A0A5K4FCH8_SCHMA Loading...

Large ribosomal subunit protein bL17m AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4FCH8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 267 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	I	39.4	Very low	38.3	Very low	213 Å²	213	155.5 Å²	155.5	100%	1.092	81%	0.809	S	S	*	*				0	102.9	0	-56.2	167.7	0	0	0	107.3
2	P	38.9	Very low	38.3	Very low	125 Å²	125	157.6 Å²	157.6	81%	0.812	82%	0.82	S	S	*	*			trans	-77.7	137.9	177.2	31.6	-27.8	0	0	0	109.4
3	K	42.4	Very low	38	Very low	204 Å²	204	157.9 Å²	157.9	89%	0.887	82%	0.822	S	S	*	*			trans	-71.2	125.1	-174.7	-65.1	175	178.5	177.4	0	110.1	S5	K3-S5 PolarHBondContact O-N 3.17Å
4	L	41.4	Very low	38.1	Very low	175 Å²	175	153.6 Å²	153.6	92%	0.916	81%	0.809	S	S	*	*			trans	-69.9	114.5	171.3	-75.2	158.5	0	0	0	109.2	S6	L4-S6 PolarHBondContact O-N 2.68Å
5	S	39.8	Very low	38	Very low	104 Å²	104	154.3 Å²	154.3	73%	0.727	81%	0.814	S	S	*	*			trans	-76.2	108.3	171.2	42.4	0	0	0	0	110	K3 F7	K3-S5 PolarHBondContact O-N 3.17Å; S5-F7 PolarHBondContact O-N 2.86Å
6	S	36	Very low	37.8	Very low	105 Å²	105	156.6 Å²	156.6	73%	0.734	82%	0.815	S	S	*	*			trans	-81.3	104.2	168.2	51.8	0	0	0	0	109.7	L4	L4-S6 PolarHBondContact O-N 2.68Å
7	F	39.5	Very low	37.7	Very low	175 Å²	175	153.6 Å²	153.6	77%	0.768	81%	0.807	S	S	*	*			trans	-113.4	100.3	163.6	-85.1	-77	0	0	0	109.9	S5 Y9	S5-F7 PolarHBondContact O-N 2.86Å; F7-Y9 PolarHBondContact O-N 3.11Å
8	S	33.1	Very low	37.5	Very low	89 Å²	89	151.7 Å²	151.7	62%	0.622	81%	0.809	S	S	*	*			trans	-68.8	112.1	169.8	-59	0	0	0	0	110.1
9	Y	37.8	Very low	37.5	Very low	223 Å²	223	150.8 Å²	150.8	88%	0.875	81%	0.81	S	S	*	*			trans	-98.9	91.2	159.4	-78.9	-83.3	0	0	0	108.1	F7	F7-Y9 PolarHBondContact O-N 3.11Å
10	Y	36.1	Very low	37.3	Very low	201 Å²	201	154.4 Å²	154.4	79%	0.788	81%	0.811	S	S	*	*			trans	-84	141.8	171.3	-87.5	-82.2	0	0	0	111.2
11	S	37.2	Very low	37.3	Very low	97 Å²	97	153.9 Å²	153.9	68%	0.678	81%	0.809	S	S	*	*			trans	61.4	102.9	141.7	63.6	0	0	0	0	120
12	L	38.6	Very low	37.3	Very low	180 Å²	180	151.4 Å²	151.4	94%	0.942	80%	0.797	S	S	*	*			trans	-149.6	81.5	135.4	-72.6	-177.6	0	0	0	108.1
13	L	33.8	Very low	37.2	Very low	162 Å²	162	156.8 Å²	156.8	85%	0.848	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-93.7	130.9	166.7	-78.6	171.8	0	0	0	108.2
14	P	40	Very low	37.2	Very low	98 Å²	98	155.2 Å²	155.2	64%	0.636	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-73.3	138.6	-178.3	29.2	-32.6	0	0	0	111.4	F16	P14-F16 PolarHBondContact O-N 3.29Å
15	D	35.3	Very low	37.2	Very low	164 Å²	164	151.3 Å²	151.3	88%	0.877	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-60.9	119.2	178.2	-63.5	-49.8	0	0	0	111.5
16	F	36.1	Very low	37.3	Very low	190 Å²	190	151.8 Å²	151.8	83%	0.833	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-85.6	130.6	175.8	-79.5	-84.7	0	0	0	110.9	P14 S18	P14-F16 PolarHBondContact O-N 3.29Å; F16-S18 PolarHBondContact O-N 3.16Å
17	P	36	Very low	37.7	Very low	106 Å²	106	150.6 Å²	150.6	69%	0.688	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-71.6	129.4	-178.7	27.2	-32	0	0	0	111.8	T19	P17-T19 PolarHBondContact O-N 3.42Å
18	S	33.3	Very low	37.8	Very low	120 Å²	120	149.4 Å²	149.4	84%	0.839	79%	0.787	S	S	*	*			trans	-64.4	90.1	174.4	177	0	0	0	0	110.9	F16	F16-S18 PolarHBondContact O-N 3.16Å
19	T	37.7	Very low	38.5	Very low	134 Å²	134	149 Å²	149	82%	0.822	79%	0.79	S	S	*	*			trans	-97.7	103.6	170.6	41.7	0	0	0	0	109.9	P17	P17-T19 PolarHBondContact O-N 3.42Å
20	R	33.8	Very low	39.1	Very low	222 Å²	222	145.9 Å²	145.9	84%	0.838	78%	0.783	S	S	*	*			trans	-66.5	140.1	168.5	-117.2	-178.1	-164.1	-170.1	5	109.5
21	L	36.2	Very low	39.2	Very low	145 Å²	145	143.8 Å²	143.8	76%	0.759	79%	0.785	S	S	*	*			trans	75.2	100.1	158.3	-52	167.9	0	0	0	116.9
22	L	40.4	Very low	39.4	Very low	161 Å²	161	144.5 Å²	144.5	84%	0.843	79%	0.788	S	S	*	*				-154.5	108.9	125.4	-83.8	-171	0	0	0	108.6	F24	L22-F24 VanDerWaalsContact C-N 3.28Å; L22-F24 PolarHBondContact O-N 3.27Å
23	R	36.6	Very low	39.5	Very low	237 Å²	237	145.1 Å²	145.1	89%	0.894	78%	0.778	S	S	*	*			trans	-74	76.5	173.7	-71.2	-178.3	174.8	-159.7	-0.1	109.6
24	F	42.2	Very low	39.8	Very low	171 Å²	171	146.8 Å²	146.8	75%	0.75	78%	0.779	S	S	*	*			trans	-138.4	117.5	160.9	-79.4	-78.6	0	0	0	107.7	L22 T26	L22-F24 VanDerWaalsContact C-N 3.28Å; L22-F24 PolarHBondContact O-N 3.27Å; F24-T26 PolarHBondContact O-N 3.18Å
25	G	41.4	Very low	40	Very low	93 Å²	93	146.6 Å²	146.6	96%	0.959	78%	0.779	S	S	*	*			trans	-69.3	37.8	-174.1	0	0	0	0	0	114.7	S27	G25-S27 PolarHBondContact O-N 3.33Å
26	T	42	Very low	40.6	Very low	115 Å²	115	142.4 Å²	142.4	71%	0.706	76%	0.763	S	S	*	*			trans	-83	107.1	166.5	53.1	0	0	0	0	107.5	F24 L28	F24-T26 PolarHBondContact O-N 3.18Å; T26-L28 PolarHBondContact O-N 3.24Å; T26-L28 VanDerWaalsContact O-N 3.08Å
27	S	43.6	Very low	41	Very low	79 Å²	79	140.5 Å²	140.5	55%	0.552	76%	0.762	S	S	*	*			trans	-41.1	117.6	172.5	174.4	0	0	0	0	110.6	G25 A29 Q30	G25-S27 PolarHBondContact O-N 3.33Å; S27-A29 PolarHBondContact O-N 3.44Å; S27-A29 WeakPolarHBondContact OG-CB 3.42Å; S27-Q30 PolarHBondContact O-N 2.99Å
28	L	41.8	Very low	41.7	Very low	150 Å²	150	143.2 Å²	143.2	79%	0.785	77%	0.765	S	S	*	*	G	3₁₀ helix	trans	-55.6	-17.9	178.6	-170.3	133.4	0	0	0	112.3	T26 Q30 L31	T26-L28 PolarHBondContact O-N 3.24Å; T26-L28 VanDerWaalsContact O-N 3.08Å; L28-Q30 PolarHBondContact O-N 3.32Å; L28-L31 PolarHBondContact O-N 3.48Å
29	A	49.3	Very low	42.3	Very low	81 Å²	81	142 Å²	142	67%	0.669	76%	0.757	S	S	*	*	G	3₁₀ helix	trans	-63.9	-15.3	172.5	0	0	0	0	0	114.2	S27	S27-A29 PolarHBondContact O-N 3.44Å; S27-A29 WeakPolarHBondContact OG-CB 3.42Å
30	Q	48.8	Very low	43.1	Very low	157 Å²	157	144.7 Å²	144.7	73%	0.734	76%	0.76	S	S	*	*	G	3₁₀ helix	trans	-87.4	-15	179.5	-154.8	158.1	-22.4	0	0	113.3	S27 L28	S27-Q30 PolarHBondContact O-N 2.99Å; L28-Q30 PolarHBondContact O-N 3.32Å
31	L	38.7	Very low	44	Very low	157 Å²	157	142.7 Å²	142.7	82%	0.822	76%	0.757	S	S	*	*	S	Bend	trans	-84.8	-17.3	-175.3	-153.6	69.5	0	0	0	114	L28	L28-L31 PolarHBondContact O-N 3.48Å
32	C	42.6	Very low	45.4	Very low	112 Å²	112	142.2 Å²	142.2	76%	0.757	76%	0.76	S	S	*	*			trans	-104.8	48.5	177.5	-66.9	0	0	0	0	112.4
33	R	40.8	Very low	47.1	Very low	193 Å²	193	137.7 Å²	137.7	73%	0.728	74%	0.742	S	S	*	*			trans	-96.8	72.1	156.5	-85.8	-174.1	-169.3	165.6	7.1	109	S35	R33-S35 PolarHBondContact O-N 3.06Å
34	K	39.8	Very low	49.5	Very low	198 Å²	198	130.9 Å²	130.9	86%	0.861	72%	0.723	S	S	*	*			trans	-60	103.7	147.3	-88.3	176.9	175.8	176.1	0	105.1	S36	K34-S36 PolarHBondContact O-N 3.04Å
35	S	44.4	Very low	52	Low	93 Å²	93	125.8 Å²	125.8	65%	0.65	70%	0.7	S	S	*	*			trans	-50.8	90.4	147.6	168.2	0	0	0	0	104.7	R33 N37	R33-S35 PolarHBondContact O-N 3.06Å; S35-N37 VanDerWaalsContact C-N 3.29Å; S35-N37 PolarHBondContact O-N 3.32Å; S35-N37 PolarHBondContact OG-OD1 2.94Å
36	S	46.5	Very low	54.4	Low	77 Å²	77	121.9 Å²	121.9	54%	0.538	66%	0.66	S	S	.	*			trans	-57.8	114.8	155.7	41	0	0	0	0	102.7	K34 Q38	K34-S36 PolarHBondContact O-N 3.04Å; S36-Q38 PolarHBondContact O-N 3.27Å
37	N	45.2	Very low	56.7	Low	149 Å²	149	118.6 Å²	118.6	80%	0.797	64%	0.644	S	S	*	*			trans	-59.6	77.1	159.4	-62.1	-16.7	0	0	0	104.1	S35 S39	S35-N37 VanDerWaalsContact C-N 3.29Å; S35-N37 PolarHBondContact O-N 3.32Å; S35-N37 PolarHBondContact OG-OD1 2.94Å; N37-S39 PolarHBondContact O-N 2.95Å
38	Q	49.9	Very low	59.1	Low	163 Å²	163	114.9 Å²	114.9	76%	0.762	62%	0.618	S	S	*	*			trans	-63.3	99.1	165.9	-67.2	-168.8	6.1	0	0	101.5	S36 E40	S36-Q38 PolarHBondContact O-N 3.27Å; Q38-E40 PolarHBondContact O-N 2.97Å; Q38-E40 VanDerWaalsContact O-N 3.16Å
39	S	46	Very low	61.5	Low	96 Å²	96	107.9 Å²	107.9	67%	0.671	58%	0.582	S	S	*	*			trans	-16.7	119	152.7	166.8	0	0	0	0	107.6	N37 K41	N37-S39 PolarHBondContact O-N 2.95Å; S39-K41 PolarHBondContact O-N 3.46Å
40	E	54.3	Low	63.6	Low	189 Å²	189	108.4 Å²	108.4	88%	0.883	58%	0.577	S	S	*	*			trans	-58.7	67.8	176.9	-70.4	176.7	151.9	0	0	109.3	Q38 V42	Q38-E40 PolarHBondContact O-N 2.97Å; Q38-E40 VanDerWaalsContact O-N 3.16Å; E40-V42 VanDerWaalsContact C-N 3.31Å; E40-V42 PolarHBondContact O-N 2.95Å
41	K	53.7	Low	65.6	Low	180 Å²	180	107.2 Å²	107.2	78%	0.783	57%	0.565	S	S	*	*			trans	-59.4	109.9	154.4	-69.7	-169	178.9	-173	0	102.1	S39 S43	S39-K41 PolarHBondContact O-N 3.46Å; K41-S43 PolarHBondContact O-N 3.44Å
42	V	65.2	Low	68.2	Low	136 Å²	136	101.5 Å²	101.5	82%	0.824	54%	0.536	S	S	*	.			trans	-51.8	96.9	170.1	179	0	0	0	0	105.5	E40 N44	E40-V42 VanDerWaalsContact C-N 3.31Å; E40-V42 PolarHBondContact O-N 2.95Å; V42-N44 PolarHBondContact O-N 3.45Å
43	S	76.9	Confident	70.5	Confident	66 Å²	66	101.1 Å²	101.1	46%	0.462	52%	0.518	S	S	.	.			trans	-75	130.4	-174.1	57.3	0	0	0	0	106.8	K41 Y45	K41-S43 PolarHBondContact O-N 3.44Å; S43-Y45 PolarHBondContact O-N 3.45Å; S43-Y45 PolarHBondContact OG-O 3.02Å
44	N	87.4	Confident	72.9	Confident	93 Å²	93	93.6 Å²	93.6	50%	0.497	49%	0.491	S	S	.	.	S	Bend	trans	-63.7	-2.1	-179.3	-71.6	-22.9	0	0	0	113.9	V42 A119 R172 F173	V42-N44 PolarHBondContact O-N 3.45Å; N44-A119 HydrophobicContact CB-CB 4.15Å; N44-R172 PolarHBondContact O-NE 2.7Å; N44-R172 PolarHBondContact O-NH2 2.97Å; N44-F173 WeakPolarHBondContact O-CE1 3.18Å
45	Y	93	Very high	75.4	Confident	65 Å²	65	90.2 Å²	90.2	26%	0.255	49%	0.489	S	S	.	.	S	Bend	trans	-142	161.7	-178.3	47.5	-106.6	0	0	0	111.2	S43 A49 T50 I115 L116 A119 R172	S43-Y45 PolarHBondContact O-N 3.45Å; S43-Y45 PolarHBondContact OG-O 3.02Å; Y45-A49 HydrophobicContact CD2-CB 3.72Å; Y45-A49 HydrophobicContact CE2-CB 4.49Å; Y45-A49 HydrophobicContact CG-CB 3.98Å; Y45-T50 HydrophobicContact CD2-CG2 4.28Å; Y45-T50 HydrophobicContact CE2-CG2 3.52Å; Y45-I115 HydrophobicContact CG-CG2 4.46Å; Y45-L116 HydrophobicContact CD1-CD2 4.03Å; Y45-L116 HydrophobicContact CD2-CD2 4.45Å; Y45-L116 HydrophobicContact CE1-CD2 3.64Å; Y45-L116 HydrophobicContact CE2-CD2 4.12Å; Y45-L116 HydrophobicContact CG-CD2 4.41Å; Y45-A119 HydrophobicContact CD1-CB 4.18Å; Y45-A119 HydrophobicContact CE1-CB 4.48Å; Y45-R172 CarbonylContact C-O 3.44Å; Y45-R172 WeakPolarHBondContact CA-O 3.42Å
46	G	92.1	Very high	77.6	Confident	11 Å²	11	89.4 Å²	89.4	11%	0.113	48%	0.48	C	S	.	.			trans	-79	169.8	-179	0	0	0	0	0	113.9	A48 A49 R172 Y174	G46-A48 PolarHBondContact O-N 3.3Å; G46-A48 VanDerWaalsContact O-N 3.11Å; G46-A49 WeakPolarHBondContact O-CB 3.44Å; G46-A49 PolarHBondContact O-N 3.18Å; G46-A49 VanDerWaalsContact O-N 3.09Å; G46-R172 PolarHBondContact N-O 3.4Å; G46-Y174 CarbonylContact C-O 3.54Å
47	A	91.1	Very high	79.6	Confident	46 Å²	46	88.6 Å²	88.6	38%	0.38	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-9.9	-172.3	0	0	0	0	0	114.4	R53 Y174	A47-R53 PolarHBondContact O-NE 3.38Å; A47-R53 VanDerWaalsContact O-NE 3.1Å; A47-R53 PolarHBondContact O-NH2 2.74Å; A47-Y174 PolarHBondContact N-O 3.01Å
48	A	93.2	Very high	81.8	Confident	1 Å²	1	87.5 Å²	87.5	1%	0.008	48%	0.478	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-21.1	173	0	0	0	0	0	113.4	G46 T50 R53 Q112 Y174 R176 Y178	G46-A48 PolarHBondContact O-N 3.3Å; G46-A48 VanDerWaalsContact O-N 3.11Å; A48-T50 VanDerWaalsContact C-N 3.35Å; A48-T50 PolarHBondContact O-N 3.3Å; A48-R53 HydrophobicContact CB-CG 4.17Å; A48-Q112 PolarHBondContact O-NE2 3.4Å; A48-Y174 WeakPolarHBondContact CB-O 3.39Å; A48-Y174 PolarHBondContact N-O 2.94Å; A48-R176 WeakPolarHBondContact CB-O 3.33Å; A48-Y178 VanDerWaalsContact C-OH 3.23Å; A48-Y178 HydrophobicContact CB-CE1 3.7Å; A48-Y178 PolarHBondContact O-OH 2.78Å
49	A	93.4	Very high	83.8	Confident	2 Å²	2	89.4 Å²	89.4	2%	0.017	48%	0.479	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-34.6	-178.8	0	0	0	0	0	112.4	Y45 G46 I115 L116 Y178	Y45-A49 HydrophobicContact CD2-CB 3.72Å; Y45-A49 HydrophobicContact CE2-CB 4.49Å; Y45-A49 HydrophobicContact CG-CB 3.98Å; G46-A49 WeakPolarHBondContact O-CB 3.44Å; G46-A49 PolarHBondContact O-N 3.18Å; G46-A49 VanDerWaalsContact O-N 3.09Å; A49-I115 HydrophobicContact CB-CB 4.47Å; A49-I115 HydrophobicContact CB-CG2 3.84Å; A49-L116 HydrophobicContact CB-CD2 4.33Å; A49-Y178 VanDerWaalsContact CA-OH 3.29Å; A49-Y178 WeakPolarHBondContact CA-OH 3.35Å; A49-Y178 PolarHBondContact N-OH 3.48Å
50	T	91.7	Very high	85.9	Confident	93 Å²	93	89.2 Å²	89.2	57%	0.571	48%	0.475	S	S	*	.	S	Bend	trans	-85.1	-24.8	-176.5	56.1	0	0	0	0	114.1	Y45 A48	Y45-T50 HydrophobicContact CD2-CG2 4.28Å; Y45-T50 HydrophobicContact CE2-CG2 3.52Å; A48-T50 VanDerWaalsContact C-N 3.35Å; A48-T50 PolarHBondContact O-N 3.3Å
51	R	92.4	Very high	87.5	Confident	131 Å²	131	82.5 Å²	82.5	49%	0.494	45%	0.445	S	S	.	.	S	Bend	trans	-154.2	141.2	-178	-167.8	-177.1	73.9	-175.1	-2.4	111.8	R53	R51-R53 PolarHBondContact O-N 3.42Å
52	L	92.3	Very high	89	Confident	38 Å²	38	84.1 Å²	84.1	20%	0.199	45%	0.446	C	S	.	.			trans	-58.9	131.7	170.5	-62.7	173.3	0	0	0	111	F54 V56 L105 E108	L52-F54 HydrophobicContact CB-CE1 4.18Å; L52-F54 HydrophobicContact CD1-CZ 4.42Å; L52-F54 HydrophobicContact CD2-CE1 4.01Å; L52-F54 HydrophobicContact CD2-CZ 4.27Å; L52-V56 HydrophobicContact CB-CG2 4.24Å; L52-V56 HydrophobicContact CD1-CG2 3.7Å; L52-L105 HydrophobicContact CD1-CD2 4.27Å; L52-E108 HydrophobicContact CD2-CB 3.45Å; L52-E108 VanDerWaalsContact CD2-CB 3.45Å; L52-E108 HydrophobicContact CD2-CG 4.38Å
53	R	91.9	Very high	90	Very high	104 Å²	104	78.4 Å²	78.4	39%	0.392	41%	0.411	S	S	.	.	S	Bend	trans	-98.1	28.2	-173.2	-68.7	-78.7	170	170.7	-4.6	113.2	A47 A48 R51	A47-R53 PolarHBondContact O-NE 3.38Å; A47-R53 VanDerWaalsContact O-NE 3.1Å; A47-R53 PolarHBondContact O-NH2 2.74Å; A48-R53 HydrophobicContact CB-CG 4.17Å; R51-R53 PolarHBondContact O-N 3.42Å
54	F	91.5	Very high	90	Very high	34 Å²	34	82.6 Å²	82.6	15%	0.149	42%	0.421	C	S	.	.	S	Bend	trans	-146.7	158.3	175.5	60.5	-88.3	0	0	0	109.5	L52 V56 R104 L105 E108	L52-F54 HydrophobicContact CB-CE1 4.18Å; L52-F54 HydrophobicContact CD1-CZ 4.42Å; L52-F54 HydrophobicContact CD2-CE1 4.01Å; L52-F54 HydrophobicContact CD2-CZ 4.27Å; F54-V56 HydrophobicContact CD2-CG2 4.44Å; F54-V56 HydrophobicContact CE2-CG2 4.14Å; F54-V56 PolarHBondContact O-N 3.34Å; F54-R104 HydrophobicContact CE1-CG 4.06Å; F54-R104 HydrophobicContact CE2-CG 3.9Å; F54-R104 HydrophobicContact CZ-CG 3.52Å; F54-L105 HydrophobicContact CE2-CD2 3.44Å; F54-L105 VanDerWaalsContact CE2-CD2 3.44Å; F54-L105 HydrophobicContact CE2-CG 4.34Å; F54-L105 HydrophobicContact CZ-CD2 3.71Å; F54-E108 HydrophobicContact CE1-CB 4.26Å; F54-E108 HydrophobicContact CE1-CG 3.69Å; F54-E108 HydrophobicContact CZ-CG 4.13Å
55	P	91.2	Very high	89.5	Confident	127 Å²	127	87.9 Å²	87.9	83%	0.825	43%	0.434	S	S	*	.			trans	-65.1	129.1	180	26.3	-34.5	0	0	0	111
56	V	91.1	Very high	88.8	Confident	76 Å²	76	85.8 Å²	85.8	46%	0.461	43%	0.429	S	S	.	.			trans	-107.2	130.1	177	-178.9	0	0	0	0	108.8	L52 F54 L105	L52-V56 HydrophobicContact CB-CG2 4.24Å; L52-V56 HydrophobicContact CD1-CG2 3.7Å; F54-V56 HydrophobicContact CD2-CG2 4.44Å; F54-V56 HydrophobicContact CE2-CG2 4.14Å; F54-V56 PolarHBondContact O-N 3.34Å; V56-L105 HydrophobicContact CB-CD2 4.15Å; V56-L105 HydrophobicContact CG1-CD1 4.36Å; V56-L105 HydrophobicContact CG1-CD2 3.64Å; V56-L105 HydrophobicContact CG2-CD2 3.64Å
57	S	89	Confident	88.4	Confident	60 Å²	60	89.1 Å²	89.1	42%	0.42	44%	0.442	S	S	.	.			trans	-69	138.2	175.2	57.1	0	0	0	0	110.6	R59	S57-R59 WeakPolarHBondContact CB-O 3.3Å; S57-R59 PolarHBondContact O-N 2.94Å; S57-R59 PolarHBondContact OG-O 2.99Å
58	S	90.5	Very high	88	Confident	126 Å²	126	88.5 Å²	88.5	88%	0.881	44%	0.44	S	S	*	.	S	Bend	trans	-65.1	-27	178.6	58.1	0	0	0	0	113.2
59	R	92.7	Very high	87.4	Confident	204 Å²	204	95.2 Å²	95.2	77%	0.77	48%	0.48	S	S	*	.	S	Bend	trans	-112.2	141.1	175.2	-65.7	-178.9	179.6	163.1	-0.1	109.6	S57	S57-R59 WeakPolarHBondContact CB-O 3.3Å; S57-R59 PolarHBondContact O-N 2.94Å; S57-R59 PolarHBondContact OG-O 2.99Å
60	P	88.6	Confident	86.7	Confident	92 Å²	92	98.9 Å²	98.9	60%	0.597	52%	0.518	S	S	*	.			trans	-67	144.7	173.7	27.9	-33.6	0	0	0	110.8	E102	P60-E102 WeakPolarHBondContact CA-OE1 3.15Å; P60-E102 WeakPolarHBondContact CB-OE1 3.41Å
61	I	89.4	Confident	86.2	Confident	47 Å²	47	95.6 Å²	95.6	24%	0.241	50%	0.504	C	S	.	.			trans	-69.6	134.8	174.8	-59.1	173.7	0	0	0	109.2	L63 I101 E102	I61-L63 PolarHBondContact O-N 2.91Å; I61-I101 HydrophobicContact CD1-CB 3.72Å; I61-I101 HydrophobicContact CD1-CD1 3.89Å; I61-I101 HydrophobicContact CD1-CG1 4.43Å; I61-I101 HydrophobicContact CD1-CG2 3.49Å; I61-I101 VanDerWaalsContact CD1-CG2 3.49Å; I61-E102 HydrophobicContact CB-CG 3.93Å; I61-E102 HydrophobicContact CD1-CG 4.48Å; I61-E102 HydrophobicContact CG1-CG 4.44Å; I61-E102 PolarHBondContact N-OE1 3.21Å
62	R	85.2	Confident	86.1	Confident	214 Å²	214	92.3 Å²	92.3	81%	0.808	51%	0.51	S	S	*	.			trans	-74.1	107.4	178.9	-171.7	176.2	-177.9	178.7	1.5	110.9	K64	R62-K64 PolarHBondContact O-N 3.48Å
63	L	86.3	Confident	85.9	Confident	16 Å²	16	96.1 Å²	96.1	8%	0.084	54%	0.535	C	S	.	.			trans	-85	99	172.9	-53.7	-174.2	0	0	0	110	I61 R65 R76 L79 L80 H99 E102	I61-L63 PolarHBondContact O-N 2.91Å; L63-R65 PolarHBondContact O-N 2.92Å; L63-R76 HydrophobicContact CD1-CG 4.11Å; L63-L79 HydrophobicContact CD1-CD2 4.43Å; L63-L80 HydrophobicContact CD1-CD1 4.43Å; L63-L80 HydrophobicContact CD1-CD2 4.05Å; L63-L80 HydrophobicContact CD1-CG 4.17Å; L63-H99 HydrophobicContact CD2-CB 4.47Å; L63-E102 HydrophobicContact CD2-CG 4.43Å
64	K	76.6	Confident	85.9	Confident	154 Å²	154	96 Å²	96	67%	0.67	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	124.8	178.2	-69	-176.9	179.5	179.4	0	109.8	R62	R62-K64 PolarHBondContact O-N 3.48Å
65	R	76.3	Confident	86	Confident	205 Å²	205	94.5 Å²	94.5	77%	0.774	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.9	64.9	176.2	-56	179.5	-176.9	163.1	-0.5	112.7	L63	L63-R65 PolarHBondContact O-N 2.92Å
66	A	79.1	Confident	86.1	Confident	20 Å²	20	90.3 Å²	90.3	17%	0.165	51%	0.507	C	S	.	.	S	Bend	trans	-61.3	-76.3	-174.1	0	0	0	0	0	113.1	G68 G75 R76 L79	A66-G68 VanDerWaalsContact C-N 3.27Å; A66-G75 VanDerWaalsContact CB-O 3.29Å; A66-G75 WeakPolarHBondContact CB-O 3.25Å; A66-R76 VanDerWaalsContact CB-CA 3.48Å; A66-R76 HydrophobicContact CB-CB 4.23Å; A66-L79 HydrophobicContact CB-CB 3.98Å; A66-L79 HydrophobicContact CB-CD2 3.78Å
67	E	82.7	Confident	86.2	Confident	82 Å²	82	89.4 Å²	89.4	38%	0.383	50%	0.499	S	S	.	.	S	Bend	trans	-92.2	15.7	169.5	-78.7	-167.9	144.4	0	0	113.3	G75 M78 L79 R82	E67-G75 WeakPolarHBondContact CG-O 3.44Å; E67-M78 HydrophobicContact CG-CB 4.18Å; E67-M78 WeakPolarHBondContact OE1-CB 3.47Å; E67-M78 WeakPolarHBondContact OE2-CB 3.46Å; E67-L79 HydrophobicContact CG-CB 4.47Å; E67-R82 IonicContact OE1-CZ 3.38Å; E67-R82 VanDerWaalsContact OE1-CZ 3.3Å; E67-R82 IonicContact OE1-NE 3.22Å; E67-R82 PolarHBondContact OE1-NE 2.77Å; E67-R82 IonicContact OE1-NH2 2.68Å; E67-R82 PolarHBondContact OE1-NH2 3.04Å
68	G	82.9	Confident	86.5	Confident	32 Å²	32	89.1 Å²	89.1	33%	0.33	49%	0.491	S	S	.	.	S	Bend	trans	118.9	-162.6	-176.5	0	0	0	0	0	113.1	A66	A66-G68 VanDerWaalsContact C-N 3.27Å
69	V	79.9	Confident	86.7	Confident	142 Å²	142	83.9 Å²	83.9	86%	0.861	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	132	-179.9	-175.4	0	0	0	0	108.7	G71	V69-G71 PolarHBondContact O-N 3.49Å
70	G	79.9	Confident	86.9	Confident	79 Å²	79	74.1 Å²	74.1	81%	0.814	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.7	-1.4	177.7	0	0	0	0	0	116.2	G72	G70-G72 VanDerWaalsContact C-N 3.25Å; G70-G72 PolarHBondContact O-N 2.9Å; G70-G72 VanDerWaalsContact O-N 3.16Å
71	G	81.8	Confident	87.3	Confident	25 Å²	25	72.6 Å²	72.6	26%	0.258	40%	0.399	S	S	.	.			trans	-63.9	-22.4	-176.2	0	0	0	0	0	115.7	V69 T74 G75	V69-G71 PolarHBondContact O-N 3.49Å; G71-T74 PolarHBondContact O-N 3.29Å; G71-G75 WeakPolarHBondContact O-CA 3.41Å; G71-G75 PolarHBondContact O-N 2.87Å
72	G	88.7	Confident	87.6	Confident	61 Å²	61	77.4 Å²	77.4	63%	0.629	41%	0.414	S	S	*	.	H	α-helix	trans	54.5	-142.1	177.9	0	0	0	0	0	113.7	G70 R76	G70-G72 VanDerWaalsContact C-N 3.25Å; G70-G72 PolarHBondContact O-N 2.9Å; G70-G72 VanDerWaalsContact O-N 3.16Å; G72-R76 PolarHBondContact O-N 3.01Å
73	V	89.8	Confident	88.2	Confident	119 Å²	119	69.6 Å²	69.6	72%	0.721	39%	0.385	S	S	*	.	H	α-helix	trans	-71.3	-39.3	178.1	-178.8	0	0	0	0	111.3	R76 M77	V73-R76 WeakPolarHBondContact O-CB 3.38Å; V73-R76 PolarHBondContact O-N 3.09Å; V73-M77 PolarHBondContact O-N 3.38Å
74	T	91.7	Very high	88.8	Confident	101 Å²	101	68.9 Å²	68.9	62%	0.62	38%	0.381	S	S	*	.	H	α-helix	trans	-62.4	-48.6	-179.8	-51.8	0	0	0	0	111.9	G71 R76 M77 M78	G71-T74 PolarHBondContact O-N 3.29Å; T74-R76 VanDerWaalsContact C-N 3.28Å; T74-R76 PolarHBondContact O-N 2.86Å; T74-M77 WeakPolarHBondContact O-CB 3.31Å; T74-M77 PolarHBondContact O-N 2.94Å; T74-M77 VanDerWaalsContact O-N 3.07Å; T74-M78 WeakPolarHBondContact O-CG 3.32Å; T74-M78 PolarHBondContact O-N 2.94Å
75	G	92.4	Very high	89.8	Confident	2 Å²	2	61.9 Å²	61.9	2%	0.021	35%	0.352	C	S	.	.	H	α-helix	trans	-64.8	-31.1	176.4	0	0	0	0	0	112.5	A66 E67 G71 L79	A66-G75 VanDerWaalsContact CB-O 3.29Å; A66-G75 WeakPolarHBondContact CB-O 3.25Å; E67-G75 WeakPolarHBondContact CG-O 3.44Å; G71-G75 WeakPolarHBondContact O-CA 3.41Å; G71-G75 PolarHBondContact O-N 2.87Å; G75-L79 WeakPolarHBondContact O-CB 3.4Å; G75-L79 PolarHBondContact O-N 3.17Å
76	R	93	Very high	90.9	Very high	40 Å²	40	56.5 Å²	56.5	15%	0.151	33%	0.334	C	S	.	.	H	α-helix	trans	-62	-46.7	170.2	-176.1	-172.2	172.7	-81.3	3.9	110.8	L63 A66 G72 V73 T74 L79 L80 E102 Y106	L63-R76 HydrophobicContact CD1-CG 4.11Å; A66-R76 VanDerWaalsContact CB-CA 3.48Å; A66-R76 HydrophobicContact CB-CB 4.23Å; G72-R76 PolarHBondContact O-N 3.01Å; V73-R76 WeakPolarHBondContact O-CB 3.38Å; V73-R76 PolarHBondContact O-N 3.09Å; T74-R76 VanDerWaalsContact C-N 3.28Å; T74-R76 PolarHBondContact O-N 2.86Å; R76-L79 PolarHBondContact O-N 2.76Å; R76-L80 HydrophobicContact CG-CD1 4.14Å; R76-L80 VanDerWaalsContact NH1-CD1 3.26Å; R76-L80 WeakPolarHBondContact O-CG 3.27Å; R76-L80 PolarHBondContact O-N 3.03Å; R76-L80 VanDerWaalsContact O-N 3.13Å; R76-E102 IonicContact CZ-OE2 2.88Å; R76-E102 IonicContact NH2-OE1 2.77Å; R76-E102 PolarHBondContact NH2-OE1 3.18Å; R76-E102 IonicContact NH2-OE2 2.91Å; R76-E102 PolarHBondContact NH2-OE2 3.08Å; R76-Y106 PolarHBondContact NH1-OH 2.56Å
77	M	94.5	Very high	91.8	Very high	57 Å²	57	55.6 Å²	55.6	28%	0.281	33%	0.326	S	S	.	.	H	α-helix	trans	-61.5	-48.2	179.9	-170.4	65.2	77.9	0	0	111.4	V73 T74 L79 L80 R81 F152 W153	V73-M77 PolarHBondContact O-N 3.38Å; T74-M77 WeakPolarHBondContact O-CB 3.31Å; T74-M77 PolarHBondContact O-N 2.94Å; T74-M77 VanDerWaalsContact O-N 3.07Å; M77-L79 PolarHBondContact O-N 3.19Å; M77-L80 PolarHBondContact O-N 3.17Å; M77-R81 PolarHBondContact O-N 3.15Å; M77-F152 HydrophobicContact CG-CE1 4.15Å; M77-F152 HydrophobicContact CG-CZ 3.89Å; M77-F152 HydrophobicContact SD-CE1 4.42Å; M77-W153 HydrophobicContact SD-CH2 3.36Å; M77-W153 WeakPolarHBondContact SD-CH2 3.42Å; M77-W153 HydrophobicContact SD-CZ2 3.75Å; M77-W153 HydrophobicContact SD-CZ3 4.24Å
78	M	95.3	Very high	92.5	Very high	53 Å²	53	51.7 Å²	51.7	26%	0.261	31%	0.308	S	S	.	.	H	α-helix	trans	-68.7	-32.8	-178.6	-66.2	-63.2	167.3	0	0	112.9	E67 T74 R81 R82 F152	E67-M78 HydrophobicContact CG-CB 4.18Å; E67-M78 WeakPolarHBondContact OE1-CB 3.47Å; E67-M78 WeakPolarHBondContact OE2-CB 3.46Å; T74-M78 WeakPolarHBondContact O-CG 3.32Å; T74-M78 PolarHBondContact O-N 2.94Å; M78-R81 WeakPolarHBondContact O-CB 3.47Å; M78-R81 PolarHBondContact O-N 3.45Å; M78-R82 WeakPolarHBondContact O-CG 3.14Å; M78-R82 PolarHBondContact O-N 2.73Å; M78-R82 VanDerWaalsContact O-N 3.13Å; M78-F152 HydrophobicContact CE-CE2 4.22Å; M78-F152 HydrophobicContact CE-CZ 4.45Å
79	L	94.3	Very high	93.2	Very high	16 Å²	16	51.9 Å²	51.9	8%	0.084	30%	0.302	C	S	.	.	H	α-helix	trans	-61.6	-45.8	170.4	178.3	64.2	0	0	0	111.6	L63 A66 E67 G75 R76 M77 R81 R82 Y83	L63-L79 HydrophobicContact CD1-CD2 4.43Å; A66-L79 HydrophobicContact CB-CB 3.98Å; A66-L79 HydrophobicContact CB-CD2 3.78Å; E67-L79 HydrophobicContact CG-CB 4.47Å; G75-L79 WeakPolarHBondContact O-CB 3.4Å; G75-L79 PolarHBondContact O-N 3.17Å; R76-L79 PolarHBondContact O-N 2.76Å; M77-L79 PolarHBondContact O-N 3.19Å; L79-R81 VanDerWaalsContact C-N 3.33Å; L79-R82 PolarHBondContact O-N 2.74Å; L79-Y83 HydrophobicContact CD1-CD2 4.24Å; L79-Y83 HydrophobicContact CD1-CE1 4.41Å; L79-Y83 HydrophobicContact CD1-CE2 3.52Å; L79-Y83 HydrophobicContact CD2-CE2 3.89Å; L79-Y83 HydrophobicContact CG-CD2 4.03Å; L79-Y83 HydrophobicContact CG-CE2 3.49Å; L79-Y83 VanDerWaalsContact CG-CE2 3.49Å; L79-Y83 WeakPolarHBondContact O-CD2 3.47Å; L79-Y83 PolarHBondContact O-N 3.16Å
80	L	96.1	Very high	94.1	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-65.9	-37.5	178.4	-71.4	164.7	0	0	0	111.7	L63 R76 M77 R82 Y83 V84 E102 Y106 W153	L63-L80 HydrophobicContact CD1-CD1 4.43Å; L63-L80 HydrophobicContact CD1-CD2 4.05Å; L63-L80 HydrophobicContact CD1-CG 4.17Å; R76-L80 HydrophobicContact CG-CD1 4.14Å; R76-L80 VanDerWaalsContact NH1-CD1 3.26Å; R76-L80 WeakPolarHBondContact O-CG 3.27Å; R76-L80 PolarHBondContact O-N 3.03Å; R76-L80 VanDerWaalsContact O-N 3.13Å; M77-L80 PolarHBondContact O-N 3.17Å; L80-R82 VanDerWaalsContact C-N 3.32Å; L80-R82 PolarHBondContact O-N 3.26Å; L80-Y83 PolarHBondContact O-N 3.21Å; L80-V84 WeakPolarHBondContact O-CG2 3.46Å; L80-V84 PolarHBondContact O-N 2.77Å; L80-E102 HydrophobicContact CD2-CB 3.81Å; L80-Y106 HydrophobicContact CD1-CD2 3.84Å; L80-Y106 HydrophobicContact CD1-CE2 3.39Å; L80-Y106 HydrophobicContact CD2-CD2 4.27Å; L80-Y106 HydrophobicContact CD2-CE2 4.49Å; L80-Y106 HydrophobicContact CG-CD2 4.46Å; L80-Y106 HydrophobicContact CG-CE2 4.44Å; L80-W153 HydrophobicContact CB-CZ3 4.12Å
81	R	97.4	Very high	94.9	Very high	59 Å²	59	44.4 Å²	44.4	22%	0.223	24%	0.238	C	C	.	.	H	α-helix	trans	-52.4	-50.2	171.5	-174.7	-171.4	-172.4	163.6	17.7	111.1	M77 M78 L79 Y83 V84 S85 V151 F152 W153	M77-R81 PolarHBondContact O-N 3.15Å; M78-R81 WeakPolarHBondContact O-CB 3.47Å; M78-R81 PolarHBondContact O-N 3.45Å; L79-R81 VanDerWaalsContact C-N 3.33Å; R81-Y83 VanDerWaalsContact C-N 3.35Å; R81-Y83 PolarHBondContact O-N 3.23Å; R81-V84 PolarHBondContact O-N 3.05Å; R81-S85 WeakPolarHBondContact O-CB 3.24Å; R81-S85 PolarHBondContact O-N 2.63Å; R81-V151 PolarHBondContact NH2-O 3.04Å; R81-F152 VanDerWaalsContact CD-O 3.31Å; R81-F152 WeakPolarHBondContact CD-O 3.45Å; R81-F152 WeakPolarHBondContact CG-O 3.44Å; R81-F152 PolarHBondContact NE-O 3.48Å; R81-F152 PolarHBondContact NH2-O 2.6Å; R81-W153 HydrophobicContact CB-CE3 4.48Å; R81-W153 WeakPolarHBondContact CG-O 3.42Å
82	R	96.4	Very high	95.7	Very high	149 Å²	149	46.3 Å²	46.3	56%	0.562	24%	0.237	S	C	*	.	H	α-helix	trans	-59.7	-43.8	178.2	-65.3	174.4	-163.4	-157.3	2.4	112	E67 M78 L79 L80 K86	E67-R82 IonicContact OE1-CZ 3.38Å; E67-R82 VanDerWaalsContact OE1-CZ 3.3Å; E67-R82 IonicContact OE1-NE 3.22Å; E67-R82 PolarHBondContact OE1-NE 2.77Å; E67-R82 IonicContact OE1-NH2 2.68Å; E67-R82 PolarHBondContact OE1-NH2 3.04Å; M78-R82 WeakPolarHBondContact O-CG 3.14Å; M78-R82 PolarHBondContact O-N 2.73Å; M78-R82 VanDerWaalsContact O-N 3.13Å; L79-R82 PolarHBondContact O-N 2.74Å; L80-R82 VanDerWaalsContact C-N 3.32Å; L80-R82 PolarHBondContact O-N 3.26Å; R82-K86 WeakPolarHBondContact O-CB 3.45Å; R82-K86 PolarHBondContact O-N 3.22Å
83	Y	97.3	Very high	96	Very high	50 Å²	50	44 Å²	44	20%	0.196	21%	0.21	C	C	.	.	H	α-helix	trans	-70.3	-39.6	179.4	-66.2	-40.9	0	0	0	113.6	L79 L80 R81 S85 K86 L87 L95 H99 T103	L79-Y83 HydrophobicContact CD1-CD2 4.24Å; L79-Y83 HydrophobicContact CD1-CE1 4.41Å; L79-Y83 HydrophobicContact CD1-CE2 3.52Å; L79-Y83 HydrophobicContact CD2-CE2 3.89Å; L79-Y83 HydrophobicContact CG-CD2 4.03Å; L79-Y83 HydrophobicContact CG-CE2 3.49Å; L79-Y83 VanDerWaalsContact CG-CE2 3.49Å; L79-Y83 WeakPolarHBondContact O-CD2 3.47Å; L79-Y83 PolarHBondContact O-N 3.16Å; L80-Y83 PolarHBondContact O-N 3.21Å; R81-Y83 VanDerWaalsContact C-N 3.35Å; R81-Y83 PolarHBondContact O-N 3.23Å; Y83-S85 VanDerWaalsContact C-N 3.34Å; Y83-K86 PolarHBondContact O-N 3.37Å; Y83-L87 VanDerWaalsContact O-CB 3.32Å; Y83-L87 WeakPolarHBondContact O-CB 3.4Å; Y83-L87 PolarHBondContact O-N 2.91Å; Y83-L95 HydrophobicContact CD1-CD1 3.95Å; Y83-L95 HydrophobicContact CD1-CD2 3.42Å; Y83-L95 VanDerWaalsContact CD1-CD2 3.42Å; Y83-L95 HydrophobicContact CD1-CG 4.34Å; Y83-L95 HydrophobicContact CD2-CD1 4.13Å; Y83-L95 HydrophobicContact CE1-CD1 4.37Å; Y83-L95 HydrophobicContact CE1-CD2 3.2Å; Y83-L95 HydrophobicContact CE1-CG 4.42Å; Y83-L95 HydrophobicContact CE2-CD2 4.41Å; Y83-L95 HydrophobicContact CG-CD1 3.82Å; Y83-L95 HydrophobicContact CG-CD2 4.13Å; Y83-H99 HydrophobicContact CE2-CB 4Å; Y83-H99 AromaticContact CE2-CD2 3.77Å; Y83-T103 WeakPolarHBondContact CB-OG1 3.36Å
84	V	98.4	Very high	96.2	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-63.9	-43.9	175.1	172.6	0	0	0	0	110	L80 R81 K86 L87 L88 T103 A107 L110 W153	L80-V84 WeakPolarHBondContact O-CG2 3.46Å; L80-V84 PolarHBondContact O-N 2.77Å; R81-V84 PolarHBondContact O-N 3.05Å; V84-K86 PolarHBondContact O-N 3.2Å; V84-L87 PolarHBondContact O-N 3.38Å; V84-L88 PolarHBondContact O-N 3.4Å; V84-T103 HydrophobicContact CG2-CG2 3.98Å; V84-A107 HydrophobicContact CG1-CB 4.48Å; V84-A107 HydrophobicContact CG2-CB 4.46Å; V84-L110 HydrophobicContact CG1-CD2 3.93Å; V84-W153 HydrophobicContact CB-CE3 4.29Å; V84-W153 HydrophobicContact CG2-CE3 4.15Å; V84-W153 HydrophobicContact CG2-CZ3 4.31Å
85	S	98.4	Very high	96.2	Very high	8 Å²	8	39.3 Å²	39.3	6%	0.056	17%	0.174	C	C	.	.	H	α-helix	trans	-58.3	-47.2	174.4	-161.3	0	0	0	0	111.2	R81 Y83 L88 D89 T155 L159	R81-S85 WeakPolarHBondContact O-CB 3.24Å; R81-S85 PolarHBondContact O-N 2.63Å; Y83-S85 VanDerWaalsContact C-N 3.34Å; S85-L88 PolarHBondContact O-N 2.75Å; S85-D89 WeakPolarHBondContact O-CB 3.37Å; S85-D89 PolarHBondContact O-N 2.79Å; S85-T155 PolarHBondContact OG-N 2.67Å; S85-L159 WeakPolarHBondContact OG-CD1 3.38Å
86	K	98.4	Very high	96.1	Very high	92 Å²	92	40.4 Å²	40.4	40%	0.4	18%	0.18	S	C	.	.	H	α-helix	trans	-68.1	-35.1	179.4	-166	50.6	167.1	153	0	113.1	R82 Y83 V84 D89 D90 I93	R82-K86 WeakPolarHBondContact O-CB 3.45Å; R82-K86 PolarHBondContact O-N 3.22Å; Y83-K86 PolarHBondContact O-N 3.37Å; V84-K86 PolarHBondContact O-N 3.2Å; K86-D89 IonicContact NZ-OD2 3.02Å; K86-D89 PolarHBondContact O-N 3.48Å; K86-D90 WeakPolarHBondContact CD-OD2 3.49Å; K86-D90 WeakPolarHBondContact CE-OD2 3.32Å; K86-D90 IonicContact NZ-OD1 3.09Å; K86-D90 PolarHBondContact NZ-OD1 2.85Å; K86-D90 IonicContact NZ-OD2 3.53Å; K86-D90 PolarHBondContact NZ-OD2 2.93Å; K86-D90 PolarHBondContact O-N 3.42Å; K86-I93 HydrophobicContact CB-CG2 4.36Å; K86-I93 HydrophobicContact CG-CG2 3.91Å
87	L	98.4	Very high	96.1	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-62.8	-45.5	175.1	178.5	63.7	0	0	0	111.7	Y83 V84 D89 E91 I93 A107 T179 L202 L204	Y83-L87 VanDerWaalsContact O-CB 3.32Å; Y83-L87 WeakPolarHBondContact O-CB 3.4Å; Y83-L87 PolarHBondContact O-N 2.91Å; V84-L87 PolarHBondContact O-N 3.38Å; L87-D89 VanDerWaalsContact C-N 3.31Å; L87-E91 WeakPolarHBondContact O-CA 3.42Å; L87-E91 PolarHBondContact O-N 3Å; L87-I93 HydrophobicContact CB-CD1 3.79Å; L87-I93 HydrophobicContact CB-CG1 4.34Å; L87-I93 HydrophobicContact CD1-CD1 4.27Å; L87-I93 HydrophobicContact CD1-CG1 3.95Å; L87-A107 HydrophobicContact CD2-CB 3.56Å; L87-T179 HydrophobicContact CD2-CG2 4.45Å; L87-L202 HydrophobicContact CD1-CB 4.47Å; L87-L202 HydrophobicContact CD1-CD2 4.23Å; L87-L202 HydrophobicContact CD1-CG 3.87Å; L87-L202 WeakPolarHBondContact CD1-O 3.41Å; L87-L202 HydrophobicContact CD2-CD2 3.65Å; L87-L202 HydrophobicContact CD2-CG 3.99Å; L87-L204 HydrophobicContact CD1-CG 4.32Å; L87-L204 HydrophobicContact CG-CD1 4.45Å; L87-L204 HydrophobicContact CG-CG 4.3Å
88	L	97.9	Very high	95.9	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-71.5	-28.8	179.4	-68.9	-174.3	0	0	0	112	V84 S85 L110 I111 L154 K162 L163 F167 L204	V84-L88 PolarHBondContact O-N 3.4Å; S85-L88 PolarHBondContact O-N 2.75Å; L88-L110 HydrophobicContact CD1-CD2 3.85Å; L88-I111 HydrophobicContact CD2-CD1 4.44Å; L88-L154 HydrophobicContact CB-CD2 4.15Å; L88-L154 HydrophobicContact CD1-CD1 4.04Å; L88-L154 HydrophobicContact CD1-CD2 3.5Å; L88-L154 HydrophobicContact CD1-CG 4.22Å; L88-L154 HydrophobicContact CG-CD2 4.29Å; L88-K162 WeakPolarHBondContact O-CE 3.19Å; L88-K162 PolarHBondContact O-NZ 2.99Å; L88-L163 HydrophobicContact CD1-CD1 4.14Å; L88-F167 HydrophobicContact CB-CE2 3.94Å; L88-F167 HydrophobicContact CD2-CD2 3.85Å; L88-F167 HydrophobicContact CD2-CE2 3.71Å; L88-F167 HydrophobicContact CD2-CZ 4.26Å; L88-F167 HydrophobicContact CG-CE2 4.34Å; L88-F167 WeakPolarHBondContact O-CE2 3.31Å; L88-F167 WeakPolarHBondContact O-CZ 3.31Å; L88-L204 HydrophobicContact CD2-CD1 3.77Å
89	D	97.7	Very high	95.8	Very high	36 Å²	36	38.7 Å²	38.7	19%	0.193	17%	0.173	C	C	.	.	H	α-helix	trans	-67	-62.4	173.6	-166.5	17.9	0	0	0	111.7	S85 K86 L87 R158 L159 K162	S85-D89 WeakPolarHBondContact O-CB 3.37Å; S85-D89 PolarHBondContact O-N 2.79Å; K86-D89 IonicContact NZ-OD2 3.02Å; K86-D89 PolarHBondContact O-N 3.48Å; L87-D89 VanDerWaalsContact C-N 3.31Å; D89-R158 VanDerWaalsContact CG-NH2 3.26Å; D89-R158 IonicContact OD1-CZ 2.63Å; D89-R158 IonicContact OD1-NH1 3.33Å; D89-R158 PolarHBondContact OD1-NH1 2.79Å; D89-R158 IonicContact OD1-NH2 3.3Å; D89-R158 PolarHBondContact OD1-NH2 3.31Å; D89-R158 IonicContact OD2-CZ 3.09Å; D89-R158 IonicContact OD2-NH1 3.31Å; D89-R158 IonicContact OD2-NH2 2.79Å; D89-R158 PolarHBondContact OD2-NH2 2.78Å; D89-L159 HydrophobicContact CB-CD1 4.32Å; D89-L159 HydrophobicContact CB-CD2 3.69Å; D89-K162 PolarHBondContact O-NZ 2.79Å
90	D	97.9	Very high	95.9	Very high	51 Å²	51	38 Å²	38	27%	0.273	17%	0.169	S	C	.	.	H	α-helix	trans	-84.6	-16.6	-171.5	-65.2	-12.4	0	0	0	113.4	K86 R92 I93 W209	K86-D90 WeakPolarHBondContact CD-OD2 3.49Å; K86-D90 WeakPolarHBondContact CE-OD2 3.32Å; K86-D90 IonicContact NZ-OD1 3.09Å; K86-D90 PolarHBondContact NZ-OD1 2.85Å; K86-D90 IonicContact NZ-OD2 3.53Å; K86-D90 PolarHBondContact NZ-OD2 2.93Å; K86-D90 PolarHBondContact O-N 3.42Å; D90-R92 WeakPolarHBondContact CB-O 3.11Å; D90-R92 PolarHBondContact O-N 2.93Å; D90-I93 HydrophobicContact CB-CG2 4.3Å; D90-W209 PolarHBondContact O-NE1 3.02Å
91	E	97.9	Very high	95.8	Very high	13 Å²	13	40 Å²	40	6%	0.061	18%	0.179	C	C	.	.	S	Bend	trans	61	-4.7	-171.5	-50	-166.2	-171.9	0	0	115.5	L87 K162 F167 R170 E203 L204 N207 P208	L87-E91 WeakPolarHBondContact O-CA 3.42Å; L87-E91 PolarHBondContact O-N 3Å; E91-K162 VanDerWaalsContact OE1-CE 3.32Å; E91-K162 WeakPolarHBondContact OE1-CE 3Å; E91-K162 IonicContact OE1-NZ 2.72Å; E91-K162 PolarHBondContact OE1-NZ 3.31Å; E91-K162 VanDerWaalsContact OE1-NZ 3.1Å; E91-F167 HydrophobicContact CG-CE1 4.1Å; E91-F167 HydrophobicContact CG-CZ 3.84Å; E91-R170 IonicContact OE1-CZ 2.7Å; E91-R170 IonicContact OE1-NH1 3.15Å; E91-R170 IonicContact OE1-NH2 3.63Å; E91-R170 PolarHBondContact OE1-NH2 3.23Å; E91-R170 IonicContact OE2-CZ 3.98Å; E91-R170 IonicContact OE2-NH1 2.78Å; E91-R170 PolarHBondContact OE2-NH1 3.43Å; E91-R170 IonicContact OE2-NH2 3.1Å; E91-E203 WeakPolarHBondContact O-CA 3.14Å; E91-L204 HydrophobicContact CB-CB 4.31Å; E91-L204 HydrophobicContact CB-CD1 4.29Å; E91-L204 HydrophobicContact CG-CD1 4.29Å; E91-L204 PolarHBondContact O-N 3.35Å; E91-N207 HydrophobicContact CB-CB 3.71Å; E91-N207 VanDerWaalsContact OE2-CA 3.31Å; E91-N207 WeakPolarHBondContact OE2-CA 3.34Å; E91-P208 WeakPolarHBondContact OE2-CD 3.38Å
92	R	97.2	Very high	95.7	Very high	64 Å²	64	37.3 Å²	37.3	24%	0.242	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	126.2	171.9	-174.3	176.8	82.1	179	7.1	109.6	D90 I201 L202 E203 W209 P210	D90-R92 WeakPolarHBondContact CB-O 3.11Å; D90-R92 PolarHBondContact O-N 2.93Å; R92-I201 HydrophobicContact CG-CG2 3.57Å; R92-L202 WeakPolarHBondContact CA-O 3.37Å; R92-E203 HydrophobicContact CB-CB 4.3Å; R92-E203 HydrophobicContact CG-CB 4.11Å; R92-W209 HydrophobicContact CB-CG 4.25Å; R92-P210 PolarHBondContact NH1-O 3.35Å
93	I	96.7	Very high	95.7	Very high	12 Å²	12	30.2 Å²	30.2	6%	0.062	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	149.5	176.5	63.7	174.6	0	0	0	111.3	K86 L87 D90 L95 T103 I201 L202	K86-I93 HydrophobicContact CB-CG2 4.36Å; K86-I93 HydrophobicContact CG-CG2 3.91Å; L87-I93 HydrophobicContact CB-CD1 3.79Å; L87-I93 HydrophobicContact CB-CG1 4.34Å; L87-I93 HydrophobicContact CD1-CD1 4.27Å; L87-I93 HydrophobicContact CD1-CG1 3.95Å; D90-I93 HydrophobicContact CB-CG2 4.3Å; I93-L95 HydrophobicContact CD1-CD1 3.5Å; I93-L95 VanDerWaalsContact CD1-CD1 3.5Å; I93-L95 HydrophobicContact CD1-CD2 4.47Å; I93-L95 HydrophobicContact CD1-CG 3.91Å; I93-L95 HydrophobicContact CG1-CD1 4.18Å; I93-L95 HydrophobicContact CG1-CG 4.17Å; I93-T103 HydrophobicContact CD1-CG2 4.47Å; I93-I201 WeakPolarHBondContact O-CA 3.17Å; I93-L202 HydrophobicContact CG1-CB 4.12Å; I93-L202 PolarHBondContact N-O 2.59Å; I93-L202 PolarHBondContact O-N 3Å
94	E	93.2	Very high	95.7	Very high	112 Å²	112	29.5 Å²	29.5	52%	0.523	14%	0.14	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	121.9	176.9	-53.2	-171.7	173.7	0	0	109.4	I201	E94-I201 HydrophobicContact CG-CG1 4.21Å
95	L	92.1	Very high	95.6	Very high	11 Å²	11	30.7 Å²	30.7	6%	0.058	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	160.6	-174.3	-66.8	-178.3	0	0	0	111.2	Y83 I93 W97 H99 A100 F199 G200	Y83-L95 HydrophobicContact CD1-CD1 3.95Å; Y83-L95 HydrophobicContact CD1-CD2 3.42Å; Y83-L95 VanDerWaalsContact CD1-CD2 3.42Å; Y83-L95 HydrophobicContact CD1-CG 4.34Å; Y83-L95 HydrophobicContact CD2-CD1 4.13Å; Y83-L95 HydrophobicContact CE1-CD1 4.37Å; Y83-L95 HydrophobicContact CE1-CD2 3.2Å; Y83-L95 HydrophobicContact CE1-CG 4.42Å; Y83-L95 HydrophobicContact CE2-CD2 4.41Å; Y83-L95 HydrophobicContact CG-CD1 3.82Å; Y83-L95 HydrophobicContact CG-CD2 4.13Å; I93-L95 HydrophobicContact CD1-CD1 3.5Å; I93-L95 VanDerWaalsContact CD1-CD1 3.5Å; I93-L95 HydrophobicContact CD1-CD2 4.47Å; I93-L95 HydrophobicContact CD1-CG 3.91Å; I93-L95 HydrophobicContact CG1-CD1 4.18Å; I93-L95 HydrophobicContact CG1-CG 4.17Å; L95-W97 PolarHBondContact O-N 3.43Å; L95-H99 HydrophobicContact CB-CB 4.47Å; L95-A100 HydrophobicContact CB-CB 4.1Å; L95-F199 CarbonylContact O-C 3.52Å; L95-F199 WeakPolarHBondContact O-CA 3.42Å; L95-F199 WeakPolarHBondContact O-CD1 3.34Å; L95-G200 PolarHBondContact N-O 2.7Å; L95-G200 PolarHBondContact O-N 2.89Å
96	P	90.7	Very high	95.5	Very high	24 Å²	24	33.1 Å²	33.1	16%	0.156	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.6	137.7	162.7	-20.7	32	0	0	0	110	S98 H99 A100 F199	P96-S98 VanDerWaalsContact C-N 3.28Å; P96-S98 PolarHBondContact O-N 2.86Å; P96-S98 VanDerWaalsContact O-N 3.11Å; P96-H99 WeakPolarHBondContact O-CA 3.08Å; P96-H99 WeakPolarHBondContact O-CB 3.39Å; P96-H99 PolarHBondContact O-N 2.84Å; P96-A100 PolarHBondContact O-N 2.9Å; P96-F199 HydrophobicContact CG-CE2 4.4Å; P96-F199 HydrophobicContact CG-CZ 4.12Å
97	W	91.9	Very high	95.5	Very high	72 Å²	72	28.8 Å²	28.8	27%	0.273	14%	0.136	S	C	.	.	H	α-helix	trans	-51.2	-43.6	-170.4	-178.7	-113	0	0	0	114	L95 H99 A100 I101 L181 Q183 S198	L95-W97 PolarHBondContact O-N 3.43Å; W97-H99 VanDerWaalsContact C-N 3.26Å; W97-H99 PolarHBondContact O-N 3.11Å; W97-A100 PolarHBondContact O-N 2.82Å; W97-I101 HydrophobicContact CD2-CD1 4.26Å; W97-I101 HydrophobicContact CG-CD1 4.27Å; W97-I101 HydrophobicContact CZ2-CD1 4.16Å; W97-I101 HydrophobicContact CZ2-CG1 4.38Å; W97-I101 VanDerWaalsContact NE1-CD1 3.27Å; W97-I101 WeakPolarHBondContact O-CG1 3.46Å; W97-I101 PolarHBondContact O-N 3.25Å; W97-L181 HydrophobicContact CE3-CD1 4.4Å; W97-L181 HydrophobicContact CE3-CD2 4.4Å; W97-L181 HydrophobicContact CE3-CG 4.38Å; W97-L181 HydrophobicContact CH2-CD1 4.5Å; W97-L181 HydrophobicContact CH2-CD2 3.48Å; W97-L181 VanDerWaalsContact CH2-CD2 3.48Å; W97-L181 HydrophobicContact CH2-CG 3.64Å; W97-L181 HydrophobicContact CZ2-CD2 4.05Å; W97-L181 HydrophobicContact CZ3-CD1 3.89Å; W97-L181 HydrophobicContact CZ3-CD2 3.69Å; W97-L181 HydrophobicContact CZ3-CG 3.48Å; W97-L181 VanDerWaalsContact CZ3-CG 3.48Å; W97-Q183 HydrophobicContact CD2-CG 4.43Å; W97-Q183 HydrophobicContact CE3-CB 4.03Å; W97-Q183 HydrophobicContact CE3-CG 4.1Å; W97-Q183 HydrophobicContact CH2-CB 4.01Å; W97-Q183 HydrophobicContact CZ3-CB 3.66Å; W97-Q183 HydrophobicContact CZ3-CG 4.25Å; W97-S198 WeakPolarHBondContact CB-O 3.25Å; W97-S198 PolarHBondContact N-O 3Å
98	S	91.5	Very high	95.5	Very high	29 Å²	29	28.9 Å²	28.9	20%	0.203	14%	0.136	C	C	.	.	H	α-helix	trans	-62.1	-33.1	177.4	49.9	0	0	0	0	113.7	P96 E102	P96-S98 VanDerWaalsContact C-N 3.28Å; P96-S98 PolarHBondContact O-N 2.86Å; P96-S98 VanDerWaalsContact O-N 3.11Å; S98-E102 PolarHBondContact O-N 3.02Å
99	H	93.1	Very high	95.4	Very high	14 Å²	14	35.3 Å²	35.3	7%	0.065	16%	0.16	C	C	.	.	H	α-helix	trans	-80.1	-37.8	-179.5	-58.2	44.3	0	0	0	109.4	L63 Y83 L95 P96 W97 E102 T103	L63-H99 HydrophobicContact CD2-CB 4.47Å; Y83-H99 HydrophobicContact CE2-CB 4Å; Y83-H99 AromaticContact CE2-CD2 3.77Å; L95-H99 HydrophobicContact CB-CB 4.47Å; P96-H99 WeakPolarHBondContact O-CA 3.08Å; P96-H99 WeakPolarHBondContact O-CB 3.39Å; P96-H99 PolarHBondContact O-N 2.84Å; W97-H99 VanDerWaalsContact C-N 3.26Å; W97-H99 PolarHBondContact O-N 3.11Å; H99-E102 PolarHBondContact O-N 2.79Å; H99-T103 VanDerWaalsContact O-CB 3.28Å; H99-T103 WeakPolarHBondContact O-CB 3.09Å; H99-T103 PolarHBondContact O-N 2.77Å; H99-T103 PolarHBondContact O-OG1 3.4Å
100	A	95	Very high	95.4	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-61.5	-45.2	175.3	0	0	0	0	0	112.2	L95 P96 W97 E102 T103 R104 L181	L95-A100 HydrophobicContact CB-CB 4.1Å; P96-A100 PolarHBondContact O-N 2.9Å; W97-A100 PolarHBondContact O-N 2.82Å; A100-E102 PolarHBondContact O-N 3.11Å; A100-T103 PolarHBondContact O-N 3Å; A100-R104 WeakPolarHBondContact O-CB 3.4Å; A100-R104 PolarHBondContact O-N 3.12Å; A100-L181 HydrophobicContact CB-CD1 3.53Å
101	I	94.9	Very high	95.4	Very high	42 Å²	42	31.3 Å²	31.3	22%	0.215	14%	0.139	C	C	.	.	H	α-helix	trans	-59.7	-46.1	177.3	-68.2	165.2	0	0	0	111.4	I61 W97 L105 L181	I61-I101 HydrophobicContact CD1-CB 3.72Å; I61-I101 HydrophobicContact CD1-CD1 3.89Å; I61-I101 HydrophobicContact CD1-CG1 4.43Å; I61-I101 HydrophobicContact CD1-CG2 3.49Å; I61-I101 VanDerWaalsContact CD1-CG2 3.49Å; W97-I101 HydrophobicContact CD2-CD1 4.26Å; W97-I101 HydrophobicContact CG-CD1 4.27Å; W97-I101 HydrophobicContact CZ2-CD1 4.16Å; W97-I101 HydrophobicContact CZ2-CG1 4.38Å; W97-I101 VanDerWaalsContact NE1-CD1 3.27Å; W97-I101 WeakPolarHBondContact O-CG1 3.46Å; W97-I101 PolarHBondContact O-N 3.25Å; I101-L105 PolarHBondContact O-N 3.15Å; I101-L181 HydrophobicContact CG1-CD2 3.86Å
102	E	94.8	Very high	95.4	Very high	4 Å²	4	31.2 Å²	31.2	2%	0.019	14%	0.138	C	C	.	.	H	α-helix	trans	-68.4	-46.5	179.5	-79.4	-73.4	-174.2	0	0	112	P60 I61 L63 R76 L80 S98 H99 A100 R104 L105 Y106	P60-E102 WeakPolarHBondContact CA-OE1 3.15Å; P60-E102 WeakPolarHBondContact CB-OE1 3.41Å; I61-E102 HydrophobicContact CB-CG 3.93Å; I61-E102 HydrophobicContact CD1-CG 4.48Å; I61-E102 HydrophobicContact CG1-CG 4.44Å; I61-E102 PolarHBondContact N-OE1 3.21Å; L63-E102 HydrophobicContact CD2-CG 4.43Å; R76-E102 IonicContact CZ-OE2 2.88Å; R76-E102 IonicContact NH2-OE1 2.77Å; R76-E102 PolarHBondContact NH2-OE1 3.18Å; R76-E102 IonicContact NH2-OE2 2.91Å; R76-E102 PolarHBondContact NH2-OE2 3.08Å; L80-E102 HydrophobicContact CD2-CB 3.81Å; S98-E102 PolarHBondContact O-N 3.02Å; H99-E102 PolarHBondContact O-N 2.79Å; A100-E102 PolarHBondContact O-N 3.11Å; E102-R104 VanDerWaalsContact C-N 3.25Å; E102-R104 PolarHBondContact O-N 2.91Å; E102-L105 WeakPolarHBondContact O-CB 3.21Å; E102-L105 PolarHBondContact O-N 2.86Å; E102-Y106 VanDerWaalsContact O-CD2 3.25Å; E102-Y106 WeakPolarHBondContact O-CD2 3.42Å; E102-Y106 PolarHBondContact O-N 3.38Å
103	T	97	Very high	95.3	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-56.7	-42.6	179.4	-57	0	0	0	0	111.1	Y83 V84 I93 H99 A100 L105 Y106 A107 L202	Y83-T103 WeakPolarHBondContact CB-OG1 3.36Å; V84-T103 HydrophobicContact CG2-CG2 3.98Å; I93-T103 HydrophobicContact CD1-CG2 4.47Å; H99-T103 VanDerWaalsContact O-CB 3.28Å; H99-T103 WeakPolarHBondContact O-CB 3.09Å; H99-T103 PolarHBondContact O-N 2.77Å; H99-T103 PolarHBondContact O-OG1 3.4Å; A100-T103 PolarHBondContact O-N 3Å; T103-L105 VanDerWaalsContact C-N 3.3Å; T103-L105 PolarHBondContact O-N 2.95Å; T103-Y106 PolarHBondContact O-N 2.77Å; T103-A107 WeakPolarHBondContact O-CB 3.05Å; T103-A107 PolarHBondContact O-N 2.75Å; T103-L202 HydrophobicContact CG2-CD2 3.84Å
104	R	97	Very high	95.2	Very high	34 Å²	34	29.8 Å²	29.8	13%	0.128	13%	0.134	C	C	.	.	H	α-helix	trans	-52.2	-46.3	173.6	161.1	-179.6	-87.9	179.8	-16.6	112.3	F54 A100 E102 Y106 A107 E108 T179 S180 L202	F54-R104 HydrophobicContact CE1-CG 4.06Å; F54-R104 HydrophobicContact CE2-CG 3.9Å; F54-R104 HydrophobicContact CZ-CG 3.52Å; A100-R104 WeakPolarHBondContact O-CB 3.4Å; A100-R104 PolarHBondContact O-N 3.12Å; E102-R104 VanDerWaalsContact C-N 3.25Å; E102-R104 PolarHBondContact O-N 2.91Å; R104-Y106 VanDerWaalsContact C-N 3.34Å; R104-Y106 PolarHBondContact O-N 3.17Å; R104-A107 PolarHBondContact O-N 3.44Å; R104-E108 HydrophobicContact CG-CG 4.16Å; R104-E108 WeakPolarHBondContact O-CB 3.41Å; R104-E108 WeakPolarHBondContact O-CG 3.13Å; R104-E108 PolarHBondContact O-N 2.75Å; R104-T179 WeakPolarHBondContact CG-OG1 3.32Å; R104-T179 PolarHBondContact NE-OG1 2.94Å; R104-T179 PolarHBondContact NH2-O 3.35Å; R104-T179 VanDerWaalsContact NH2-O 3.15Å; R104-S180 VanDerWaalsContact NH2-CA 3.31Å; R104-L202 HydrophobicContact CB-CD1 3.8Å; R104-L202 HydrophobicContact CB-CD2 4.19Å; R104-L202 HydrophobicContact CG-CD1 4.49Å
105	L	96.3	Very high	95.4	Very high	25 Å²	25	24.4 Å²	24.4	13%	0.131	11%	0.109	C	C	.	.	H	α-helix	trans	-60.2	-45.4	-176.9	-66.5	168.9	0	0	0	111.5	L52 F54 V56 I101 E102 T103 R109	L52-L105 HydrophobicContact CD1-CD2 4.27Å; F54-L105 HydrophobicContact CE2-CD2 3.44Å; F54-L105 VanDerWaalsContact CE2-CD2 3.44Å; F54-L105 HydrophobicContact CE2-CG 4.34Å; F54-L105 HydrophobicContact CZ-CD2 3.71Å; V56-L105 HydrophobicContact CB-CD2 4.15Å; V56-L105 HydrophobicContact CG1-CD1 4.36Å; V56-L105 HydrophobicContact CG1-CD2 3.64Å; V56-L105 HydrophobicContact CG2-CD2 3.64Å; I101-L105 PolarHBondContact O-N 3.15Å; E102-L105 WeakPolarHBondContact O-CB 3.21Å; E102-L105 PolarHBondContact O-N 2.86Å; T103-L105 VanDerWaalsContact C-N 3.3Å; T103-L105 PolarHBondContact O-N 2.95Å; L105-R109 WeakPolarHBondContact O-CB 3.09Å; L105-R109 PolarHBondContact O-N 3.28Å; L105-R109 VanDerWaalsContact O-N 3.1Å
106	Y	96.7	Very high	95.4	Very high	60 Å²	60	26.3 Å²	26.3	24%	0.235	12%	0.119	C	C	.	.	H	α-helix	trans	-71.4	-41.3	179.9	-70.1	-79.8	0	0	0	112.3	R76 L80 E102 T103 R104 R109 L110 W153	R76-Y106 PolarHBondContact NH1-OH 2.56Å; L80-Y106 HydrophobicContact CD1-CD2 3.84Å; L80-Y106 HydrophobicContact CD1-CE2 3.39Å; L80-Y106 HydrophobicContact CD2-CD2 4.27Å; L80-Y106 HydrophobicContact CD2-CE2 4.49Å; L80-Y106 HydrophobicContact CG-CD2 4.46Å; L80-Y106 HydrophobicContact CG-CE2 4.44Å; E102-Y106 VanDerWaalsContact O-CD2 3.25Å; E102-Y106 WeakPolarHBondContact O-CD2 3.42Å; E102-Y106 PolarHBondContact O-N 3.38Å; T103-Y106 PolarHBondContact O-N 2.77Å; R104-Y106 VanDerWaalsContact C-N 3.34Å; R104-Y106 PolarHBondContact O-N 3.17Å; Y106-R109 PolarHBondContact O-N 2.68Å; Y106-L110 WeakPolarHBondContact O-CB 3.04Å; Y106-L110 PolarHBondContact O-N 3.41Å; Y106-W153 AromaticContact CD1-CH2 3.1Å; Y106-W153 HydrophobicContact CD1-CH2 3.1Å; Y106-W153 AromaticContact CD1-CZ2 3.36Å; Y106-W153 HydrophobicContact CD1-CZ2 3.36Å; Y106-W153 AromaticContact CD1-CZ3 3.97Å; Y106-W153 HydrophobicContact CD1-CZ3 3.97Å; Y106-W153 HydrophobicContact CD2-CH2 4.45Å; Y106-W153 AromaticContact CE1-CH2 3.54Å; Y106-W153 HydrophobicContact CE1-CH2 3.54Å; Y106-W153 AromaticContact CE1-CZ2 3.8Å; Y106-W153 HydrophobicContact CE1-CZ2 3.8Å; Y106-W153 AromaticContact CG-CH2 3.62Å; Y106-W153 HydrophobicContact CG-CH2 3.62Å; Y106-W153 HydrophobicContact CG-CZ2 4.23Å; Y106-W153 HydrophobicContact CG-CZ3 4.04Å
107	A	98.3	Very high	95.5	Very high	1 Å²	1	25.3 Å²	25.3	1%	0.008	11%	0.112	C	C	.	.	H	α-helix	trans	-63.4	-45.8	177.7	0	0	0	0	0	112.1	V84 L87 T103 R104 R109 L110 I111	V84-A107 HydrophobicContact CG1-CB 4.48Å; V84-A107 HydrophobicContact CG2-CB 4.46Å; L87-A107 HydrophobicContact CD2-CB 3.56Å; T103-A107 WeakPolarHBondContact O-CB 3.05Å; T103-A107 PolarHBondContact O-N 2.75Å; R104-A107 PolarHBondContact O-N 3.44Å; A107-R109 VanDerWaalsContact C-N 3.32Å; A107-R109 PolarHBondContact O-N 2.87Å; A107-L110 PolarHBondContact O-N 2.87Å; A107-I111 WeakPolarHBondContact O-CG1 3.47Å; A107-I111 PolarHBondContact O-N 2.96Å; A107-I111 VanDerWaalsContact O-N 3.11Å
108	E	97.5	Very high	95.6	Very high	1 Å²	1	22.9 Å²	22.9	1%	0.005	11%	0.107	C	C	.	.	H	α-helix	trans	-62	-43.5	176.7	-69.4	-98.7	-177.1	0	0	111	L52 F54 R104 L110 I111 Q112 S177 Y178 T179	L52-E108 HydrophobicContact CD2-CB 3.45Å; L52-E108 VanDerWaalsContact CD2-CB 3.45Å; L52-E108 HydrophobicContact CD2-CG 4.38Å; F54-E108 HydrophobicContact CE1-CB 4.26Å; F54-E108 HydrophobicContact CE1-CG 3.69Å; F54-E108 HydrophobicContact CZ-CG 4.13Å; R104-E108 HydrophobicContact CG-CG 4.16Å; R104-E108 WeakPolarHBondContact O-CB 3.41Å; R104-E108 WeakPolarHBondContact O-CG 3.13Å; R104-E108 PolarHBondContact O-N 2.75Å; E108-L110 PolarHBondContact O-N 3.45Å; E108-I111 PolarHBondContact O-N 3.45Å; E108-Q112 WeakPolarHBondContact O-CG 2.78Å; E108-Q112 PolarHBondContact O-N 3Å; E108-S177 WeakPolarHBondContact OE1-CB 3.4Å; E108-Y178 PolarHBondContact OE1-N 3.22Å; E108-Y178 WeakPolarHBondContact OE2-CD2 2.96Å; E108-Y178 PolarHBondContact OE2-N 3.34Å; E108-T179 HydrophobicContact CG-CG2 4.04Å; E108-T179 WeakPolarHBondContact OE1-CB 3.35Å; E108-T179 PolarHBondContact OE1-N 2.89Å; E108-T179 PolarHBondContact OE1-OG1 3.45Å
109	R	96.8	Very high	95.4	Very high	136 Å²	136	23.1 Å²	23.1	51%	0.513	11%	0.11	S	C	.	.	H	α-helix	trans	-63.5	-42.1	178.2	-175.9	57.8	-177.1	-101.5	3.8	112.1	L105 Y106 A107 I111 Q112 E113	L105-R109 WeakPolarHBondContact O-CB 3.09Å; L105-R109 PolarHBondContact O-N 3.28Å; L105-R109 VanDerWaalsContact O-N 3.1Å; Y106-R109 PolarHBondContact O-N 2.68Å; A107-R109 VanDerWaalsContact C-N 3.32Å; A107-R109 PolarHBondContact O-N 2.87Å; R109-I111 VanDerWaalsContact C-N 3.31Å; R109-I111 PolarHBondContact O-N 3.47Å; R109-Q112 WeakPolarHBondContact O-CB 3.11Å; R109-Q112 PolarHBondContact O-N 3.28Å; R109-E113 IonicContact CZ-OE1 2.76Å; R109-E113 IonicContact NE-OE1 2.74Å; R109-E113 PolarHBondContact NE-OE1 2.86Å; R109-E113 IonicContact NH2-OE1 2.72Å; R109-E113 PolarHBondContact NH2-OE1 2.94Å; R109-E113 WeakPolarHBondContact O-CG 3.17Å; R109-E113 PolarHBondContact O-N 2.63Å
110	L	97.2	Very high	95.2	Very high	3 Å²	3	29.3 Å²	29.3	2%	0.016	14%	0.139	C	C	.	.	H	α-helix	trans	-58.3	-44.3	176.5	179.1	63.2	0	0	0	111.5	V84 L88 Y106 A107 E108 G114 L149 W153 L154 L163	V84-L110 HydrophobicContact CG1-CD2 3.93Å; L88-L110 HydrophobicContact CD1-CD2 3.85Å; Y106-L110 WeakPolarHBondContact O-CB 3.04Å; Y106-L110 PolarHBondContact O-N 3.41Å; A107-L110 PolarHBondContact O-N 2.87Å; E108-L110 PolarHBondContact O-N 3.45Å; L110-G114 PolarHBondContact O-N 3.32Å; L110-G114 VanDerWaalsContact O-N 3.11Å; L110-L149 HydrophobicContact CD1-CD2 3.3Å; L110-W153 HydrophobicContact CD1-CB 4.33Å; L110-W153 HydrophobicContact CD1-CG 4.49Å; L110-W153 HydrophobicContact CD2-CB 3.89Å; L110-L154 HydrophobicContact CD2-CD1 4.48Å; L110-L154 HydrophobicContact CD2-CG 4.43Å; L110-L163 HydrophobicContact CD1-CD2 4.15Å; L110-L163 HydrophobicContact CD2-CD2 4.3Å; L110-L163 HydrophobicContact CG-CD2 4.05Å
111	I	98.1	Very high	94.8	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-67.5	-38.8	177.4	-64.1	168	0	0	0	111.1	L88 A107 E108 R109 G114 I115 L163 Y171 Y178 L204	L88-I111 HydrophobicContact CD2-CD1 4.44Å; A107-I111 WeakPolarHBondContact O-CG1 3.47Å; A107-I111 PolarHBondContact O-N 2.96Å; A107-I111 VanDerWaalsContact O-N 3.11Å; E108-I111 PolarHBondContact O-N 3.45Å; R109-I111 VanDerWaalsContact C-N 3.31Å; R109-I111 PolarHBondContact O-N 3.47Å; I111-G114 PolarHBondContact O-N 3.02Å; I111-I115 HydrophobicContact CG2-CD1 3.71Å; I111-I115 HydrophobicContact CG2-CG1 4.34Å; I111-I115 WeakPolarHBondContact O-CG1 3.46Å; I111-I115 PolarHBondContact O-N 3.28Å; I111-L163 HydrophobicContact CG1-CD1 4.21Å; I111-Y171 HydrophobicContact CD1-CD2 4.18Å; I111-Y171 HydrophobicContact CD1-CE2 4.19Å; I111-Y171 HydrophobicContact CG2-CD2 3.96Å; I111-Y171 HydrophobicContact CG2-CG 4.46Å; I111-Y178 HydrophobicContact CB-CD2 3.79Å; I111-Y178 HydrophobicContact CB-CE2 3.97Å; I111-Y178 HydrophobicContact CD1-CD2 4.3Å; I111-Y178 HydrophobicContact CD1-CG 4.47Å; I111-Y178 HydrophobicContact CG2-CD1 4.4Å; I111-Y178 HydrophobicContact CG2-CD2 3.56Å; I111-Y178 HydrophobicContact CG2-CE1 4.43Å; I111-Y178 HydrophobicContact CG2-CE2 3.58Å; I111-Y178 HydrophobicContact CG2-CG 3.99Å; I111-L204 HydrophobicContact CD1-CD2 4.04Å
112	Q	96.7	Very high	94.5	Very high	11 Å²	11	34.3 Å²	34.3	5%	0.051	17%	0.165	C	C	.	.	H	α-helix	trans	-57.9	-51.2	175.1	-73.5	178.4	-28.2	0	0	111.7	A48 E108 R109 G114 I115 L116 Y178	A48-Q112 PolarHBondContact O-NE2 3.4Å; E108-Q112 WeakPolarHBondContact O-CG 2.78Å; E108-Q112 PolarHBondContact O-N 3Å; R109-Q112 WeakPolarHBondContact O-CB 3.11Å; R109-Q112 PolarHBondContact O-N 3.28Å; Q112-G114 VanDerWaalsContact C-N 3.31Å; Q112-G114 PolarHBondContact O-N 3.03Å; Q112-I115 PolarHBondContact O-N 3.49Å; Q112-L116 WeakPolarHBondContact O-CG 3.37Å; Q112-L116 PolarHBondContact O-N 2.98Å; Q112-Y178 HydrophobicContact CG-CE2 3.8Å
113	E	95.4	Very high	94.4	Very high	46 Å²	46	34.6 Å²	34.6	22%	0.215	17%	0.167	C	C	.	.	H	α-helix	trans	-60.9	-42.2	179.5	-64.2	-59	157.6	0	0	111.3	R109 I115 L116 A117	R109-E113 IonicContact CZ-OE1 2.76Å; R109-E113 IonicContact NE-OE1 2.74Å; R109-E113 PolarHBondContact NE-OE1 2.86Å; R109-E113 IonicContact NH2-OE1 2.72Å; R109-E113 PolarHBondContact NH2-OE1 2.94Å; R109-E113 WeakPolarHBondContact O-CG 3.17Å; R109-E113 PolarHBondContact O-N 2.63Å; E113-I115 PolarHBondContact O-N 3.48Å; E113-L116 PolarHBondContact O-N 3.1Å; E113-A117 WeakPolarHBondContact O-CB 3.02Å; E113-A117 PolarHBondContact O-N 3.38Å
114	G	95.6	Very high	94.2	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-60.8	-41.9	175.2	0	0	0	0	0	113.2	L110 I111 Q112 S118 L123	L110-G114 PolarHBondContact O-N 3.32Å; L110-G114 VanDerWaalsContact O-N 3.11Å; I111-G114 PolarHBondContact O-N 3.02Å; Q112-G114 VanDerWaalsContact C-N 3.31Å; Q112-G114 PolarHBondContact O-N 3.03Å; G114-S118 WeakPolarHBondContact O-CB 3.41Å; G114-S118 PolarHBondContact O-N 3.44Å; G114-L123 WeakPolarHBondContact O-CD1 3.32Å
115	I	96.3	Very high	93.9	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-67	-43.9	178	-70.1	165.3	0	0	0	111.3	Y45 A49 I111 Q112 E113 A117 S118 A119 V168 Y178	Y45-I115 HydrophobicContact CG-CG2 4.46Å; A49-I115 HydrophobicContact CB-CB 4.47Å; A49-I115 HydrophobicContact CB-CG2 3.84Å; I111-I115 HydrophobicContact CG2-CD1 3.71Å; I111-I115 HydrophobicContact CG2-CG1 4.34Å; I111-I115 WeakPolarHBondContact O-CG1 3.46Å; I111-I115 PolarHBondContact O-N 3.28Å; Q112-I115 PolarHBondContact O-N 3.49Å; E113-I115 PolarHBondContact O-N 3.48Å; I115-A117 VanDerWaalsContact C-N 3.35Å; I115-A117 PolarHBondContact O-N 3.36Å; I115-S118 PolarHBondContact O-N 2.85Å; I115-S118 PolarHBondContact O-OG 3.3Å; I115-A119 PolarHBondContact O-N 3.45Å; I115-V168 HydrophobicContact CG1-CG1 4.27Å; I115-V168 HydrophobicContact CG1-CG2 4.48Å; I115-Y178 HydrophobicContact CD1-CE1 3.98Å; I115-Y178 HydrophobicContact CD1-CE2 4.38Å; I115-Y178 VanDerWaalsContact CD1-OH 3.32Å; I115-Y178 WeakPolarHBondContact CD1-OH 3.29Å
116	L	93.5	Very high	93.5	Very high	51 Å²	51	38.6 Å²	38.6	27%	0.267	20%	0.197	S	C	.	.	H	α-helix	trans	-61.2	-45.2	178.3	-67.9	175.1	0	0	0	111	Y45 A49 Q112 E113 S118 A119	Y45-L116 HydrophobicContact CD1-CD2 4.03Å; Y45-L116 HydrophobicContact CD2-CD2 4.45Å; Y45-L116 HydrophobicContact CE1-CD2 3.64Å; Y45-L116 HydrophobicContact CE2-CD2 4.12Å; Y45-L116 HydrophobicContact CG-CD2 4.41Å; A49-L116 HydrophobicContact CB-CD2 4.33Å; Q112-L116 WeakPolarHBondContact O-CG 3.37Å; Q112-L116 PolarHBondContact O-N 2.98Å; E113-L116 PolarHBondContact O-N 3.1Å; L116-S118 VanDerWaalsContact C-N 3.32Å; L116-S118 PolarHBondContact O-N 2.68Å; L116-A119 WeakPolarHBondContact O-CB 3.48Å; L116-A119 PolarHBondContact O-N 2.96Å
117	A	92.7	Very high	93.2	Very high	2 Å²	2	35.8 Å²	35.8	2%	0.017	19%	0.186	C	C	.	.	H	α-helix	trans	-61.2	-39.7	176.6	0	0	0	0	0	113.2	E113 I115 A119 E120 Q121 L123 I146	E113-A117 WeakPolarHBondContact O-CB 3.02Å; E113-A117 PolarHBondContact O-N 3.38Å; I115-A117 VanDerWaalsContact C-N 3.35Å; I115-A117 PolarHBondContact O-N 3.36Å; A117-A119 PolarHBondContact O-N 3.18Å; A117-A119 VanDerWaalsContact O-N 3.14Å; A117-E120 PolarHBondContact O-N 2.93Å; A117-Q121 PolarHBondContact O-N 3.29Å; A117-L123 HydrophobicContact CB-CD1 4Å; A117-L123 HydrophobicContact CB-CD2 3.82Å; A117-L123 HydrophobicContact CB-CG 4.37Å; A117-I146 HydrophobicContact CB-CB 4.47Å; A117-I146 HydrophobicContact CB-CD1 3.28Å; A117-I146 HydrophobicContact CB-CG1 4.33Å; A117-I146 HydrophobicContact CB-CG2 3.98Å
118	S	92.2	Very high	92.8	Very high	22 Å²	22	38.6 Å²	38.6	15%	0.154	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-9.5	179.8	78.9	0	0	0	0	114.1	G114 I115 L116 V168 R172	G114-S118 WeakPolarHBondContact O-CB 3.41Å; G114-S118 PolarHBondContact O-N 3.44Å; I115-S118 PolarHBondContact O-N 2.85Å; I115-S118 PolarHBondContact O-OG 3.3Å; L116-S118 VanDerWaalsContact C-N 3.32Å; L116-S118 PolarHBondContact O-N 2.68Å; S118-V168 WeakPolarHBondContact OG-CG1 3.33Å; S118-R172 PolarHBondContact O-NH1 2.87Å; S118-R172 PolarHBondContact OG-NH1 3.19Å
119	A	89.2	Confident	92.3	Very high	33 Å²	33	43.5 Å²	43.5	27%	0.273	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-23.3	171.6	0	0	0	0	0	112	N44 Y45 I115 L116 A117	N44-A119 HydrophobicContact CB-CB 4.15Å; Y45-A119 HydrophobicContact CD1-CB 4.18Å; Y45-A119 HydrophobicContact CE1-CB 4.48Å; I115-A119 PolarHBondContact O-N 3.45Å; L116-A119 WeakPolarHBondContact O-CB 3.48Å; L116-A119 PolarHBondContact O-N 2.96Å; A117-A119 PolarHBondContact O-N 3.18Å; A117-A119 VanDerWaalsContact O-N 3.14Å
120	E	87.5	Confident	91.8	Very high	144 Å²	144	41.6 Å²	41.6	67%	0.673	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.5	-40.6	-175.3	-61.3	176.7	175.6	0	0	112.4	A117 N143	A117-E120 PolarHBondContact O-N 2.93Å; E120-N143 PolarHBondContact OE2-ND2 3.11Å
121	Q	86.2	Confident	91.3	Very high	45 Å²	45	44.8 Å²	44.8	21%	0.21	23%	0.232	C	C	.	.	S	Bend	trans	-139.2	155.3	-169.5	-61	178.9	3.7	0	0	111.5	A117 L123 L126 K141	A117-Q121 PolarHBondContact O-N 3.29Å; Q121-L123 PolarHBondContact O-N 2.96Å; Q121-L126 HydrophobicContact CB-CD1 4.15Å; Q121-K141 PolarHBondContact NE2-O 3.28Å; Q121-K141 VanDerWaalsContact NE2-O 3.08Å
122	D	90	Very high	90.9	Very high	102 Å²	102	51 Å²	51	55%	0.545	27%	0.265	S	S	.	.			trans	-82.9	102.5	170.3	-177.2	18.1	0	0	0	110.8	V124 S125 L126	D122-V124 VanDerWaalsContact C-N 3.27Å; D122-V124 PolarHBondContact O-N 2.86Å; D122-V124 PolarHBondContact OD1-N 3.22Å; D122-S125 PolarHBondContact O-N 2.74Å; D122-S125 WeakPolarHBondContact OD2-CB 3.48Å; D122-L126 WeakPolarHBondContact O-CG 3.45Å; D122-L126 PolarHBondContact O-N 3.3Å
123	L	91.4	Very high	90.2	Very high	11 Å²	11	52.7 Å²	52.7	6%	0.058	28%	0.278	C	S	.	.	H	α-helix	trans	-67.1	-27.9	-178.1	-60.4	173.5	0	0	0	112.8	G114 A117 Q121 L126 F127 F164	G114-L123 WeakPolarHBondContact O-CD1 3.32Å; A117-L123 HydrophobicContact CB-CD1 4Å; A117-L123 HydrophobicContact CB-CD2 3.82Å; A117-L123 HydrophobicContact CB-CG 4.37Å; Q121-L123 PolarHBondContact O-N 2.96Å; L123-L126 HydrophobicContact CD2-CD1 4.34Å; L123-F127 VanDerWaalsContact O-CB 3.3Å; L123-F127 WeakPolarHBondContact O-CB 3.42Å; L123-F127 PolarHBondContact O-N 3.1Å; L123-F164 HydrophobicContact CB-CB 4.11Å; L123-F164 HydrophobicContact CB-CD1 3.8Å; L123-F164 HydrophobicContact CB-CD2 4.04Å; L123-F164 HydrophobicContact CB-CE1 4.2Å; L123-F164 HydrophobicContact CB-CE2 4.4Å; L123-F164 HydrophobicContact CB-CG 3.72Å; L123-F164 HydrophobicContact CB-CZ 4.48Å; L123-F164 HydrophobicContact CD1-CD1 3.47Å; L123-F164 VanDerWaalsContact CD1-CD1 3.47Å; L123-F164 HydrophobicContact CD1-CE1 3.63Å; L123-F164 HydrophobicContact CD1-CG 4.26Å; L123-F164 HydrophobicContact CG-CD1 4.23Å; L123-F164 HydrophobicContact CG-CE1 4.37Å
124	V	93	Very high	89.3	Confident	41 Å²	41	60.6 Å²	60.6	25%	0.248	31%	0.312	C	S	.	.	H	α-helix	trans	-68	-49.8	179.1	178.7	0	0	0	0	109.3	D122 L126 F127 E128 F164 K165	D122-V124 VanDerWaalsContact C-N 3.27Å; D122-V124 PolarHBondContact O-N 2.86Å; D122-V124 PolarHBondContact OD1-N 3.22Å; V124-L126 VanDerWaalsContact C-N 3.3Å; V124-L126 PolarHBondContact O-N 2.68Å; V124-F127 PolarHBondContact O-N 2.76Å; V124-E128 HydrophobicContact CG1-CG 4.41Å; V124-E128 WeakPolarHBondContact O-CG 3.47Å; V124-E128 PolarHBondContact O-N 2.99Å; V124-F164 HydrophobicContact CG2-CB 4.19Å; V124-K165 HydrophobicContact CG1-CD 4.49Å; V124-K165 VanDerWaalsContact CG1-CE 3.49Å; V124-K165 HydrophobicContact CG1-CG 4.24Å; V124-K165 HydrophobicContact CG2-CG 3.78Å
125	S	90.4	Very high	88.2	Confident	71 Å²	71	68.2 Å²	68.2	50%	0.497	35%	0.347	S	S	.	.	H	α-helix	trans	-59.3	-40.1	176.5	-175.3	0	0	0	0	112.7	D122 F127 L129	D122-S125 PolarHBondContact O-N 2.74Å; D122-S125 WeakPolarHBondContact OD2-CB 3.48Å; S125-F127 VanDerWaalsContact C-N 3.34Å; S125-L129 WeakPolarHBondContact O-CB 3.37Å; S125-L129 PolarHBondContact O-N 3.06Å
126	L	88.1	Confident	86.6	Confident	30 Å²	30	71.9 Å²	71.9	16%	0.157	37%	0.371	C	S	.	.	H	α-helix	trans	-63.1	-42.5	177.6	-74	171.2	0	0	0	112.3	Q121 D122 L123 V124 L129 W130 L142	Q121-L126 HydrophobicContact CB-CD1 4.15Å; D122-L126 WeakPolarHBondContact O-CG 3.45Å; D122-L126 PolarHBondContact O-N 3.3Å; L123-L126 HydrophobicContact CD2-CD1 4.34Å; V124-L126 VanDerWaalsContact C-N 3.3Å; V124-L126 PolarHBondContact O-N 2.68Å; L126-L129 PolarHBondContact O-N 3.41Å; L126-W130 WeakPolarHBondContact O-CB 3.42Å; L126-W130 PolarHBondContact O-N 3.33Å; L126-L142 HydrophobicContact CD2-CB 4.18Å; L126-L142 HydrophobicContact CD2-CD1 3.64Å; L126-L142 HydrophobicContact CD2-CD2 3.9Å; L126-L142 HydrophobicContact CD2-CG 4.09Å
127	F	90.8	Very high	85.3	Confident	2 Å²	2	77.6 Å²	77.6	1%	0.009	40%	0.396	C	S	.	.	H	α-helix	trans	-68.5	-42.2	179.7	-178.7	-100.4	0	0	0	112.2	L123 V124 S125 L129 W130 K131 L147 E157 V160 E161 F164	L123-F127 VanDerWaalsContact O-CB 3.3Å; L123-F127 WeakPolarHBondContact O-CB 3.42Å; L123-F127 PolarHBondContact O-N 3.1Å; V124-F127 PolarHBondContact O-N 2.76Å; S125-F127 VanDerWaalsContact C-N 3.34Å; F127-L129 VanDerWaalsContact C-N 3.3Å; F127-L129 PolarHBondContact O-N 3.09Å; F127-W130 HydrophobicContact CD2-CE3 4.26Å; F127-W130 AromaticContact CE2-CE3 3.97Å; F127-W130 HydrophobicContact CE2-CE3 3.97Å; F127-W130 HydrophobicContact CE2-CZ3 4.08Å; F127-W130 PolarHBondContact O-N 2.83Å; F127-K131 HydrophobicContact CD1-CD 3.79Å; F127-K131 HydrophobicContact CD1-CG 4.33Å; F127-K131 HydrophobicContact CE1-CD 3.18Å; F127-K131 HydrophobicContact CE1-CG 3.87Å; F127-K131 HydrophobicContact CE2-CG 4.5Å; F127-K131 HydrophobicContact CZ-CD 3.72Å; F127-K131 HydrophobicContact CZ-CG 4.02Å; F127-K131 WeakPolarHBondContact O-CG 3.45Å; F127-K131 PolarHBondContact O-N 2.84Å; F127-L147 HydrophobicContact CB-CD1 4.47Å; F127-L147 HydrophobicContact CD2-CD1 4.32Å; F127-E157 HydrophobicContact CE1-CG 4.31Å; F127-E157 HydrophobicContact CE2-CG 4.39Å; F127-E157 HydrophobicContact CZ-CG 3.52Å; F127-V160 HydrophobicContact CD2-CB 4.36Å; F127-V160 HydrophobicContact CD2-CG1 3.58Å; F127-V160 HydrophobicContact CE2-CB 3.68Å; F127-V160 HydrophobicContact CE2-CG1 3.37Å; F127-V160 HydrophobicContact CE2-CG2 4.47Å; F127-V160 HydrophobicContact CG-CG1 4.4Å; F127-V160 HydrophobicContact CZ-CB 3.94Å; F127-V160 HydrophobicContact CZ-CG1 4.06Å; F127-E161 HydrophobicContact CD1-CG 3.67Å; F127-E161 HydrophobicContact CE1-CB 4.33Å; F127-E161 HydrophobicContact CE1-CG 3.05Å; F127-E161 HydrophobicContact CZ-CG 3.86Å; F127-F164 HydrophobicContact CB-CD2 4.25Å; F127-F164 HydrophobicContact CB-CE2 4.39Å
128	E	89.4	Confident	83.7	Confident	60 Å²	60	83.6 Å²	83.6	28%	0.28	43%	0.427	S	S	.	.	H	α-helix	trans	-64.1	-35.4	174.4	-62.8	-64.7	170.2	0	0	111.8	V124 K131 N132 K165	V124-E128 HydrophobicContact CG1-CG 4.41Å; V124-E128 WeakPolarHBondContact O-CG 3.47Å; V124-E128 PolarHBondContact O-N 2.99Å; E128-K131 PolarHBondContact O-N 3.39Å; E128-N132 PolarHBondContact O-N 3.32Å; E128-N132 PolarHBondContact O-ND2 3.47Å; E128-K165 IonicContact OE1-NZ 3.3Å; E128-K165 PolarHBondContact OE1-NZ 3.48Å
129	L	87.2	Confident	82.4	Confident	104 Å²	104	87.4 Å²	87.4	55%	0.545	45%	0.446	S	S	.	.	H	α-helix	trans	-65	-47.1	173.9	-155.8	175	0	0	0	110.5	S125 L126 F127 K131 N132 S133	S125-L129 WeakPolarHBondContact O-CB 3.37Å; S125-L129 PolarHBondContact O-N 3.06Å; L126-L129 PolarHBondContact O-N 3.41Å; F127-L129 VanDerWaalsContact C-N 3.3Å; F127-L129 PolarHBondContact O-N 3.09Å; L129-K131 VanDerWaalsContact C-N 3.31Å; L129-K131 PolarHBondContact O-N 3.05Å; L129-N132 PolarHBondContact O-N 2.82Å; L129-S133 WeakPolarHBondContact O-CB 3.31Å; L129-S133 PolarHBondContact O-N 3.45Å
130	W	86.2	Confident	81.2	Confident	96 Å²	96	93.7 Å²	93.7	36%	0.364	47%	0.474	S	S	.	.	H	α-helix	trans	-58.7	-40.9	176.7	177.9	85.1	0	0	0	112.4	L126 F127 L147 V151	L126-W130 WeakPolarHBondContact O-CB 3.42Å; L126-W130 PolarHBondContact O-N 3.33Å; F127-W130 HydrophobicContact CD2-CE3 4.26Å; F127-W130 AromaticContact CE2-CE3 3.97Å; F127-W130 HydrophobicContact CE2-CE3 3.97Å; F127-W130 HydrophobicContact CE2-CZ3 4.08Å; F127-W130 PolarHBondContact O-N 2.83Å; W130-L147 HydrophobicContact CB-CD1 3.78Å; W130-L147 HydrophobicContact CB-CD2 4.42Å; W130-L147 HydrophobicContact CD2-CD2 3.99Å; W130-L147 HydrophobicContact CG-CD1 4.02Å; W130-L147 HydrophobicContact CG-CD2 3.76Å; W130-V151 HydrophobicContact CH2-CG1 4.49Å; W130-V151 HydrophobicContact CH2-CG2 4.24Å; W130-V151 HydrophobicContact CZ2-CG1 4.48Å; W130-V151 HydrophobicContact CZ2-CG2 4.32Å
131	K	88.4	Confident	80.1	Confident	70 Å²	70	95.8 Å²	95.8	30%	0.304	48%	0.481	S	S	.	.	H	α-helix	trans	-63.5	-40.4	177.5	-79.9	179.7	51.8	147	0	113.8	F127 E128 L129 E157 E161	F127-K131 HydrophobicContact CD1-CD 3.79Å; F127-K131 HydrophobicContact CD1-CG 4.33Å; F127-K131 HydrophobicContact CE1-CD 3.18Å; F127-K131 HydrophobicContact CE1-CG 3.87Å; F127-K131 HydrophobicContact CE2-CG 4.5Å; F127-K131 HydrophobicContact CZ-CD 3.72Å; F127-K131 HydrophobicContact CZ-CG 4.02Å; F127-K131 WeakPolarHBondContact O-CG 3.45Å; F127-K131 PolarHBondContact O-N 2.84Å; E128-K131 PolarHBondContact O-N 3.39Å; L129-K131 VanDerWaalsContact C-N 3.31Å; L129-K131 PolarHBondContact O-N 3.05Å; K131-E157 HydrophobicContact CD-CG 4.37Å; K131-E157 WeakPolarHBondContact CD-OE1 3.44Å; K131-E157 WeakPolarHBondContact CE-OE1 3.15Å; K131-E157 IonicContact NZ-OE1 2.65Å; K131-E157 PolarHBondContact NZ-OE1 2.92Å; K131-E161 IonicContact NZ-OE1 2.66Å; K131-E161 PolarHBondContact NZ-OE1 3.47Å
132	N	89.4	Confident	79.1	Confident	129 Å²	129	97 Å²	97	69%	0.69	49%	0.489	S	S	*	.	H	α-helix	trans	-89.5	-14	-173	-67.6	-50.2	0	0	0	113	E128 L129	E128-N132 PolarHBondContact O-N 3.32Å; E128-N132 PolarHBondContact O-ND2 3.47Å; L129-N132 PolarHBondContact O-N 2.82Å
133	S	82.1	Confident	78.2	Confident	47 Å²	47	94.2 Å²	94.2	33%	0.329	47%	0.474	S	S	.	.			trans	-83.2	135.6	177.9	-165.8	0	0	0	0	112	L129 E135	L129-S133 WeakPolarHBondContact O-CB 3.31Å; L129-S133 PolarHBondContact O-N 3.45Å; S133-E135 PolarHBondContact OG-N 3.34Å; S133-E135 PolarHBondContact OG-O 2.93Å
134	K	75.8	Confident	77.6	Confident	213 Å²	213	96.3 Å²	96.3	93%	0.926	49%	0.485	S	S	*	.	S	Bend	trans	-76.1	-31.2	166.6	-74.3	-177.8	178.6	178	0	111.7
135	E	72.2	Confident	77.4	Confident	160 Å²	160	96.6 Å²	96.6	75%	0.748	50%	0.496	S	S	*	.	S	Bend	trans	-140.3	106	-177.1	-69.6	-177	179.2	0	0	108.2	S133 E137	S133-E135 PolarHBondContact OG-N 3.34Å; S133-E135 PolarHBondContact OG-O 2.93Å; E135-E137 PolarHBondContact O-N 3.37Å
136	P	62.2	Low	77.4	Confident	77 Å²	77	94.6 Å²	94.6	50%	0.5	48%	0.479	S	S	.	.			trans	-68.4	108.8	176.2	26.7	-31.3	0	0	0	108.9	I138	P136-I138 PolarHBondContact O-N 2.84Å; P136-I138 VanDerWaalsContact O-N 3.16Å
137	E	66.3	Low	77.6	Confident	171 Å²	171	93.8 Å²	93.8	80%	0.799	48%	0.476	S	S	*	.			trans	-63.1	115.9	164.6	-70.6	-172.1	175.3	0	0	108	E135 N139	E135-E137 PolarHBondContact O-N 3.37Å; E137-N139 VanDerWaalsContact C-N 3.33Å; E137-N139 PolarHBondContact O-N 3.4Å
138	I	60.5	Low	77.6	Confident	128 Å²	128	99.1 Å²	99.1	66%	0.656	50%	0.5	S	S	*	.			trans	-73.1	90	-176.4	-56.7	172.6	0	0	0	107.9	P136 D140 L144	P136-I138 PolarHBondContact O-N 2.84Å; P136-I138 VanDerWaalsContact O-N 3.16Å; I138-D140 PolarHBondContact O-N 3.19Å; I138-L144 HydrophobicContact CG2-CD2 4.45Å
139	N	64.6	Low	77.8	Confident	102 Å²	102	99.2 Å²	99.2	55%	0.545	50%	0.503	S	S	.	.			trans	-75.7	113.7	166.9	-74.6	-35.3	0	0	0	109	E137 K141 L142	E137-N139 VanDerWaalsContact C-N 3.33Å; E137-N139 PolarHBondContact O-N 3.4Å; N139-K141 PolarHBondContact O-N 3.18Å; N139-L142 HydrophobicContact CB-CD1 4.19Å; N139-L142 HydrophobicContact CB-CG 4.31Å; N139-L142 PolarHBondContact O-N 3Å
140	D	63.8	Low	78.2	Confident	164 Å²	164	94.3 Å²	94.3	88%	0.877	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-14.6	-177.3	-81.4	-14.7	0	0	0	115.6	I138	I138-D140 PolarHBondContact O-N 3.19Å
141	K	63.7	Low	78.6	Confident	188 Å²	188	91.8 Å²	91.8	82%	0.817	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-18.3	-177.3	-87.3	-179.9	176.2	175.3	0	115.2	Q121 N139	Q121-K141 PolarHBondContact NE2-O 3.28Å; Q121-K141 VanDerWaalsContact NE2-O 3.08Å; N139-K141 PolarHBondContact O-N 3.18Å
142	L	65.9	Low	79	Confident	71 Å²	71	92.1 Å²	92.1	37%	0.372	47%	0.473	S	S	.	.	S	Bend	trans	-86	144.1	-173.9	-60.5	178.4	0	0	0	110.1	L126 N139 L144	L126-L142 HydrophobicContact CD2-CB 4.18Å; L126-L142 HydrophobicContact CD2-CD1 3.64Å; L126-L142 HydrophobicContact CD2-CD2 3.9Å; L126-L142 HydrophobicContact CD2-CG 4.09Å; N139-L142 HydrophobicContact CB-CD1 4.19Å; N139-L142 HydrophobicContact CB-CG 4.31Å; N139-L142 PolarHBondContact O-N 3Å; L142-L144 PolarHBondContact O-N 3.39Å
143	N	70.2	Confident	79.4	Confident	43 Å²	43	87.2 Å²	87.2	23%	0.23	45%	0.445	C	S	.	.			trans	-74.9	58.4	179	-73.1	-24.5	0	0	0	111.3	E120 G145 I146	E120-N143 PolarHBondContact OE2-ND2 3.11Å; N143-G145 PolarHBondContact O-N 3.42Å; N143-I146 HydrophobicContact CB-CD1 3.8Å; N143-I146 PolarHBondContact O-N 2.94Å; N143-I146 VanDerWaalsContact O-N 3.12Å
144	L	80.4	Confident	80.2	Confident	56 Å²	56	85.1 Å²	85.1	29%	0.293	43%	0.43	S	S	.	.	H	α-helix	trans	-56.9	-35.7	-178.1	-178.7	61.4	0	0	0	111.6	I138 L142 I146 L147 E148	I138-L144 HydrophobicContact CG2-CD2 4.45Å; L142-L144 PolarHBondContact O-N 3.39Å; L144-I146 PolarHBondContact O-N 3.34Å; L144-I146 VanDerWaalsContact O-N 3.12Å; L144-L147 PolarHBondContact O-N 3.46Å; L144-L147 VanDerWaalsContact O-N 3.1Å; L144-E148 HydrophobicContact CD1-CG 4.26Å; L144-E148 HydrophobicContact CG-CG 4.1Å; L144-E148 WeakPolarHBondContact O-CG 3.16Å; L144-E148 PolarHBondContact O-N 3.28Å
145	G	87.9	Confident	81	Confident	47 Å²	47	79.3 Å²	79.3	49%	0.485	41%	0.413	S	S	.	.	H	α-helix	trans	-58.5	-28	179.5	0	0	0	0	0	114.1	N143 L149	N143-G145 PolarHBondContact O-N 3.42Å; G145-L149 WeakPolarHBondContact O-CB 3.45Å; G145-L149 PolarHBondContact O-N 3.33Å
146	I	91.2	Very high	82.1	Confident	28 Å²	28	75.5 Å²	75.5	14%	0.144	40%	0.395	C	S	.	.	H	α-helix	trans	-80.8	-35.8	-179.7	-63.2	161.6	0	0	0	110.5	A117 N143 L144 S150	A117-I146 HydrophobicContact CB-CB 4.47Å; A117-I146 HydrophobicContact CB-CD1 3.28Å; A117-I146 HydrophobicContact CB-CG1 4.33Å; A117-I146 HydrophobicContact CB-CG2 3.98Å; N143-I146 HydrophobicContact CB-CD1 3.8Å; N143-I146 PolarHBondContact O-N 2.94Å; N143-I146 VanDerWaalsContact O-N 3.12Å; L144-I146 PolarHBondContact O-N 3.34Å; L144-I146 VanDerWaalsContact O-N 3.12Å; I146-S150 WeakPolarHBondContact O-CB 3.25Å; I146-S150 PolarHBondContact O-N 3.06Å; I146-S150 PolarHBondContact O-OG 3.36Å
147	L	90.6	Very high	83.6	Confident	14 Å²	14	76.3 Å²	76.3	7%	0.073	39%	0.392	C	S	.	.	H	α-helix	trans	-66.2	-48.8	172.3	-174.4	147.9	0	0	0	110.4	F127 W130 L144 L149 S150 V151	F127-L147 HydrophobicContact CB-CD1 4.47Å; F127-L147 HydrophobicContact CD2-CD1 4.32Å; W130-L147 HydrophobicContact CB-CD1 3.78Å; W130-L147 HydrophobicContact CB-CD2 4.42Å; W130-L147 HydrophobicContact CD2-CD2 3.99Å; W130-L147 HydrophobicContact CG-CD1 4.02Å; W130-L147 HydrophobicContact CG-CD2 3.76Å; L144-L147 PolarHBondContact O-N 3.46Å; L144-L147 VanDerWaalsContact O-N 3.1Å; L147-L149 VanDerWaalsContact C-N 3.32Å; L147-L149 PolarHBondContact O-N 2.93Å; L147-S150 PolarHBondContact O-N 3.07Å; L147-S150 VanDerWaalsContact O-N 3.1Å; L147-V151 HydrophobicContact CD2-CG2 4.02Å; L147-V151 WeakPolarHBondContact O-CG2 3.36Å; L147-V151 PolarHBondContact O-N 3.1Å
148	E	91.2	Very high	85.1	Confident	114 Å²	114	73.8 Å²	73.8	53%	0.533	38%	0.375	S	S	.	.	H	α-helix	trans	-59.2	-43.2	175.9	-71.1	179	168.8	0	0	111.9	L144 S150 F152	L144-E148 HydrophobicContact CD1-CG 4.26Å; L144-E148 HydrophobicContact CG-CG 4.1Å; L144-E148 WeakPolarHBondContact O-CG 3.16Å; L144-E148 PolarHBondContact O-N 3.28Å; E148-S150 VanDerWaalsContact C-N 3.33Å; E148-S150 PolarHBondContact O-N 2.75Å; E148-F152 VanDerWaalsContact O-CB 3.25Å; E148-F152 WeakPolarHBondContact O-CB 2.85Å; E148-F152 PolarHBondContact O-N 3.31Å
149	L	95	Very high	86.8	Confident	62 Å²	62	67.8 Å²	67.8	33%	0.325	34%	0.344	S	S	.	.	H	α-helix	trans	-61.6	-42.2	174.8	-177.4	148.8	0	0	0	111.1	L110 G145 L147 F152 W153	L110-L149 HydrophobicContact CD1-CD2 3.3Å; G145-L149 WeakPolarHBondContact O-CB 3.45Å; G145-L149 PolarHBondContact O-N 3.33Å; L147-L149 VanDerWaalsContact C-N 3.32Å; L147-L149 PolarHBondContact O-N 2.93Å; L149-F152 WeakPolarHBondContact O-CB 3.38Å; L149-F152 PolarHBondContact O-N 3.35Å; L149-W153 PolarHBondContact O-N 3.49Å
150	S	95.6	Very high	88.4	Confident	1 Å²	1	63 Å²	63	1%	0.007	32%	0.319	C	S	.	.	H	α-helix	trans	-67.4	-47.3	179.8	-59.6	0	0	0	0	111.9	I146 L147 E148 F152 W153 L154 F164	I146-S150 WeakPolarHBondContact O-CB 3.25Å; I146-S150 PolarHBondContact O-N 3.06Å; I146-S150 PolarHBondContact O-OG 3.36Å; L147-S150 PolarHBondContact O-N 3.07Å; L147-S150 VanDerWaalsContact O-N 3.1Å; E148-S150 VanDerWaalsContact C-N 3.33Å; E148-S150 PolarHBondContact O-N 2.75Å; S150-F152 PolarHBondContact O-N 3.18Å; S150-W153 PolarHBondContact O-N 3.38Å; S150-W153 VanDerWaalsContact O-N 3.14Å; S150-L154 WeakPolarHBondContact O-CB 3.5Å; S150-L154 PolarHBondContact O-N 2.93Å; S150-F164 WeakPolarHBondContact OG-CZ 3.09Å
151	V	94.5	Very high	90	Very high	43 Å²	43	57.2 Å²	57.2	26%	0.261	29%	0.287	S	S	.	.	H	α-helix	trans	-62	-31.7	174.1	173.4	0	0	0	0	111.1	R81 W130 L147 V160	R81-V151 PolarHBondContact NH2-O 3.04Å; W130-V151 HydrophobicContact CH2-CG1 4.49Å; W130-V151 HydrophobicContact CH2-CG2 4.24Å; W130-V151 HydrophobicContact CZ2-CG1 4.48Å; W130-V151 HydrophobicContact CZ2-CG2 4.32Å; L147-V151 HydrophobicContact CD2-CG2 4.02Å; L147-V151 WeakPolarHBondContact O-CG2 3.36Å; L147-V151 PolarHBondContact O-N 3.1Å; V151-V160 HydrophobicContact CG2-CG2 4.36Å
152	F	96.1	Very high	91.6	Very high	76 Å²	76	50.3 Å²	50.3	33%	0.333	26%	0.257	S	S	.	.	H	α-helix	trans	-68.9	-44.7	171.7	177.5	-93.7	0	0	0	112.3	M77 M78 R81 E148 L149 S150	M77-F152 HydrophobicContact CG-CE1 4.15Å; M77-F152 HydrophobicContact CG-CZ 3.89Å; M77-F152 HydrophobicContact SD-CE1 4.42Å; M78-F152 HydrophobicContact CE-CE2 4.22Å; M78-F152 HydrophobicContact CE-CZ 4.45Å; R81-F152 VanDerWaalsContact CD-O 3.31Å; R81-F152 WeakPolarHBondContact CD-O 3.45Å; R81-F152 WeakPolarHBondContact CG-O 3.44Å; R81-F152 PolarHBondContact NE-O 3.48Å; R81-F152 PolarHBondContact NH2-O 2.6Å; E148-F152 VanDerWaalsContact O-CB 3.25Å; E148-F152 WeakPolarHBondContact O-CB 2.85Å; E148-F152 PolarHBondContact O-N 3.31Å; L149-F152 WeakPolarHBondContact O-CB 3.38Å; L149-F152 PolarHBondContact O-N 3.35Å; S150-F152 PolarHBondContact O-N 3.18Å
153	W	98.1	Very high	93.1	Very high	26 Å²	26	46.9 Å²	46.9	10%	0.098	24%	0.239	C	C	.	.	H	α-helix	trans	-78.4	-29.2	-177.2	-77.8	102.6	0	0	0	113.9	M77 L80 R81 V84 Y106 L110 L149 S150	M77-W153 HydrophobicContact SD-CH2 3.36Å; M77-W153 WeakPolarHBondContact SD-CH2 3.42Å; M77-W153 HydrophobicContact SD-CZ2 3.75Å; M77-W153 HydrophobicContact SD-CZ3 4.24Å; L80-W153 HydrophobicContact CB-CZ3 4.12Å; R81-W153 HydrophobicContact CB-CE3 4.48Å; R81-W153 WeakPolarHBondContact CG-O 3.42Å; V84-W153 HydrophobicContact CB-CE3 4.29Å; V84-W153 HydrophobicContact CG2-CE3 4.15Å; V84-W153 HydrophobicContact CG2-CZ3 4.31Å; Y106-W153 AromaticContact CD1-CH2 3.1Å; Y106-W153 HydrophobicContact CD1-CH2 3.1Å; Y106-W153 AromaticContact CD1-CZ2 3.36Å; Y106-W153 HydrophobicContact CD1-CZ2 3.36Å; Y106-W153 AromaticContact CD1-CZ3 3.97Å; Y106-W153 HydrophobicContact CD1-CZ3 3.97Å; Y106-W153 HydrophobicContact CD2-CH2 4.45Å; Y106-W153 AromaticContact CE1-CH2 3.54Å; Y106-W153 HydrophobicContact CE1-CH2 3.54Å; Y106-W153 AromaticContact CE1-CZ2 3.8Å; Y106-W153 HydrophobicContact CE1-CZ2 3.8Å; Y106-W153 AromaticContact CG-CH2 3.62Å; Y106-W153 HydrophobicContact CG-CH2 3.62Å; Y106-W153 HydrophobicContact CG-CZ2 4.23Å; Y106-W153 HydrophobicContact CG-CZ3 4.04Å; L110-W153 HydrophobicContact CD1-CB 4.33Å; L110-W153 HydrophobicContact CD1-CG 4.49Å; L110-W153 HydrophobicContact CD2-CB 3.89Å; L149-W153 PolarHBondContact O-N 3.49Å; S150-W153 PolarHBondContact O-N 3.38Å; S150-W153 VanDerWaalsContact O-N 3.14Å
154	L	97.7	Very high	94.4	Very high	3 Å²	3	45.3 Å²	45.3	2%	0.016	23%	0.23	C	C	.	.			trans	-105	119.7	-175.6	-67.5	168.5	0	0	0	109.9	L88 L110 S150 E156 L159 V160 L163	L88-L154 HydrophobicContact CB-CD2 4.15Å; L88-L154 HydrophobicContact CD1-CD1 4.04Å; L88-L154 HydrophobicContact CD1-CD2 3.5Å; L88-L154 HydrophobicContact CD1-CG 4.22Å; L88-L154 HydrophobicContact CG-CD2 4.29Å; L110-L154 HydrophobicContact CD2-CD1 4.48Å; L110-L154 HydrophobicContact CD2-CG 4.43Å; S150-L154 WeakPolarHBondContact O-CB 3.5Å; S150-L154 PolarHBondContact O-N 2.93Å; L154-E156 VanDerWaalsContact C-N 3.34Å; L154-L159 HydrophobicContact CB-CB 4.21Å; L154-L159 HydrophobicContact CD1-CB 4.29Å; L154-L159 HydrophobicContact CD2-CB 3.83Å; L154-L159 HydrophobicContact CD2-CD1 4.3Å; L154-L159 HydrophobicContact CG-CB 4.33Å; L154-V160 HydrophobicContact CB-CG2 3.77Å; L154-V160 HydrophobicContact CD1-CB 4.43Å; L154-V160 HydrophobicContact CD1-CG2 3.96Å; L154-L163 HydrophobicContact CD1-CB 4.09Å; L154-L163 HydrophobicContact CD1-CD2 3.98Å
155	T	92.6	Very high	95.2	Very high	91 Å²	91	47 Å²	47	56%	0.558	24%	0.235	S	C	*	.	S	Bend	trans	-71.3	-33	-177.3	-57.1	0	0	0	0	112.1	S85	S85-T155 PolarHBondContact OG-N 2.67Å
156	E	95.9	Very high	95.6	Very high	81 Å²	81	47.5 Å²	47.5	38%	0.379	23%	0.229	S	C	.	.	S	Bend	trans	-107.4	136.2	-174.9	-58.3	178.7	-137.4	0	0	110.9	L154 R158 L159	L154-E156 VanDerWaalsContact C-N 3.34Å; E156-R158 VanDerWaalsContact C-N 3.32Å; E156-R158 HydrophobicContact CB-CG 4.14Å; E156-R158 PolarHBondContact O-N 3.41Å; E156-R158 IonicContact OE1-NH2 2.86Å; E156-R158 PolarHBondContact OE1-NH2 3.38Å; E156-R158 IonicContact OE2-CZ 3.97Å; E156-R158 IonicContact OE2-NE 3.84Å; E156-R158 PolarHBondContact OE2-NE 3.44Å; E156-R158 IonicContact OE2-NH2 3.8Å; E156-R158 PolarHBondContact OE2-NH2 2.98Å; E156-L159 HydrophobicContact CB-CD1 3.97Å; E156-L159 HydrophobicContact CB-CG 4.03Å; E156-L159 HydrophobicContact CG-CD1 4.38Å; E156-L159 WeakPolarHBondContact O-CB 3.35Å; E156-L159 PolarHBondContact O-N 2.78Å
157	E	94.5	Very high	96	Very high	93 Å²	93	46.2 Å²	46.2	44%	0.435	22%	0.222	S	C	.	.	H	α-helix	trans	-58.6	-41.7	-179.4	-172.7	-173.5	131.2	0	0	112.5	F127 K131 L159 V160 E161	F127-E157 HydrophobicContact CE1-CG 4.31Å; F127-E157 HydrophobicContact CE2-CG 4.39Å; F127-E157 HydrophobicContact CZ-CG 3.52Å; K131-E157 HydrophobicContact CD-CG 4.37Å; K131-E157 WeakPolarHBondContact CD-OE1 3.44Å; K131-E157 WeakPolarHBondContact CE-OE1 3.15Å; K131-E157 IonicContact NZ-OE1 2.65Å; K131-E157 PolarHBondContact NZ-OE1 2.92Å; E157-L159 PolarHBondContact O-N 3.02Å; E157-L159 VanDerWaalsContact O-N 3.09Å; E157-V160 WeakPolarHBondContact O-CB 3.29Å; E157-V160 PolarHBondContact O-N 3.18Å; E157-E161 PolarHBondContact O-N 2.8Å; E157-E161 VanDerWaalsContact O-N 3.15Å
158	R	96.7	Very high	96.3	Very high	119 Å²	119	45.8 Å²	45.8	45%	0.449	22%	0.22	S	C	.	.	H	α-helix	trans	-56.9	-27.6	176.1	68.8	176.2	179.6	90.5	10.2	113.2	D89 E156 K162	D89-R158 VanDerWaalsContact CG-NH2 3.26Å; D89-R158 IonicContact OD1-CZ 2.63Å; D89-R158 IonicContact OD1-NH1 3.33Å; D89-R158 PolarHBondContact OD1-NH1 2.79Å; D89-R158 IonicContact OD1-NH2 3.3Å; D89-R158 PolarHBondContact OD1-NH2 3.31Å; D89-R158 IonicContact OD2-CZ 3.09Å; D89-R158 IonicContact OD2-NH1 3.31Å; D89-R158 IonicContact OD2-NH2 2.79Å; D89-R158 PolarHBondContact OD2-NH2 2.78Å; E156-R158 VanDerWaalsContact C-N 3.32Å; E156-R158 HydrophobicContact CB-CG 4.14Å; E156-R158 PolarHBondContact O-N 3.41Å; E156-R158 IonicContact OE1-NH2 2.86Å; E156-R158 PolarHBondContact OE1-NH2 3.38Å; E156-R158 IonicContact OE2-CZ 3.97Å; E156-R158 IonicContact OE2-NE 3.84Å; E156-R158 PolarHBondContact OE2-NE 3.44Å; E156-R158 IonicContact OE2-NH2 3.8Å; E156-R158 PolarHBondContact OE2-NH2 2.98Å; R158-K162 WeakPolarHBondContact O-CB 3.28Å; R158-K162 PolarHBondContact O-N 2.83Å
159	L	97.6	Very high	96.5	Very high	1 Å²	1	44 Å²	44	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-78.1	-32	179.2	-62.1	175.3	0	0	0	111.2	S85 D89 L154 E156 E157 K162 L163	S85-L159 WeakPolarHBondContact OG-CD1 3.38Å; D89-L159 HydrophobicContact CB-CD1 4.32Å; D89-L159 HydrophobicContact CB-CD2 3.69Å; L154-L159 HydrophobicContact CB-CB 4.21Å; L154-L159 HydrophobicContact CD1-CB 4.29Å; L154-L159 HydrophobicContact CD2-CB 3.83Å; L154-L159 HydrophobicContact CD2-CD1 4.3Å; L154-L159 HydrophobicContact CG-CB 4.33Å; E156-L159 HydrophobicContact CB-CD1 3.97Å; E156-L159 HydrophobicContact CB-CG 4.03Å; E156-L159 HydrophobicContact CG-CD1 4.38Å; E156-L159 WeakPolarHBondContact O-CB 3.35Å; E156-L159 PolarHBondContact O-N 2.78Å; E157-L159 PolarHBondContact O-N 3.02Å; E157-L159 VanDerWaalsContact O-N 3.09Å; L159-K162 PolarHBondContact O-N 3.16Å; L159-L163 WeakPolarHBondContact O-CB 3.48Å; L159-L163 PolarHBondContact O-N 3.46Å
160	V	97.4	Very high	96.6	Very high	2 Å²	2	44.5 Å²	44.5	1%	0.012	22%	0.216	C	C	.	.	H	α-helix	trans	-65.6	-42.7	172.3	-176.2	0	0	0	0	109.6	F127 V151 L154 E157 K162 L163 F164	F127-V160 HydrophobicContact CD2-CB 4.36Å; F127-V160 HydrophobicContact CD2-CG1 3.58Å; F127-V160 HydrophobicContact CE2-CB 3.68Å; F127-V160 HydrophobicContact CE2-CG1 3.37Å; F127-V160 HydrophobicContact CE2-CG2 4.47Å; F127-V160 HydrophobicContact CG-CG1 4.4Å; F127-V160 HydrophobicContact CZ-CB 3.94Å; F127-V160 HydrophobicContact CZ-CG1 4.06Å; V151-V160 HydrophobicContact CG2-CG2 4.36Å; L154-V160 HydrophobicContact CB-CG2 3.77Å; L154-V160 HydrophobicContact CD1-CB 4.43Å; L154-V160 HydrophobicContact CD1-CG2 3.96Å; E157-V160 WeakPolarHBondContact O-CB 3.29Å; E157-V160 PolarHBondContact O-N 3.18Å; V160-K162 PolarHBondContact O-N 2.65Å; V160-L163 WeakPolarHBondContact O-CB 3.14Å; V160-L163 PolarHBondContact O-N 2.79Å; V160-F164 HydrophobicContact CG1-CD2 4.08Å; V160-F164 HydrophobicContact CG1-CE2 3.55Å; V160-F164 HydrophobicContact CG1-CZ 4.23Å; V160-F164 WeakPolarHBondContact O-CD2 3.39Å; V160-F164 PolarHBondContact O-N 2.63Å
161	E	96.5	Very high	96.7	Very high	43 Å²	43	44.5 Å²	44.5	20%	0.201	22%	0.216	C	C	.	.	H	α-helix	trans	-58.9	-47	171	-69.7	-165.9	-152.1	0	0	112.4	F127 K131 E157 L163 F164 K165	F127-E161 HydrophobicContact CD1-CG 3.67Å; F127-E161 HydrophobicContact CE1-CB 4.33Å; F127-E161 HydrophobicContact CE1-CG 3.05Å; F127-E161 HydrophobicContact CZ-CG 3.86Å; K131-E161 IonicContact NZ-OE1 2.66Å; K131-E161 PolarHBondContact NZ-OE1 3.47Å; E157-E161 PolarHBondContact O-N 2.8Å; E157-E161 VanDerWaalsContact O-N 3.15Å; E161-L163 VanDerWaalsContact C-N 3.26Å; E161-L163 PolarHBondContact O-N 3.11Å; E161-F164 PolarHBondContact O-N 2.82Å; E161-K165 WeakPolarHBondContact O-CB 3.43Å; E161-K165 PolarHBondContact O-N 3.09Å; E161-K165 IonicContact OE2-NZ 3.98Å; E161-K165 PolarHBondContact OE2-NZ 2.98Å
162	K	97.7	Very high	96.8	Very high	42 Å²	42	45.3 Å²	45.3	18%	0.183	21%	0.214	C	C	.	.	H	α-helix	trans	-59.8	-37.7	177.9	-167.9	-177.8	-179	-168.2	0	111.4	L88 D89 E91 R158 L159 V160 V166 F167	L88-K162 WeakPolarHBondContact O-CE 3.19Å; L88-K162 PolarHBondContact O-NZ 2.99Å; D89-K162 PolarHBondContact O-NZ 2.79Å; E91-K162 VanDerWaalsContact OE1-CE 3.32Å; E91-K162 WeakPolarHBondContact OE1-CE 3Å; E91-K162 IonicContact OE1-NZ 2.72Å; E91-K162 PolarHBondContact OE1-NZ 3.31Å; E91-K162 VanDerWaalsContact OE1-NZ 3.1Å; R158-K162 WeakPolarHBondContact O-CB 3.28Å; R158-K162 PolarHBondContact O-N 2.83Å; L159-K162 PolarHBondContact O-N 3.16Å; V160-K162 PolarHBondContact O-N 2.65Å; K162-V166 HydrophobicContact CG-CB 4.22Å; K162-V166 HydrophobicContact CG-CG2 4.22Å; K162-V166 WeakPolarHBondContact O-CA 3.32Å; K162-V166 VanDerWaalsContact O-CB 3.26Å; K162-V166 WeakPolarHBondContact O-CB 3.5Å; K162-V166 PolarHBondContact O-N 3.33Å; K162-F167 HydrophobicContact CD-CE2 3.79Å; K162-F167 HydrophobicContact CD-CZ 4.12Å; K162-F167 HydrophobicContact CG-CD2 4.25Å; K162-F167 HydrophobicContact CG-CE2 3.79Å; K162-F167 HydrophobicContact CG-CZ 4.37Å; K162-F167 PolarHBondContact O-N 3.29Å; K162-F167 VanDerWaalsContact O-N 3.12Å
163	L	97.8	Very high	96.8	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	23%	0.228	C	C	.	.	I	π-helix	trans	-57.5	-52.5	175.4	-177.5	65.7	0	0	0	111.4	L88 L110 I111 L154 L159 V160 E161 F167 V168	L88-L163 HydrophobicContact CD1-CD1 4.14Å; L110-L163 HydrophobicContact CD1-CD2 4.15Å; L110-L163 HydrophobicContact CD2-CD2 4.3Å; L110-L163 HydrophobicContact CG-CD2 4.05Å; I111-L163 HydrophobicContact CG1-CD1 4.21Å; L154-L163 HydrophobicContact CD1-CB 4.09Å; L154-L163 HydrophobicContact CD1-CD2 3.98Å; L159-L163 WeakPolarHBondContact O-CB 3.48Å; L159-L163 PolarHBondContact O-N 3.46Å; V160-L163 WeakPolarHBondContact O-CB 3.14Å; V160-L163 PolarHBondContact O-N 2.79Å; E161-L163 VanDerWaalsContact C-N 3.26Å; E161-L163 PolarHBondContact O-N 3.11Å; L163-F167 HydrophobicContact CD1-CB 4.3Å; L163-F167 PolarHBondContact O-N 2.98Å; L163-V168 WeakPolarHBondContact O-CG2 3.4Å; L163-V168 PolarHBondContact O-N 3.31Å
164	F	96.6	Very high	96.6	Very high	10 Å²	10	49.8 Å²	49.8	4%	0.044	23%	0.233	C	C	.	.	I	π-helix	trans	-80.8	-39.6	-175	-57.9	-39.8	0	0	0	113.9	L123 V124 F127 S150 V160 E161 V168 P169	L123-F164 HydrophobicContact CB-CB 4.11Å; L123-F164 HydrophobicContact CB-CD1 3.8Å; L123-F164 HydrophobicContact CB-CD2 4.04Å; L123-F164 HydrophobicContact CB-CE1 4.2Å; L123-F164 HydrophobicContact CB-CE2 4.4Å; L123-F164 HydrophobicContact CB-CG 3.72Å; L123-F164 HydrophobicContact CB-CZ 4.48Å; L123-F164 HydrophobicContact CD1-CD1 3.47Å; L123-F164 VanDerWaalsContact CD1-CD1 3.47Å; L123-F164 HydrophobicContact CD1-CE1 3.63Å; L123-F164 HydrophobicContact CD1-CG 4.26Å; L123-F164 HydrophobicContact CG-CD1 4.23Å; L123-F164 HydrophobicContact CG-CE1 4.37Å; V124-F164 HydrophobicContact CG2-CB 4.19Å; F127-F164 HydrophobicContact CB-CD2 4.25Å; F127-F164 HydrophobicContact CB-CE2 4.39Å; S150-F164 WeakPolarHBondContact OG-CZ 3.09Å; V160-F164 HydrophobicContact CG1-CD2 4.08Å; V160-F164 HydrophobicContact CG1-CE2 3.55Å; V160-F164 HydrophobicContact CG1-CZ 4.23Å; V160-F164 WeakPolarHBondContact O-CD2 3.39Å; V160-F164 PolarHBondContact O-N 2.63Å; E161-F164 PolarHBondContact O-N 2.82Å; F164-V168 HydrophobicContact CD1-CG2 4.35Å; F164-P169 WeakPolarHBondContact O-CD 3.35Å
165	K	97.4	Very high	96.3	Very high	92 Å²	92	51.9 Å²	51.9	40%	0.4	26%	0.255	S	S	.	.	I	π-helix	trans	-79.2	-31.2	-178.2	-67.6	177.1	-178.5	163.3	0	112.7	V124 E128 E161	V124-K165 HydrophobicContact CG1-CD 4.49Å; V124-K165 VanDerWaalsContact CG1-CE 3.49Å; V124-K165 HydrophobicContact CG1-CG 4.24Å; V124-K165 HydrophobicContact CG2-CG 3.78Å; E128-K165 IonicContact OE1-NZ 3.3Å; E128-K165 PolarHBondContact OE1-NZ 3.48Å; E161-K165 WeakPolarHBondContact O-CB 3.43Å; E161-K165 PolarHBondContact O-N 3.09Å; E161-K165 IonicContact OE2-NZ 3.98Å; E161-K165 PolarHBondContact OE2-NZ 2.98Å
166	V	97.7	Very high	96.3	Very high	57 Å²	57	53.9 Å²	53.9	35%	0.345	25%	0.253	S	S	.	.	I	π-helix	trans	-113.6	-59.6	-172.8	-176.1	0	0	0	0	112.1	K162 R170	K162-V166 HydrophobicContact CG-CB 4.22Å; K162-V166 HydrophobicContact CG-CG2 4.22Å; K162-V166 WeakPolarHBondContact O-CA 3.32Å; K162-V166 VanDerWaalsContact O-CB 3.26Å; K162-V166 WeakPolarHBondContact O-CB 3.5Å; K162-V166 PolarHBondContact O-N 3.33Å; V166-R170 VanDerWaalsContact CG1-NH2 3.26Å; V166-R170 WeakPolarHBondContact O-CB 3.49Å; V166-R170 PolarHBondContact O-N 3.29Å; V166-R170 VanDerWaalsContact O-N 3.09Å
167	F	98.2	Very high	96.3	Very high	0 Å²	0	51 Å²	51	0%	0	24%	0.242	C	C	.	.	I	π-helix	trans	-73.2	-42.1	-168.8	-67.7	-54.1	0	0	0	113.4	L88 E91 K162 L163 R170 Y171 L204	L88-F167 HydrophobicContact CB-CE2 3.94Å; L88-F167 HydrophobicContact CD2-CD2 3.85Å; L88-F167 HydrophobicContact CD2-CE2 3.71Å; L88-F167 HydrophobicContact CD2-CZ 4.26Å; L88-F167 HydrophobicContact CG-CE2 4.34Å; L88-F167 WeakPolarHBondContact O-CE2 3.31Å; L88-F167 WeakPolarHBondContact O-CZ 3.31Å; E91-F167 HydrophobicContact CG-CE1 4.1Å; E91-F167 HydrophobicContact CG-CZ 3.84Å; K162-F167 HydrophobicContact CD-CE2 3.79Å; K162-F167 HydrophobicContact CD-CZ 4.12Å; K162-F167 HydrophobicContact CG-CD2 4.25Å; K162-F167 HydrophobicContact CG-CE2 3.79Å; K162-F167 HydrophobicContact CG-CZ 4.37Å; K162-F167 PolarHBondContact O-N 3.29Å; K162-F167 VanDerWaalsContact O-N 3.12Å; L163-F167 HydrophobicContact CD1-CB 4.3Å; L163-F167 PolarHBondContact O-N 2.98Å; F167-R170 PolarHBondContact O-N 3.12Å; F167-Y171 HydrophobicContact CB-CD2 4.13Å; F167-Y171 HydrophobicContact CB-CE2 4.14Å; F167-Y171 HydrophobicContact CD1-CD2 4.43Å; F167-Y171 AromaticContact CD1-CE2 3.64Å; F167-Y171 HydrophobicContact CD1-CE2 3.64Å; F167-Y171 HydrophobicContact CE1-CE2 4.5Å; F167-Y171 HydrophobicContact CG-CE2 4.27Å; F167-Y171 WeakPolarHBondContact O-CB 3.38Å; F167-Y171 WeakPolarHBondContact O-CD2 3.1Å; F167-Y171 PolarHBondContact O-N 2.87Å; F167-L204 HydrophobicContact CD1-CD1 4.31Å; F167-L204 HydrophobicContact CE1-CD1 3.59Å; F167-L204 HydrophobicContact CE2-CD1 4.42Å; F167-L204 HydrophobicContact CZ-CD1 3.66Å
168	V	97.4	Very high	96.4	Very high	5 Å²	5	46.6 Å²	46.6	3%	0.03	22%	0.221	C	C	.	.	H	α-helix	trans	-61.1	-51.8	179.3	164.9	0	0	0	0	111.5	I115 S118 L163 F164 R170 Y171 R172	I115-V168 HydrophobicContact CG1-CG1 4.27Å; I115-V168 HydrophobicContact CG1-CG2 4.48Å; S118-V168 WeakPolarHBondContact OG-CG1 3.33Å; L163-V168 WeakPolarHBondContact O-CG2 3.4Å; L163-V168 PolarHBondContact O-N 3.31Å; F164-V168 HydrophobicContact CD1-CG2 4.35Å; V168-R170 PolarHBondContact O-N 2.91Å; V168-Y171 PolarHBondContact O-N 2.92Å; V168-R172 WeakPolarHBondContact O-CB 3.48Å; V168-R172 PolarHBondContact O-N 3.33Å
169	P	96.7	Very high	96.4	Very high	78 Å²	78	41 Å²	41	51%	0.506	20%	0.2	S	C	.	.	H	α-helix	trans	-60.4	-41.9	173.7	-27.2	35.7	0	0	0	113.4	F164 Y171	F164-P169 WeakPolarHBondContact O-CD 3.35Å; P169-Y171 VanDerWaalsContact C-N 3.33Å; P169-Y171 PolarHBondContact O-N 3.42Å
170	R	96.8	Very high	96.2	Very high	72 Å²	72	41.8 Å²	41.8	27%	0.272	21%	0.206	S	C	.	.	H	α-helix	trans	-59.5	-41.9	-180	-176.7	-167.7	-64	-172.4	3.2	112.2	E91 V166 F167 V168 Y174 G206	E91-R170 IonicContact OE1-CZ 2.7Å; E91-R170 IonicContact OE1-NH1 3.15Å; E91-R170 IonicContact OE1-NH2 3.63Å; E91-R170 PolarHBondContact OE1-NH2 3.23Å; E91-R170 IonicContact OE2-CZ 3.98Å; E91-R170 IonicContact OE2-NH1 2.78Å; E91-R170 PolarHBondContact OE2-NH1 3.43Å; E91-R170 IonicContact OE2-NH2 3.1Å; V166-R170 VanDerWaalsContact CG1-NH2 3.26Å; V166-R170 WeakPolarHBondContact O-CB 3.49Å; V166-R170 PolarHBondContact O-N 3.29Å; V166-R170 VanDerWaalsContact O-N 3.09Å; F167-R170 PolarHBondContact O-N 3.12Å; V168-R170 PolarHBondContact O-N 2.91Å; R170-Y174 VanDerWaalsContact O-CE2 3.29Å; R170-Y174 WeakPolarHBondContact O-CE2 3.39Å; R170-G206 PolarHBondContact NH1-O 3.35Å; R170-G206 VanDerWaalsContact NH1-O 3.17Å
171	Y	97.9	Very high	96	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-100.2	-0.8	-173.5	-63.6	-48.6	0	0	0	114.6	I111 F167 V168 P169 F173 Y174 Y178 L204 H205	I111-Y171 HydrophobicContact CD1-CD2 4.18Å; I111-Y171 HydrophobicContact CD1-CE2 4.19Å; I111-Y171 HydrophobicContact CG2-CD2 3.96Å; I111-Y171 HydrophobicContact CG2-CG 4.46Å; F167-Y171 HydrophobicContact CB-CD2 4.13Å; F167-Y171 HydrophobicContact CB-CE2 4.14Å; F167-Y171 HydrophobicContact CD1-CD2 4.43Å; F167-Y171 AromaticContact CD1-CE2 3.64Å; F167-Y171 HydrophobicContact CD1-CE2 3.64Å; F167-Y171 HydrophobicContact CE1-CE2 4.5Å; F167-Y171 HydrophobicContact CG-CE2 4.27Å; F167-Y171 WeakPolarHBondContact O-CB 3.38Å; F167-Y171 WeakPolarHBondContact O-CD2 3.1Å; F167-Y171 PolarHBondContact O-N 2.87Å; V168-Y171 PolarHBondContact O-N 2.92Å; P169-Y171 VanDerWaalsContact C-N 3.33Å; P169-Y171 PolarHBondContact O-N 3.42Å; Y171-F173 PolarHBondContact O-N 3.13Å; Y171-Y174 AromaticContact CD1-CD1 3.73Å; Y171-Y174 HydrophobicContact CD1-CD1 3.73Å; Y171-Y174 HydrophobicContact CD1-CD2 4.04Å; Y171-Y174 AromaticContact CD1-CE1 3.55Å; Y171-Y174 HydrophobicContact CD1-CE1 3.55Å; Y171-Y174 AromaticContact CD1-CE2 3.87Å; Y171-Y174 HydrophobicContact CD1-CE2 3.87Å; Y171-Y174 AromaticContact CD1-CG 3.98Å; Y171-Y174 HydrophobicContact CD1-CG 3.98Å; Y171-Y174 AromaticContact CD1-CZ 3.62Å; Y171-Y174 HydrophobicContact CE1-CD1 4.3Å; Y171-Y174 AromaticContact CE1-CE1 3.72Å; Y171-Y174 HydrophobicContact CE1-CE1 3.72Å; Y171-Y174 HydrophobicContact CE1-CE2 4.45Å; Y171-Y174 AromaticContact CE1-CZ 3.81Å; Y171-Y174 WeakPolarHBondContact O-CB 3.44Å; Y171-Y174 PolarHBondContact O-N 3.48Å; Y171-Y178 AromaticContact CD1-CD1 3.94Å; Y171-Y178 HydrophobicContact CD1-CD1 3.94Å; Y171-Y178 HydrophobicContact CD2-CD1 4.39Å; Y171-Y178 HydrophobicContact CD2-CG 4.47Å; Y171-Y178 AromaticContact CG-CD1 3.72Å; Y171-Y178 HydrophobicContact CG-CD1 3.72Å; Y171-Y178 HydrophobicContact CG-CE1 4.37Å; Y171-Y178 HydrophobicContact CG-CG 4.22Å; Y171-L204 HydrophobicContact CE2-CD2 4.41Å; Y171-L204 WeakPolarHBondContact OH-CB 3.32Å; Y171-H205 HydrophobicContact CE1-CB 4.18Å; Y171-H205 WeakPolarHBondContact CE1-O 3.33Å; Y171-H205 PolarHBondContact OH-N 3.13Å; Y171-H205 PolarHBondContact OH-O 2.91Å
172	R	95.4	Very high	95.9	Very high	61 Å²	61	42.1 Å²	42.1	23%	0.23	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.8	-42.7	-173.3	-172.8	171.8	-177.6	115.3	-9.4	113.9	N44 Y45 G46 S118 V168	N44-R172 PolarHBondContact O-NE 2.7Å; N44-R172 PolarHBondContact O-NH2 2.97Å; Y45-R172 CarbonylContact C-O 3.44Å; Y45-R172 WeakPolarHBondContact CA-O 3.42Å; G46-R172 PolarHBondContact N-O 3.4Å; S118-R172 PolarHBondContact O-NH1 2.87Å; S118-R172 PolarHBondContact OG-NH1 3.19Å; V168-R172 WeakPolarHBondContact O-CB 3.48Å; V168-R172 PolarHBondContact O-N 3.33Å
173	F	95.4	Very high	95.5	Very high	142 Å²	142	45.8 Å²	45.8	62%	0.623	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-108.6	19.2	-175.3	-59.7	-69.3	0	0	0	114.1	N44 Y171 G175	N44-F173 WeakPolarHBondContact O-CE1 3.18Å; Y171-F173 PolarHBondContact O-N 3.13Å; F173-G175 PolarHBondContact O-N 3.45Å
174	Y	94.7	Very high	95	Very high	53 Å²	53	48 Å²	48	21%	0.208	24%	0.237	C	C	.	.			trans	-68.1	134.6	179.8	-92.3	-136.4	0	0	0	112	G46 A47 A48 R170 Y171 R176 Y178 H205	G46-Y174 CarbonylContact C-O 3.54Å; A47-Y174 PolarHBondContact N-O 3.01Å; A48-Y174 WeakPolarHBondContact CB-O 3.39Å; A48-Y174 PolarHBondContact N-O 2.94Å; R170-Y174 VanDerWaalsContact O-CE2 3.29Å; R170-Y174 WeakPolarHBondContact O-CE2 3.39Å; Y171-Y174 AromaticContact CD1-CD1 3.73Å; Y171-Y174 HydrophobicContact CD1-CD1 3.73Å; Y171-Y174 HydrophobicContact CD1-CD2 4.04Å; Y171-Y174 AromaticContact CD1-CE1 3.55Å; Y171-Y174 HydrophobicContact CD1-CE1 3.55Å; Y171-Y174 AromaticContact CD1-CE2 3.87Å; Y171-Y174 HydrophobicContact CD1-CE2 3.87Å; Y171-Y174 AromaticContact CD1-CG 3.98Å; Y171-Y174 HydrophobicContact CD1-CG 3.98Å; Y171-Y174 AromaticContact CD1-CZ 3.62Å; Y171-Y174 HydrophobicContact CE1-CD1 4.3Å; Y171-Y174 AromaticContact CE1-CE1 3.72Å; Y171-Y174 HydrophobicContact CE1-CE1 3.72Å; Y171-Y174 HydrophobicContact CE1-CE2 4.45Å; Y171-Y174 AromaticContact CE1-CZ 3.81Å; Y171-Y174 WeakPolarHBondContact O-CB 3.44Å; Y171-Y174 PolarHBondContact O-N 3.48Å; Y174-R176 HydrophobicContact CD1-CG 4.02Å; Y174-R176 HydrophobicContact CE1-CG 4.48Å; Y174-Y178 HydrophobicContact CD1-CD1 4.19Å; Y174-Y178 HydrophobicContact CG-CD1 4.37Å; Y174-H205 HydrophobicContact CE1-CB 3.84Å
175	G	91.5	Very high	94.3	Very high	47 Å²	47	56.6 Å²	56.6	49%	0.485	27%	0.274	S	S	.	.	S	Bend	trans	-97	-10.6	171	0	0	0	0	0	114.3	F173	F173-G175 PolarHBondContact O-N 3.45Å
176	R	92.8	Very high	93.2	Very high	133 Å²	133	54 Å²	54	50%	0.502	27%	0.267	S	S	.	.	S	Bend	trans	-110	171.5	177.6	64.3	173.3	-174.9	-177.4	2	110.9	A48 Y174 H205	A48-R176 WeakPolarHBondContact CB-O 3.33Å; Y174-R176 HydrophobicContact CD1-CG 4.02Å; Y174-R176 HydrophobicContact CE1-CG 4.48Å; R176-H205 PolarHBondContact NH2-ND1 3.35Å
177	S	94.8	Very high	92	Very high	21 Å²	21	53.9 Å²	53.9	15%	0.147	27%	0.267	C	S	.	.			trans	-54.5	151	171.8	52.7	0	0	0	0	110.9	E108 T179 H205	E108-S177 WeakPolarHBondContact OE1-CB 3.4Å; S177-T179 PolarHBondContact OG-O 3.2Å; S177-T179 VanDerWaalsContact OG-O 3.12Å; S177-H205 PolarHBondContact O-CD2 2.82Å
178	Y	97	Very high	90.7	Very high	1 Å²	1	61 Å²	61	0%	0.004	31%	0.31	C	S	.	.	S	Bend	trans	-78.1	-27.3	177.5	-50	-52.8	0	0	0	112.2	A48 A49 E108 I111 Q112 I115 Y171 Y174 H205	A48-Y178 VanDerWaalsContact C-OH 3.23Å; A48-Y178 HydrophobicContact CB-CE1 3.7Å; A48-Y178 PolarHBondContact O-OH 2.78Å; A49-Y178 VanDerWaalsContact CA-OH 3.29Å; A49-Y178 WeakPolarHBondContact CA-OH 3.35Å; A49-Y178 PolarHBondContact N-OH 3.48Å; E108-Y178 PolarHBondContact OE1-N 3.22Å; E108-Y178 WeakPolarHBondContact OE2-CD2 2.96Å; E108-Y178 PolarHBondContact OE2-N 3.34Å; I111-Y178 HydrophobicContact CB-CD2 3.79Å; I111-Y178 HydrophobicContact CB-CE2 3.97Å; I111-Y178 HydrophobicContact CD1-CD2 4.3Å; I111-Y178 HydrophobicContact CD1-CG 4.47Å; I111-Y178 HydrophobicContact CG2-CD1 4.4Å; I111-Y178 HydrophobicContact CG2-CD2 3.56Å; I111-Y178 HydrophobicContact CG2-CE1 4.43Å; I111-Y178 HydrophobicContact CG2-CE2 3.58Å; I111-Y178 HydrophobicContact CG2-CG 3.99Å; Q112-Y178 HydrophobicContact CG-CE2 3.8Å; I115-Y178 HydrophobicContact CD1-CE1 3.98Å; I115-Y178 HydrophobicContact CD1-CE2 4.38Å; I115-Y178 VanDerWaalsContact CD1-OH 3.32Å; I115-Y178 WeakPolarHBondContact CD1-OH 3.29Å; Y171-Y178 AromaticContact CD1-CD1 3.94Å; Y171-Y178 HydrophobicContact CD1-CD1 3.94Å; Y171-Y178 HydrophobicContact CD2-CD1 4.39Å; Y171-Y178 HydrophobicContact CD2-CG 4.47Å; Y171-Y178 AromaticContact CG-CD1 3.72Å; Y171-Y178 HydrophobicContact CG-CD1 3.72Å; Y171-Y178 HydrophobicContact CG-CE1 4.37Å; Y171-Y178 HydrophobicContact CG-CG 4.22Å; Y174-Y178 HydrophobicContact CD1-CD1 4.19Å; Y174-Y178 HydrophobicContact CG-CD1 4.37Å; Y178-H205 PolarHBondContact O-CD2 3.25Å; Y178-H205 VanDerWaalsContact O-CD2 3.25Å; Y178-H205 PolarHBondContact O-N 2.88Å
179	T	96.7	Very high	89.1	Confident	0 Å²	0	70 Å²	70	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	147.5	-178.6	65.9	0	0	0	0	112.3	L87 R104 E108 S177 L202 E203 L204	L87-T179 HydrophobicContact CD2-CG2 4.45Å; R104-T179 WeakPolarHBondContact CG-OG1 3.32Å; R104-T179 PolarHBondContact NE-OG1 2.94Å; R104-T179 PolarHBondContact NH2-O 3.35Å; R104-T179 VanDerWaalsContact NH2-O 3.15Å; E108-T179 HydrophobicContact CG-CG2 4.04Å; E108-T179 WeakPolarHBondContact OE1-CB 3.35Å; E108-T179 PolarHBondContact OE1-N 2.89Å; E108-T179 PolarHBondContact OE1-OG1 3.45Å; S177-T179 PolarHBondContact OG-O 3.2Å; S177-T179 VanDerWaalsContact OG-O 3.12Å; T179-L202 HydrophobicContact CG2-CD1 4.26Å; T179-E203 CarbonylContact C-O 3.48Å; T179-E203 WeakPolarHBondContact CA-O 3.14Å; T179-E203 WeakPolarHBondContact CB-O 3.42Å; T179-L204 HydrophobicContact CG2-CD2 3.77Å
180	S	94.3	Very high	87.4	Confident	19 Å²	19	71.2 Å²	71.2	13%	0.133	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	152.1	163.6	-174.8	0	0	0	0	110.3	R104 F182 L202 E203	R104-S180 VanDerWaalsContact NH2-CA 3.31Å; S180-F182 WeakPolarHBondContact OG-CE1 3.34Å; S180-F182 WeakPolarHBondContact OG-CZ 3.34Å; S180-L202 WeakPolarHBondContact O-CD1 3.29Å; S180-E203 WeakPolarHBondContact CB-OE1 3.41Å; S180-E203 PolarHBondContact N-O 3.04Å; S180-E203 PolarHBondContact O-N 2.82Å
181	L	93.8	Very high	85.6	Confident	22 Å²	22	71.9 Å²	71.9	12%	0.115	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	125.2	-175.7	178.5	71	0	0	0	108	W97 A100 I101 I201 L202	W97-L181 HydrophobicContact CE3-CD1 4.4Å; W97-L181 HydrophobicContact CE3-CD2 4.4Å; W97-L181 HydrophobicContact CE3-CG 4.38Å; W97-L181 HydrophobicContact CH2-CD1 4.5Å; W97-L181 HydrophobicContact CH2-CD2 3.48Å; W97-L181 VanDerWaalsContact CH2-CD2 3.48Å; W97-L181 HydrophobicContact CH2-CG 3.64Å; W97-L181 HydrophobicContact CZ2-CD2 4.05Å; W97-L181 HydrophobicContact CZ3-CD1 3.89Å; W97-L181 HydrophobicContact CZ3-CD2 3.69Å; W97-L181 HydrophobicContact CZ3-CG 3.48Å; W97-L181 VanDerWaalsContact CZ3-CG 3.48Å; A100-L181 HydrophobicContact CB-CD1 3.53Å; I101-L181 HydrophobicContact CG1-CD2 3.86Å; L181-I201 VanDerWaalsContact CA-O 3.32Å; L181-I201 WeakPolarHBondContact CA-O 3.26Å; L181-L202 HydrophobicContact CB-CD1 4.43Å; L181-L202 HydrophobicContact CD1-CB 4.12Å; L181-L202 HydrophobicContact CD1-CD1 4.23Å
182	F	92.3	Very high	83.6	Confident	29 Å²	29	80.6 Å²	80.6	13%	0.127	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	136.6	-177.9	-54.6	-54.4	0	0	0	109.6	S180 G200 I201 E203 V212 H213	S180-F182 WeakPolarHBondContact OG-CE1 3.34Å; S180-F182 WeakPolarHBondContact OG-CZ 3.34Å; F182-G200 CarbonylContact O-C 3.39Å; F182-G200 WeakPolarHBondContact O-CA 3.14Å; F182-I201 PolarHBondContact N-O 2.97Å; F182-I201 PolarHBondContact O-N 2.72Å; F182-E203 HydrophobicContact CE2-CG 4.17Å; F182-E203 WeakPolarHBondContact CE2-OE1 3.49Å; F182-E203 WeakPolarHBondContact CZ-OE1 3.37Å; F182-V212 HydrophobicContact CB-CG1 4.23Å; F182-V212 HydrophobicContact CD2-CB 3.53Å; F182-V212 HydrophobicContact CD2-CG1 3.72Å; F182-V212 HydrophobicContact CD2-CG2 3.75Å; F182-V212 HydrophobicContact CE2-CB 3.63Å; F182-V212 HydrophobicContact CE2-CG1 4.29Å; F182-V212 HydrophobicContact CE2-CG2 3.94Å; F182-V212 HydrophobicContact CG-CB 4.39Å; F182-V212 HydrophobicContact CG-CG1 4.17Å; F182-H213 AromaticContact CD1-CE1 3.09Å; F182-H213 WeakPolarHBondContact CD1-CE1 3.44Å; F182-H213 AromaticContact CD1-ND1 3.41Å; F182-H213 WeakPolarHBondContact CD1-ND1 3.02Å; F182-H213 AromaticContact CE1-CE1 3.21Å; F182-H213 WeakPolarHBondContact CE1-CE1 3.4Å; F182-H213 AromaticContact CE1-ND1 3.05Å; F182-H213 WeakPolarHBondContact CE1-ND1 3.47Å; F182-H213 AromaticContact CG-CE1 3.81Å; F182-H213 AromaticContact CZ-ND1 3.42Å; F182-H213 WeakPolarHBondContact CZ-ND1 3.46Å
183	Q	90.6	Very high	81.4	Confident	119 Å²	119	84.1 Å²	84.1	56%	0.556	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.9	128.9	175.4	-170.6	174.3	-25.3	0	0	108.7	W97 S198	W97-Q183 HydrophobicContact CD2-CG 4.43Å; W97-Q183 HydrophobicContact CE3-CB 4.03Å; W97-Q183 HydrophobicContact CE3-CG 4.1Å; W97-Q183 HydrophobicContact CH2-CB 4.01Å; W97-Q183 HydrophobicContact CZ3-CB 3.66Å; W97-Q183 HydrophobicContact CZ3-CG 4.25Å; Q183-S198 PolarHBondContact NE2-OG 3.42Å
184	I	87.3	Confident	79.4	Confident	48 Å²	48	83.1 Å²	83.1	25%	0.246	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	162.7	178.7	58.6	163.7	0	0	0	110.7	F199 I201	I184-F199 HydrophobicContact CD1-CB 4.04Å; I184-F199 HydrophobicContact CG1-CB 3.68Å; I184-F199 PolarHBondContact N-O 3.46Å; I184-F199 PolarHBondContact O-N 3.21Å; I184-I201 HydrophobicContact CD1-CD1 4.21Å; I184-I201 HydrophobicContact CD1-CG1 3.77Å; I184-I201 HydrophobicContact CG1-CG1 4.21Å; I184-I201 HydrophobicContact CG2-CD1 3.66Å; I184-I201 HydrophobicContact CG2-CG1 3.83Å
185	F	81.6	Confident	77.5	Confident	190 Å²	190	83.2 Å²	83.2	83%	0.833	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-63	145.4	170.1	-65.8	-74.1	0	0	0	110.2
186	P	75.2	Confident	75.6	Confident	38 Å²	38	86.8 Å²	86.8	25%	0.247	47%	0.468	C	S	.	.	P	Polyproline II helix	trans	-64.1	146.9	176.5	31.5	-37.1	0	0	0	110.2	I191 T196 F199	P186-I191 HydrophobicContact CB-CD1 3.7Å; P186-I191 HydrophobicContact CG-CD1 4.37Å; P186-T196 HydrophobicContact CG-CG2 3.97Å; P186-F199 HydrophobicContact CB-CD2 4.11Å
187	P	71.7	Confident	74.5	Confident	53 Å²	53	85.8 Å²	85.8	34%	0.344	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-62.5	141.9	-177.6	25.6	-34.5	0	0	0	111.2	Y189 I191 F199	P187-Y189 PolarHBondContact O-N 3.37Å; P187-I191 HydrophobicContact CG-CD1 4.43Å; P187-I191 WeakPolarHBondContact O-CD1 3.36Å; P187-I191 WeakPolarHBondContact O-CG1 3.35Å; P187-F199 HydrophobicContact CG-CE1 4.28Å; P187-F199 HydrophobicContact CG-CE2 4.24Å; P187-F199 HydrophobicContact CG-CZ 4.08Å
188	V	70.8	Confident	74	Confident	149 Å²	149	86.9 Å²	86.9	90%	0.903	48%	0.475	S	S	*	.	S	Bend	trans	-62.9	-30.6	-175.4	-178.8	0	0	0	0	112.6
189	Y	64.6	Low	73.6	Confident	195 Å²	195	89 Å²	89	77%	0.765	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-146.2	147.9	-178.1	-174.3	-92	0	0	0	110.9	P187	P187-Y189 PolarHBondContact O-N 3.37Å
190	P	59.5	Low	73.3	Confident	103 Å²	103	89 Å²	89	67%	0.669	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	cis	-88.1	102	-8.6	32	-29.8	0	0	0	111
191	I	59.6	Low	73.4	Confident	86 Å²	86	88.7 Å²	88.7	44%	0.441	48%	0.481	S	S	.	.			trans	-101.9	125.1	176.5	-70.4	-167.9	0	0	0	111.7	P186 P187	P186-I191 HydrophobicContact CB-CD1 3.7Å; P186-I191 HydrophobicContact CG-CD1 4.37Å; P187-I191 HydrophobicContact CG-CD1 4.43Å; P187-I191 WeakPolarHBondContact O-CD1 3.36Å; P187-I191 WeakPolarHBondContact O-CG1 3.35Å
192	K	56.2	Low	73.5	Confident	184 Å²	184	87.7 Å²	87.7	80%	0.8	48%	0.476	S	S	*	.			trans	-71.9	132.2	157.6	-65.1	-176.9	178.3	-175.7	0	108	C194	K192-C194 PolarHBondContact O-N 3.43Å
193	P	48.1	Very low	73.7	Confident	134 Å²	134	86.9 Å²	86.9	87%	0.87	47%	0.473	S	S	*	.	S	Bend	trans	-68.1	5	-172.4	27.8	-35.1	0	0	0	114.7	G195	P193-G195 PolarHBondContact O-N 3.11Å
194	C	54.8	Low	74	Confident	121 Å²	121	81.2 Å²	81.2	82%	0.818	45%	0.446	S	S	*	.	S	Bend	trans	-96.4	90	-170.9	-158.3	0	0	0	0	111.5	K192	K192-C194 PolarHBondContact O-N 3.43Å
195	G	54.3	Low	74.3	Confident	55 Å²	55	80.2 Å²	80.2	57%	0.567	44%	0.44	S	S	*	.			trans	86.8	87.8	167.3	0	0	0	0	0	112.3	P193 K197	P193-G195 PolarHBondContact O-N 3.11Å; G195-K197 VanDerWaalsContact C-N 3.34Å; G195-K197 PolarHBondContact O-N 2.9Å
196	T	52.6	Low	74.8	Confident	122 Å²	122	73.7 Å²	73.7	75%	0.748	43%	0.427	S	S	*	.			trans	-43.3	94	168.9	-41.1	0	0	0	0	110.2	P186 S198	P186-T196 HydrophobicContact CG-CG2 3.97Å; T196-S198 PolarHBondContact O-N 2.9Å
197	K	69.8	Low	75.6	Confident	113 Å²	113	73.3 Å²	73.3	49%	0.491	42%	0.423	S	S	.	.			trans	-83.2	114.1	168.4	-69.2	177.4	-172.3	171.4	0	104.7	G195 F199	G195-K197 VanDerWaalsContact C-N 3.34Å; G195-K197 PolarHBondContact O-N 2.9Å; K197-F199 PolarHBondContact O-N 3.49Å
198	S	82.7	Confident	76.6	Confident	43 Å²	43	75.9 Å²	75.9	30%	0.301	44%	0.439	S	S	.	.			trans	-47.1	139.6	167.4	-54.7	0	0	0	0	108.9	W97 Q183 T196	W97-S198 WeakPolarHBondContact CB-O 3.25Å; W97-S198 PolarHBondContact N-O 3Å; Q183-S198 PolarHBondContact NE2-OG 3.42Å; T196-S198 PolarHBondContact O-N 2.9Å
199	F	89.1	Confident	77.5	Confident	46 Å²	46	74.4 Å²	74.4	20%	0.202	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	160.5	170.9	-97.6	-113.2	0	0	0	109.2	L95 P96 I184 P186 P187 K197	L95-F199 CarbonylContact O-C 3.52Å; L95-F199 WeakPolarHBondContact O-CA 3.42Å; L95-F199 WeakPolarHBondContact O-CD1 3.34Å; P96-F199 HydrophobicContact CG-CE2 4.4Å; P96-F199 HydrophobicContact CG-CZ 4.12Å; I184-F199 HydrophobicContact CD1-CB 4.04Å; I184-F199 HydrophobicContact CG1-CB 3.68Å; I184-F199 PolarHBondContact N-O 3.46Å; I184-F199 PolarHBondContact O-N 3.21Å; P186-F199 HydrophobicContact CB-CD2 4.11Å; P187-F199 HydrophobicContact CG-CE1 4.28Å; P187-F199 HydrophobicContact CG-CE2 4.24Å; P187-F199 HydrophobicContact CG-CZ 4.08Å; K197-F199 PolarHBondContact O-N 3.49Å
200	G	91.6	Very high	78.6	Confident	0 Å²	0	69.3 Å²	69.3	0%	0	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	144.7	174.3	0	0	0	0	0	111.9	L95 F182	L95-G200 PolarHBondContact N-O 2.7Å; L95-G200 PolarHBondContact O-N 2.89Å; F182-G200 CarbonylContact O-C 3.39Å; F182-G200 WeakPolarHBondContact O-CA 3.14Å
201	I	95	Very high	79.7	Confident	13 Å²	13	67 Å²	67	7%	0.067	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	118.1	169.1	-55.9	176.8	0	0	0	106.8	R92 I93 E94 L181 F182 I184 V212	R92-I201 HydrophobicContact CG-CG2 3.57Å; I93-I201 WeakPolarHBondContact O-CA 3.17Å; E94-I201 HydrophobicContact CG-CG1 4.21Å; L181-I201 VanDerWaalsContact CA-O 3.32Å; L181-I201 WeakPolarHBondContact CA-O 3.26Å; F182-I201 PolarHBondContact N-O 2.97Å; F182-I201 PolarHBondContact O-N 2.72Å; I184-I201 HydrophobicContact CD1-CD1 4.21Å; I184-I201 HydrophobicContact CD1-CG1 3.77Å; I184-I201 HydrophobicContact CG1-CG1 4.21Å; I184-I201 HydrophobicContact CG2-CD1 3.66Å; I184-I201 HydrophobicContact CG2-CG1 3.83Å; I201-V212 HydrophobicContact CD1-CG1 3.83Å; I201-V212 HydrophobicContact CD1-CG2 3.89Å; I201-V212 HydrophobicContact CG2-CG2 4.06Å
202	L	97	Very high	80.7	Confident	0 Å²	0	65 Å²	65	0%	0	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	122.2	171	179.2	60.8	0	0	0	108.2	L87 R92 I93 T103 R104 T179 S180 L181	L87-L202 HydrophobicContact CD1-CB 4.47Å; L87-L202 HydrophobicContact CD1-CD2 4.23Å; L87-L202 HydrophobicContact CD1-CG 3.87Å; L87-L202 WeakPolarHBondContact CD1-O 3.41Å; L87-L202 HydrophobicContact CD2-CD2 3.65Å; L87-L202 HydrophobicContact CD2-CG 3.99Å; R92-L202 WeakPolarHBondContact CA-O 3.37Å; I93-L202 HydrophobicContact CG1-CB 4.12Å; I93-L202 PolarHBondContact N-O 2.59Å; I93-L202 PolarHBondContact O-N 3Å; T103-L202 HydrophobicContact CG2-CD2 3.84Å; R104-L202 HydrophobicContact CB-CD1 3.8Å; R104-L202 HydrophobicContact CB-CD2 4.19Å; R104-L202 HydrophobicContact CG-CD1 4.49Å; T179-L202 HydrophobicContact CG2-CD1 4.26Å; S180-L202 WeakPolarHBondContact O-CD1 3.29Å; L181-L202 HydrophobicContact CB-CD1 4.43Å; L181-L202 HydrophobicContact CD1-CB 4.12Å; L181-L202 HydrophobicContact CD1-CD1 4.23Å
203	E	95.8	Very high	81.4	Confident	12 Å²	12	60.6 Å²	60.6	6%	0.056	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	152.2	-177.1	66.6	174.4	-161.7	0	0	111.9	E91 R92 T179 S180 F182	E91-E203 WeakPolarHBondContact O-CA 3.14Å; R92-E203 HydrophobicContact CB-CB 4.3Å; R92-E203 HydrophobicContact CG-CB 4.11Å; T179-E203 CarbonylContact C-O 3.48Å; T179-E203 WeakPolarHBondContact CA-O 3.14Å; T179-E203 WeakPolarHBondContact CB-O 3.42Å; S180-E203 WeakPolarHBondContact CB-OE1 3.41Å; S180-E203 PolarHBondContact N-O 3.04Å; S180-E203 PolarHBondContact O-N 2.82Å; F182-E203 HydrophobicContact CE2-CG 4.17Å; F182-E203 WeakPolarHBondContact CE2-OE1 3.49Å; F182-E203 WeakPolarHBondContact CZ-OE1 3.37Å
204	L	97.4	Very high	81.6	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	141.8	170.2	-72.6	171.3	0	0	0	109.9	L87 L88 E91 I111 F167 Y171 T179 N207	L87-L204 HydrophobicContact CD1-CG 4.32Å; L87-L204 HydrophobicContact CG-CD1 4.45Å; L87-L204 HydrophobicContact CG-CG 4.3Å; L88-L204 HydrophobicContact CD2-CD1 3.77Å; E91-L204 HydrophobicContact CB-CB 4.31Å; E91-L204 HydrophobicContact CB-CD1 4.29Å; E91-L204 HydrophobicContact CG-CD1 4.29Å; E91-L204 PolarHBondContact O-N 3.35Å; I111-L204 HydrophobicContact CD1-CD2 4.04Å; F167-L204 HydrophobicContact CD1-CD1 4.31Å; F167-L204 HydrophobicContact CE1-CD1 3.59Å; F167-L204 HydrophobicContact CE2-CD1 4.42Å; F167-L204 HydrophobicContact CZ-CD1 3.66Å; Y171-L204 HydrophobicContact CE2-CD2 4.41Å; Y171-L204 WeakPolarHBondContact OH-CB 3.32Å; T179-L204 HydrophobicContact CG2-CD2 3.77Å; L204-N207 VanDerWaalsContact O-CB 3.25Å; L204-N207 WeakPolarHBondContact O-CB 3.41Å; L204-N207 VanDerWaalsContact O-CG 3.22Å; L204-N207 PolarHBondContact O-N 3.15Å; L204-N207 PolarHBondContact O-ND2 2.98Å
205	H	93.8	Very high	81.1	Confident	27 Å²	27	54.1 Å²	54.1	13%	0.125	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	142.1	177.1	-75.3	-55.4	0	0	0	112.5	Y171 Y174 R176 S177 Y178 N207	Y171-H205 HydrophobicContact CE1-CB 4.18Å; Y171-H205 WeakPolarHBondContact CE1-O 3.33Å; Y171-H205 PolarHBondContact OH-N 3.13Å; Y171-H205 PolarHBondContact OH-O 2.91Å; Y174-H205 HydrophobicContact CE1-CB 3.84Å; R176-H205 PolarHBondContact NH2-ND1 3.35Å; S177-H205 PolarHBondContact O-CD2 2.82Å; Y178-H205 PolarHBondContact O-CD2 3.25Å; Y178-H205 VanDerWaalsContact O-CD2 3.25Å; Y178-H205 PolarHBondContact O-N 2.88Å; H205-N207 VanDerWaalsContact C-N 3.26Å
206	G	91	Very high	80.5	Confident	54 Å²	54	52.1 Å²	52.1	56%	0.557	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.6	23.7	-174.6	0	0	0	0	0	112.7	R170	R170-G206 PolarHBondContact NH1-O 3.35Å; R170-G206 VanDerWaalsContact NH1-O 3.17Å
207	N	92.8	Very high	80	Confident	30 Å²	30	54 Å²	54	16%	0.16	30%	0.3	C	S	.	.			trans	-66.9	155.9	169.7	62.1	0.7	0	0	0	111.4	E91 L204 H205 W209	E91-N207 HydrophobicContact CB-CB 3.71Å; E91-N207 VanDerWaalsContact OE2-CA 3.31Å; E91-N207 WeakPolarHBondContact OE2-CA 3.34Å; L204-N207 VanDerWaalsContact O-CB 3.25Å; L204-N207 WeakPolarHBondContact O-CB 3.41Å; L204-N207 VanDerWaalsContact O-CG 3.22Å; L204-N207 PolarHBondContact O-N 3.15Å; L204-N207 PolarHBondContact O-ND2 2.98Å; H205-N207 VanDerWaalsContact C-N 3.26Å; N207-W209 PolarHBondContact O-N 3.09Å
208	P	91.6	Very high	78.9	Confident	106 Å²	106	53.7 Å²	53.7	69%	0.688	32%	0.318	S	S	*	.	S	Bend	trans	-79.7	3.4	179.4	32.8	-36.7	0	0	0	113.6	E91	E91-P208 WeakPolarHBondContact OE2-CD 3.38Å
209	W	91.2	Very high	77.2	Confident	118 Å²	118	56 Å²	56	45%	0.447	35%	0.348	S	S	.	.	S	Bend	trans	-87.4	152.3	-174.2	-64.9	110	0	0	0	112	D90 R92 N207	D90-W209 PolarHBondContact O-NE1 3.02Å; R92-W209 HydrophobicContact CB-CG 4.25Å; N207-W209 PolarHBondContact O-N 3.09Å
210	P	87.3	Confident	74.9	Confident	88 Å²	88	62.8 Å²	62.8	57%	0.571	37%	0.373	S	S	*	.	P	Polyproline II helix	trans	-58.8	137.4	170.3	25.7	-33.3	0	0	0	109.6	R92	R92-P210 PolarHBondContact NH1-O 3.35Å
211	P	82	Confident	72.7	Confident	56 Å²	56	66.7 Å²	66.7	36%	0.364	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-67	137	-175.9	28.5	-35.8	0	0	0	110.9	H213 H215	P211-H213 CarbonylContact C-O 3.1Å; P211-H213 WeakPolarHBondContact CB-O 3.36Å; P211-H213 CarbonylContact O-C 3.47Å; P211-H215 HydrophobicContact CB-CB 3.94Å; P211-H215 HydrophobicContact CG-CB 3.83Å; P211-H215 VanDerWaalsContact CG-N 3.3Å
212	V	80.3	Confident	70.5	Confident	44 Å²	44	71.4 Å²	71.4	27%	0.267	43%	0.425	S	S	.	.	S	Bend	trans	-67.6	-48.6	-172.4	174.8	0	0	0	0	112.8	F182 I201	F182-V212 HydrophobicContact CB-CG1 4.23Å; F182-V212 HydrophobicContact CD2-CB 3.53Å; F182-V212 HydrophobicContact CD2-CG1 3.72Å; F182-V212 HydrophobicContact CD2-CG2 3.75Å; F182-V212 HydrophobicContact CE2-CB 3.63Å; F182-V212 HydrophobicContact CE2-CG1 4.29Å; F182-V212 HydrophobicContact CE2-CG2 3.94Å; F182-V212 HydrophobicContact CG-CB 4.39Å; F182-V212 HydrophobicContact CG-CG1 4.17Å; I201-V212 HydrophobicContact CD1-CG1 3.83Å; I201-V212 HydrophobicContact CD1-CG2 3.89Å; I201-V212 HydrophobicContact CG2-CG2 4.06Å
213	H	70.3	Confident	68.2	Low	91 Å²	91	74.2 Å²	74.2	42%	0.421	44%	0.44	S	S	.	.	S	Bend	trans	-80.4	111.7	155.1	-57.8	101.7	0	0	0	103.4	F182 P211 H215 L222	F182-H213 AromaticContact CD1-CE1 3.09Å; F182-H213 WeakPolarHBondContact CD1-CE1 3.44Å; F182-H213 AromaticContact CD1-ND1 3.41Å; F182-H213 WeakPolarHBondContact CD1-ND1 3.02Å; F182-H213 AromaticContact CE1-CE1 3.21Å; F182-H213 WeakPolarHBondContact CE1-CE1 3.4Å; F182-H213 AromaticContact CE1-ND1 3.05Å; F182-H213 WeakPolarHBondContact CE1-ND1 3.47Å; F182-H213 AromaticContact CG-CE1 3.81Å; F182-H213 AromaticContact CZ-ND1 3.42Å; F182-H213 WeakPolarHBondContact CZ-ND1 3.46Å; P211-H213 CarbonylContact C-O 3.1Å; P211-H213 WeakPolarHBondContact CB-O 3.36Å; P211-H213 CarbonylContact O-C 3.47Å; H213-H215 PolarHBondContact O-N 2.9Å; H213-H215 PolarHBondContact O-ND1 3.23Å; H213-L222 CarbonylContact C-O 2.74Å
214	G	52.7	Low	65.9	Low	10 Å²	10	76.9 Å²	76.9	10%	0.103	46%	0.458	C	S	.	.			trans	-55.8	83	-174.5	0	0	0	0	0	111.6	G216 L222 N223 P224	G214-G216 VanDerWaalsContact C-N 3.33Å; G214-G216 PolarHBondContact O-N 3.34Å; G214-L222 CarbonylContact C-O 3.11Å; G214-L222 WeakPolarHBondContact CA-O 3.34Å; G214-L222 PolarHBondContact N-O 3Å; G214-L222 CarbonylContact O-C 3.45Å; G214-L222 WeakPolarHBondContact O-CA 3.33Å; G214-N223 WeakPolarHBondContact CA-OD1 3.5Å; G214-N223 PolarHBondContact N-OD1 2.72Å; G214-N223 WeakPolarHBondContact O-CA 3.45Å; G214-N223 PolarHBondContact O-N 3.01Å; G214-P224 WeakPolarHBondContact O-CD 3.47Å
215	H	44.4	Very low	64	Low	108 Å²	108	80.6 Å²	80.6	50%	0.5	48%	0.475	S	S	.	.			trans	-62	103.8	174.5	-73.6	61.8	0	0	0	105.8	P211 H213 I217	P211-H215 HydrophobicContact CB-CB 3.94Å; P211-H215 HydrophobicContact CG-CB 3.83Å; P211-H215 VanDerWaalsContact CG-N 3.3Å; H213-H215 PolarHBondContact O-N 2.9Å; H213-H215 PolarHBondContact O-ND1 3.23Å; H215-I217 PolarHBondContact O-N 3.14Å
216	G	41.7	Very low	62.4	Low	14 Å²	14	83.8 Å²	83.8	14%	0.144	50%	0.498	C	S	.	.			trans	-52.1	128.6	156.4	0	0	0	0	0	106.3	G214 A218 R220	G214-G216 VanDerWaalsContact C-N 3.33Å; G214-G216 PolarHBondContact O-N 3.34Å; G216-A218 PolarHBondContact O-N 2.94Å; G216-R220 WeakPolarHBondContact CA-O 3.39Å
217	I	42.5	Very low	61.4	Low	162 Å²	162	87 Å²	87	83%	0.831	50%	0.497	S	S	*	.	S	Bend	trans	-33.5	127.5	156.1	-61.9	166.2	0	0	0	107.2	H215 G219 R220	H215-I217 PolarHBondContact O-N 3.14Å; I217-G219 PolarHBondContact O-N 3.05Å; I217-G219 VanDerWaalsContact O-N 3.16Å; I217-R220 PolarHBondContact O-N 2.61Å
218	A	46.6	Very low	60.3	Low	105 Å²	105	88.8 Å²	88.8	87%	0.868	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-24.8	113.5	-171.2	0	0	0	0	0	113.5	G216	G216-A218 PolarHBondContact O-N 2.94Å
219	G	46.2	Very low	59.7	Low	91 Å²	91	89.9 Å²	89.9	94%	0.938	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	105.3	1.2	178.2	0	0	0	0	0	116.5	I217	I217-G219 PolarHBondContact O-N 3.05Å; I217-G219 VanDerWaalsContact O-N 3.16Å
220	R	42.4	Very low	59.2	Low	190 Å²	190	92.9 Å²	92.9	72%	0.717	52%	0.516	S	S	*	.	S	Bend	trans	-116.3	135.5	169.8	-157.3	175.6	-78.5	-142.1	-0.4	110.3	G216 I217	G216-R220 WeakPolarHBondContact CA-O 3.39Å; I217-R220 PolarHBondContact O-N 2.61Å
221	S	45.2	Very low	59.1	Low	81 Å²	81	92.9 Å²	92.9	57%	0.566	51%	0.505	S	S	*	.			trans	-40.9	140.8	-175.6	-140.8	0	0	0	0	112.7	N223	S221-N223 CarbonylContact O-C 3.57Å; S221-N223 PolarHBondContact O-N 2.7Å
222	L	47.4	Very low	59.5	Low	113 Å²	113	96.3 Å²	96.3	59%	0.592	52%	0.52	S	S	*	.	S	Bend	trans	-59.8	10	-168.7	-81.2	149	0	0	0	117.2	H213 G214	H213-L222 CarbonylContact C-O 2.74Å; G214-L222 CarbonylContact C-O 3.11Å; G214-L222 WeakPolarHBondContact CA-O 3.34Å; G214-L222 PolarHBondContact N-O 3Å; G214-L222 CarbonylContact O-C 3.45Å; G214-L222 WeakPolarHBondContact O-CA 3.33Å
223	N	48.7	Very low	60.1	Low	59 Å²	59	99.7 Å²	99.7	32%	0.316	54%	0.535	S	S	.	.	S	Bend	trans	-147.4	114.1	151.9	-91.4	-50.5	0	0	0	104.1	G214 S221 E225	G214-N223 WeakPolarHBondContact CA-OD1 3.5Å; G214-N223 PolarHBondContact N-OD1 2.72Å; G214-N223 WeakPolarHBondContact O-CA 3.45Å; G214-N223 PolarHBondContact O-N 3.01Å; S221-N223 CarbonylContact O-C 3.57Å; S221-N223 PolarHBondContact O-N 2.7Å; N223-E225 HydrophobicContact CB-CB 4.47Å; N223-E225 HydrophobicContact CB-CG 4.04Å; N223-E225 PolarHBondContact O-N 2.94Å
224	P	49.4	Very low	61	Low	68 Å²	68	97.2 Å²	97.2	44%	0.442	53%	0.525	S	S	.	.			trans	-71.2	67.2	157.9	32.9	-32.7	0	0	0	105.6	G214 P226	G214-P224 WeakPolarHBondContact O-CD 3.47Å; P224-P226 VanDerWaalsContact C-N 3.32Å; P224-P226 WeakPolarHBondContact O-CD 3.36Å
225	E	57.6	Low	63.1	Low	77 Å²	77	100.1 Å²	100.1	36%	0.36	54%	0.54	S	S	.	.			trans	-56.6	107.7	159.3	-93.8	173.3	-138.3	0	0	104	N223 F227 Q228 Y231	N223-E225 HydrophobicContact CB-CB 4.47Å; N223-E225 HydrophobicContact CB-CG 4.04Å; N223-E225 PolarHBondContact O-N 2.94Å; E225-F227 PolarHBondContact O-N 3.1Å; E225-F227 VanDerWaalsContact O-N 3.15Å; E225-Q228 HydrophobicContact CB-CB 4.36Å; E225-Q228 PolarHBondContact O-N 3.32Å; E225-Y231 WeakPolarHBondContact CB-OH 3.31Å; E225-Y231 WeakPolarHBondContact CG-OH 3.48Å; E225-Y231 WeakPolarHBondContact OE2-CE2 3.34Å; E225-Y231 PolarHBondContact OE2-OH 3.49Å
226	P	59.7	Low	65.5	Low	94 Å²	94	100 Å²	100	61%	0.61	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	131.5	-174.5	25.4	-32.6	0	0	0	106.3	P224 Q228	P224-P226 VanDerWaalsContact C-N 3.32Å; P224-P226 WeakPolarHBondContact O-CD 3.36Å; P226-Q228 PolarHBondContact O-N 3.47Å
227	F	68.8	Low	68.1	Low	122 Å²	122	103.4 Å²	103.4	54%	0.535	56%	0.557	S	S	.	*	T	Hydrogen-bonded Turn	trans	67.5	28.8	-179.9	-38.1	-70.6	0	0	0	115.2	E225 D229 R230 Y231	E225-F227 PolarHBondContact O-N 3.1Å; E225-F227 VanDerWaalsContact O-N 3.15Å; F227-D229 PolarHBondContact O-N 3.18Å; F227-R230 HydrophobicContact CB-CB 3.85Å; F227-R230 HydrophobicContact CB-CG 3.8Å; F227-R230 HydrophobicContact CD1-CG 4.39Å; F227-R230 VanDerWaalsContact CD1-NH1 3.34Å; F227-R230 VanDerWaalsContact CE1-NH1 3.3Å; F227-R230 CarbonylContact O-C 3.48Å; F227-R230 VanDerWaalsContact O-CA 3.31Å; F227-R230 WeakPolarHBondContact O-CA 3.42Å; F227-R230 WeakPolarHBondContact O-CB 3.5Å; F227-R230 PolarHBondContact O-N 3.44Å; F227-Y231 WeakPolarHBondContact O-CD1 3.38Å; F227-Y231 PolarHBondContact O-N 2.91Å; F227-Y231 VanDerWaalsContact O-N 3.17Å
228	Q	70.2	Confident	70.6	Confident	67 Å²	67	98.8 Å²	98.8	31%	0.313	53%	0.534	S	S	.	.	G	3₁₀ helix	trans	-47	-45.1	170	-174.6	174.1	27.2	0	0	111.3	E225 P226 R230 Y231 N234	E225-Q228 HydrophobicContact CB-CB 4.36Å; E225-Q228 PolarHBondContact O-N 3.32Å; P226-Q228 PolarHBondContact O-N 3.47Å; Q228-R230 PolarHBondContact O-N 3.14Å; Q228-R230 VanDerWaalsContact O-N 3.17Å; Q228-Y231 HydrophobicContact CG-CD2 4.35Å; Q228-Y231 HydrophobicContact CG-CE2 4.38Å; Q228-Y231 VanDerWaalsContact O-CB 3.31Å; Q228-Y231 WeakPolarHBondContact O-CB 3.32Å; Q228-Y231 PolarHBondContact O-N 3.07Å; Q228-N234 WeakPolarHBondContact CG-ND2 3.47Å; Q228-N234 PolarHBondContact O-ND2 3.16Å
229	D	78.3	Confident	73	Confident	130 Å²	130	96.2 Å²	96.2	70%	0.695	51%	0.514	S	S	*	.	G	3₁₀ helix	trans	-61.7	-24.2	176.8	-49.7	-18.2	0	0	0	113.2	F227 V235	F227-D229 PolarHBondContact O-N 3.18Å; D229-V235 WeakPolarHBondContact O-CG2 3.49Å
230	R	82.1	Confident	75.4	Confident	181 Å²	181	94.4 Å²	94.4	68%	0.683	49%	0.489	S	S	*	.	G	3₁₀ helix	trans	-92.6	-2.5	177.2	-48.4	-171.6	-177.6	169.9	-4.7	113.6	F227 Q228 L232	F227-R230 HydrophobicContact CB-CB 3.85Å; F227-R230 HydrophobicContact CB-CG 3.8Å; F227-R230 HydrophobicContact CD1-CG 4.39Å; F227-R230 VanDerWaalsContact CD1-NH1 3.34Å; F227-R230 VanDerWaalsContact CE1-NH1 3.3Å; F227-R230 CarbonylContact O-C 3.48Å; F227-R230 VanDerWaalsContact O-CA 3.31Å; F227-R230 WeakPolarHBondContact O-CA 3.42Å; F227-R230 WeakPolarHBondContact O-CB 3.5Å; F227-R230 PolarHBondContact O-N 3.44Å; Q228-R230 PolarHBondContact O-N 3.14Å; Q228-R230 VanDerWaalsContact O-N 3.17Å; R230-L232 PolarHBondContact O-N 2.97Å
231	Y	84.8	Confident	77.9	Confident	87 Å²	87	93 Å²	93	34%	0.341	48%	0.484	S	S	.	.	S	Bend	trans	-58.9	133.6	172.2	-69.9	-7.9	0	0	0	108.9	E225 F227 Q228 I233 N234 V235	E225-Y231 WeakPolarHBondContact CB-OH 3.31Å; E225-Y231 WeakPolarHBondContact CG-OH 3.48Å; E225-Y231 WeakPolarHBondContact OE2-CE2 3.34Å; E225-Y231 PolarHBondContact OE2-OH 3.49Å; F227-Y231 WeakPolarHBondContact O-CD1 3.38Å; F227-Y231 PolarHBondContact O-N 2.91Å; F227-Y231 VanDerWaalsContact O-N 3.17Å; Q228-Y231 HydrophobicContact CG-CD2 4.35Å; Q228-Y231 HydrophobicContact CG-CE2 4.38Å; Q228-Y231 VanDerWaalsContact O-CB 3.31Å; Q228-Y231 WeakPolarHBondContact O-CB 3.32Å; Q228-Y231 PolarHBondContact O-N 3.07Å; Y231-I233 PolarHBondContact O-N 3.41Å; Y231-N234 PolarHBondContact O-N 3.28Å; Y231-V235 WeakPolarHBondContact O-CG2 3.36Å; Y231-V235 PolarHBondContact O-N 3.02Å
232	L	90.9	Very high	80.3	Confident	129 Å²	129	94.5 Å²	94.5	68%	0.675	48%	0.482	S	S	*	.	H	α-helix	trans	-49.1	-39.7	-178.8	-179.4	61.6	0	0	0	111.2	R230 V235 L236	R230-L232 PolarHBondContact O-N 2.97Å; L232-V235 PolarHBondContact O-N 3.37Å; L232-L236 HydrophobicContact CD1-CD1 4.26Å; L232-L236 HydrophobicContact CD1-CG 4.22Å; L232-L236 HydrophobicContact CG-CD1 4.01Å; L232-L236 HydrophobicContact CG-CG 4.4Å; L232-L236 WeakPolarHBondContact O-CB 3.37Å; L232-L236 WeakPolarHBondContact O-CG 3.47Å; L232-L236 PolarHBondContact O-N 2.72Å
233	I	91.3	Very high	82.6	Confident	114 Å²	114	91.6 Å²	91.6	59%	0.585	47%	0.471	S	S	*	.	H	α-helix	trans	-65.2	-39.9	179	-156	147.9	0	0	0	113.4	Y231 L236 L237	Y231-I233 PolarHBondContact O-N 3.41Å; I233-L236 PolarHBondContact O-N 3.35Å; I233-L237 WeakPolarHBondContact O-CB 3.37Å; I233-L237 VanDerWaalsContact O-CG 3.24Å; I233-L237 WeakPolarHBondContact O-CG 3.32Å; I233-L237 PolarHBondContact O-N 3.2Å
234	N	90.8	Very high	84.6	Confident	39 Å²	39	91.5 Å²	91.5	21%	0.209	48%	0.475	C	S	.	.	H	α-helix	trans	-73.3	-41.1	179.2	-69.2	-24.1	0	0	0	110.6	Q228 Y231 L236 L237 D238	Q228-N234 WeakPolarHBondContact CG-ND2 3.47Å; Q228-N234 PolarHBondContact O-ND2 3.16Å; Y231-N234 PolarHBondContact O-N 3.28Å; N234-L236 VanDerWaalsContact C-N 3.31Å; N234-L236 PolarHBondContact O-N 2.66Å; N234-L237 PolarHBondContact O-N 2.65Å; N234-D238 WeakPolarHBondContact O-CB 3.34Å; N234-D238 VanDerWaalsContact O-CG 3.31Å; N234-D238 PolarHBondContact O-N 3.19Å
235	V	95.3	Very high	86.6	Confident	71 Å²	71	92.5 Å²	92.5	43%	0.43	48%	0.48	S	S	.	.	H	α-helix	trans	-56.9	-44.7	171.6	175.6	0	0	0	0	111.2	D229 Y231 L232 D238 A239	D229-V235 WeakPolarHBondContact O-CG2 3.49Å; Y231-V235 WeakPolarHBondContact O-CG2 3.36Å; Y231-V235 PolarHBondContact O-N 3.02Å; L232-V235 PolarHBondContact O-N 3.37Å; V235-D238 PolarHBondContact O-N 3.46Å; V235-A239 WeakPolarHBondContact O-CB 3.05Å; V235-A239 PolarHBondContact O-N 3.34Å
236	L	95.9	Very high	88.2	Confident	106 Å²	106	95 Å²	95	56%	0.555	49%	0.49	S	S	*	.	H	α-helix	trans	-66.6	-40.3	177.3	-71.5	173.4	0	0	0	112.3	L232 I233 N234 A240	L232-L236 HydrophobicContact CD1-CD1 4.26Å; L232-L236 HydrophobicContact CD1-CG 4.22Å; L232-L236 HydrophobicContact CG-CD1 4.01Å; L232-L236 HydrophobicContact CG-CG 4.4Å; L232-L236 WeakPolarHBondContact O-CB 3.37Å; L232-L236 WeakPolarHBondContact O-CG 3.47Å; L232-L236 PolarHBondContact O-N 2.72Å; I233-L236 PolarHBondContact O-N 3.35Å; N234-L236 VanDerWaalsContact C-N 3.31Å; N234-L236 PolarHBondContact O-N 2.66Å; L236-A240 VanDerWaalsContact O-CB 3.32Å; L236-A240 WeakPolarHBondContact O-CB 3.37Å; L236-A240 PolarHBondContact O-N 3.1Å
237	L	95.9	Very high	89.3	Confident	85 Å²	85	97 Å²	97	45%	0.445	49%	0.489	S	S	.	.	H	α-helix	trans	-64.2	-42.2	176.1	-76	172.8	0	0	0	111.9	I233 N234 A240 R241	I233-L237 WeakPolarHBondContact O-CB 3.37Å; I233-L237 VanDerWaalsContact O-CG 3.24Å; I233-L237 WeakPolarHBondContact O-CG 3.32Å; I233-L237 PolarHBondContact O-N 3.2Å; N234-L237 PolarHBondContact O-N 2.65Å; L237-A240 PolarHBondContact O-N 2.83Å; L237-R241 VanDerWaalsContact O-CG 3.27Å; L237-R241 WeakPolarHBondContact O-CG 3.3Å; L237-R241 PolarHBondContact O-N 3.04Å
238	D	96	Very high	89.9	Confident	65 Å²	65	96.4 Å²	96.4	35%	0.348	49%	0.491	S	S	.	.	H	α-helix	trans	-68.1	-43.3	179.2	-69.4	-23.5	0	0	0	111	N234 V235 A240 R241 E242	N234-D238 WeakPolarHBondContact O-CB 3.34Å; N234-D238 VanDerWaalsContact O-CG 3.31Å; N234-D238 PolarHBondContact O-N 3.19Å; V235-D238 PolarHBondContact O-N 3.46Å; D238-A240 VanDerWaalsContact C-N 3.32Å; D238-A240 PolarHBondContact O-N 2.95Å; D238-R241 WeakPolarHBondContact O-CB 2.85Å; D238-R241 PolarHBondContact O-N 3.39Å; D238-R241 IonicContact OD1-NH1 3.73Å; D238-R241 PolarHBondContact OD1-NH1 2.85Å; D238-R241 VanDerWaalsContact OD1-NH1 3.09Å; D238-E242 WeakPolarHBondContact O-CG 3.34Å; D238-E242 PolarHBondContact O-N 3.03Å
239	A	96.1	Very high	90.1	Very high	52 Å²	52	98.2 Å²	98.2	43%	0.43	51%	0.51	S	S	.	.	H	α-helix	trans	-60.1	-40.6	172.5	0	0	0	0	0	112.4	V235 E242 S243	V235-A239 WeakPolarHBondContact O-CB 3.05Å; V235-A239 PolarHBondContact O-N 3.34Å; A239-E242 PolarHBondContact O-N 2.9Å; A239-S243 WeakPolarHBondContact O-CB 3.35Å; A239-S243 PolarHBondContact O-N 3.41Å
240	A	95.7	Very high	90	Very high	52 Å²	52	97.3 Å²	97.3	43%	0.43	51%	0.509	S	S	.	.	H	α-helix	trans	-64	-43.7	176.2	0	0	0	0	0	111.6	L236 L237 D238 S243 S244	L236-A240 VanDerWaalsContact O-CB 3.32Å; L236-A240 WeakPolarHBondContact O-CB 3.37Å; L236-A240 PolarHBondContact O-N 3.1Å; L237-A240 PolarHBondContact O-N 2.83Å; D238-A240 VanDerWaalsContact C-N 3.32Å; D238-A240 PolarHBondContact O-N 2.95Å; A240-S243 PolarHBondContact O-N 2.86Å; A240-S243 PolarHBondContact O-OG 3.12Å; A240-S244 PolarHBondContact O-N 2.82Å
241	R	95.9	Very high	89.1	Confident	161 Å²	161	94.1 Å²	94.1	61%	0.608	51%	0.505	S	S	*	.	H	α-helix	trans	-60	-48.1	175.3	-74.5	165.9	174.6	170.4	-4	111.5	L237 D238 S243 S244 V245	L237-R241 VanDerWaalsContact O-CG 3.27Å; L237-R241 WeakPolarHBondContact O-CG 3.3Å; L237-R241 PolarHBondContact O-N 3.04Å; D238-R241 WeakPolarHBondContact O-CB 2.85Å; D238-R241 PolarHBondContact O-N 3.39Å; D238-R241 IonicContact OD1-NH1 3.73Å; D238-R241 PolarHBondContact OD1-NH1 2.85Å; D238-R241 VanDerWaalsContact OD1-NH1 3.09Å; R241-S243 VanDerWaalsContact C-N 3.32Å; R241-S243 PolarHBondContact O-N 3.22Å; R241-S244 WeakPolarHBondContact O-CB 3.49Å; R241-S244 PolarHBondContact O-N 3.2Å; R241-V245 WeakPolarHBondContact O-CG2 3.25Å; R241-V245 PolarHBondContact O-N 3.28Å
242	E	95.9	Very high	88.1	Confident	113 Å²	113	94.6 Å²	94.6	53%	0.528	52%	0.519	S	S	.	.	H	α-helix	trans	-59	-42.4	176.4	-72.9	-178.6	-169.2	0	0	112.3	D238 A239 S244 V245 K246	D238-E242 WeakPolarHBondContact O-CG 3.34Å; D238-E242 PolarHBondContact O-N 3.03Å; A239-E242 PolarHBondContact O-N 2.9Å; E242-S244 VanDerWaalsContact C-N 3.31Å; E242-S244 PolarHBondContact O-N 2.99Å; E242-V245 PolarHBondContact O-N 3.44Å; E242-K246 WeakPolarHBondContact O-CB 3.08Å; E242-K246 VanDerWaalsContact O-CG 3.25Å; E242-K246 WeakPolarHBondContact O-CG 3.41Å; E242-K246 PolarHBondContact O-N 3.39Å
243	S	94.8	Very high	86.6	Confident	51 Å²	51	99 Å²	99	36%	0.357	53%	0.533	S	S	.	.	H	α-helix	trans	-64.5	-36.4	177.8	80.8	0	0	0	0	112.4	A239 A240 R241 K247	A239-S243 WeakPolarHBondContact O-CB 3.35Å; A239-S243 PolarHBondContact O-N 3.41Å; A240-S243 PolarHBondContact O-N 2.86Å; A240-S243 PolarHBondContact O-OG 3.12Å; R241-S243 VanDerWaalsContact C-N 3.32Å; R241-S243 PolarHBondContact O-N 3.22Å; S243-K247 VanDerWaalsContact O-CG 3.31Å; S243-K247 WeakPolarHBondContact O-CG 3.48Å; S243-K247 PolarHBondContact O-N 3.38Å
244	S	91.1	Very high	85.1	Confident	57 Å²	57	97.6 Å²	97.6	40%	0.399	53%	0.533	S	S	.	.	H	α-helix	trans	-69.2	-45	177.5	-174.8	0	0	0	0	111.4	A240 R241 E242 K246 K247 N248	A240-S244 PolarHBondContact O-N 2.82Å; R241-S244 WeakPolarHBondContact O-CB 3.49Å; R241-S244 PolarHBondContact O-N 3.2Å; E242-S244 VanDerWaalsContact C-N 3.31Å; E242-S244 PolarHBondContact O-N 2.99Å; S244-K246 VanDerWaalsContact C-N 3.33Å; S244-K246 PolarHBondContact O-N 3Å; S244-K247 PolarHBondContact O-N 3.25Å; S244-N248 PolarHBondContact O-N 3.12Å; S244-N248 PolarHBondContact O-ND2 2.75Å
245	V	92	Very high	83.4	Confident	89 Å²	89	100.4 Å²	100.4	54%	0.539	56%	0.555	S	S	.	*	H	α-helix	trans	-59.2	-45.7	174.1	173.7	0	0	0	0	110.4	R241 E242 K247 N248 C249	R241-V245 WeakPolarHBondContact O-CG2 3.25Å; R241-V245 PolarHBondContact O-N 3.28Å; E242-V245 PolarHBondContact O-N 3.44Å; V245-K247 PolarHBondContact O-N 2.94Å; V245-N248 PolarHBondContact O-N 3.08Å; V245-C249 PolarHBondContact O-N 3.04Å; V245-C249 PolarHBondContact O-SG 3.22Å
246	K	89.7	Confident	81.4	Confident	131 Å²	131	102.9 Å²	102.9	57%	0.57	57%	0.573	S	S	*	*	H	α-helix	trans	-57.6	-47	175.8	-73.8	168.8	-175.8	168.9	0	111.8	E242 S244 N248 C249 T250	E242-K246 WeakPolarHBondContact O-CB 3.08Å; E242-K246 VanDerWaalsContact O-CG 3.25Å; E242-K246 WeakPolarHBondContact O-CG 3.41Å; E242-K246 PolarHBondContact O-N 3.39Å; S244-K246 VanDerWaalsContact C-N 3.33Å; S244-K246 PolarHBondContact O-N 3Å; K246-N248 PolarHBondContact O-N 3.49Å; K246-C249 PolarHBondContact O-N 2.96Å; K246-T250 WeakPolarHBondContact O-CG2 3.46Å; K246-T250 PolarHBondContact O-N 3.27Å; K246-T250 PolarHBondContact O-OG1 2.93Å; K246-T250 VanDerWaalsContact O-OG1 3.06Å
247	K	83.5	Confident	79.7	Confident	136 Å²	136	104.5 Å²	104.5	59%	0.591	58%	0.581	S	S	*	*	H	α-helix	trans	-58.8	-46.1	176.6	-75.5	173.7	-178.4	-180	0	112.4	S243 S244 V245 T250 L251	S243-K247 VanDerWaalsContact O-CG 3.31Å; S243-K247 WeakPolarHBondContact O-CG 3.48Å; S243-K247 PolarHBondContact O-N 3.38Å; S244-K247 PolarHBondContact O-N 3.25Å; V245-K247 PolarHBondContact O-N 2.94Å; K247-T250 WeakPolarHBondContact CA-OG1 3.48Å; K247-T250 PolarHBondContact O-N 2.77Å; K247-T250 PolarHBondContact O-OG1 2.89Å; K247-L251 WeakPolarHBondContact O-CG 3.39Å; K247-L251 PolarHBondContact O-N 3.18Å
248	N	80.8	Confident	77.9	Confident	108 Å²	108	106.2 Å²	106.2	58%	0.578	59%	0.594	S	S	*	*	H	α-helix	trans	-66.1	-36.5	179.5	-70	-22.3	0	0	0	112.5	S244 V245 K246	S244-N248 PolarHBondContact O-N 3.12Å; S244-N248 PolarHBondContact O-ND2 2.75Å; V245-N248 PolarHBondContact O-N 3.08Å; K246-N248 PolarHBondContact O-N 3.49Å
249	C	76.3	Confident	76.1	Confident	106 Å²	106	108.6 Å²	108.6	72%	0.716	61%	0.606	S	S	*	*	H	α-helix	trans	-70.7	-32.4	175.6	-69.2	0	0	0	0	113	V245 K246	V245-C249 PolarHBondContact O-N 3.04Å; V245-C249 PolarHBondContact O-SG 3.22Å; K246-C249 PolarHBondContact O-N 2.96Å
250	T	75.5	Confident	74.4	Confident	110 Å²	110	112.9 Å²	112.9	68%	0.675	62%	0.622	S	S	*	*	H	α-helix	trans	-80.2	-20.6	179.9	49.6	0	0	0	0	114.1	K246 K247 P252	K246-T250 WeakPolarHBondContact O-CG2 3.46Å; K246-T250 PolarHBondContact O-N 3.27Å; K246-T250 PolarHBondContact O-OG1 2.93Å; K246-T250 VanDerWaalsContact O-OG1 3.06Å; K247-T250 WeakPolarHBondContact CA-OG1 3.48Å; K247-T250 PolarHBondContact O-N 2.77Å; K247-T250 PolarHBondContact O-OG1 2.89Å; T250-P252 VanDerWaalsContact O-CD 3.3Å; T250-P252 WeakPolarHBondContact O-CD 3.45Å
251	L	63.1	Low	73.1	Confident	115 Å²	115	120 Å²	120	60%	0.602	64%	0.639	S	S	*	*	S	Bend	trans	-70.5	117.7	178.3	-81.1	161	0	0	0	109.3	K247	K247-L251 WeakPolarHBondContact O-CG 3.39Å; K247-L251 PolarHBondContact O-N 3.18Å
252	P	64.4	Low	71.5	Confident	97 Å²	97	120 Å²	120	63%	0.63	65%	0.646	S	S	*	*			trans	-59.1	144.7	171.7	25	-31.3	0	0	0	108.4	T250 S254	T250-P252 VanDerWaalsContact O-CD 3.3Å; T250-P252 WeakPolarHBondContact O-CD 3.45Å; P252-S254 PolarHBondContact O-N 2.87Å
253	K	58.1	Low	69.8	Low	222 Å²	222	122.5 Å²	122.5	97%	0.965	66%	0.662	S	S	*	*			trans	-67.2	66	170.5	-63.3	-177.1	-178.6	179.4	0	109.4
254	S	59.5	Low	68.3	Low	84 Å²	84	129.8 Å²	129.8	59%	0.587	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-79.4	133.5	170.6	55	0	0	0	0	108	P252	P252-S254 PolarHBondContact O-N 2.87Å
255	S	56.2	Low	66.8	Low	97 Å²	97	132.6 Å²	132.6	68%	0.678	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-47.2	148.6	-179.3	44.3	0	0	0	0	113.1	I257	S255-I257 PolarHBondContact O-N 3.42Å; S255-I257 VanDerWaalsContact O-N 3.11Å
256	P	53.4	Low	65.5	Low	124 Å²	124	136.5 Å²	136.5	81%	0.805	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-59.7	117.2	-173.7	-5.9	17	0	0	0	110.1	V258	P256-V258 PolarHBondContact O-N 3.42Å
257	I	59	Low	64.3	Low	140 Å²	140	140.9 Å²	140.9	72%	0.718	74%	0.744	S	S	*	*			trans	-77.1	110.3	170.7	-59.4	171.1	0	0	0	105.9	S255 I259	S255-I257 PolarHBondContact O-N 3.42Å; S255-I257 VanDerWaalsContact O-N 3.11Å; I257-I259 HydrophobicContact CG2-CG1 4.1Å; I257-I259 PolarHBondContact O-N 3.05Å; I257-I259 VanDerWaalsContact O-N 3.16Å
258	V	59.7	Low	63.4	Low	120 Å²	120	141.2 Å²	141.2	73%	0.727	75%	0.752	S	S	*	*			trans	-68.1	106.9	171.4	-179.6	0	0	0	0	106.7	P256	P256-V258 PolarHBondContact O-N 3.42Å
259	I	57.9	Low	62.5	Low	116 Å²	116	142.9 Å²	142.9	60%	0.595	76%	0.761	S	S	*	*			trans	-96.2	101.4	174.4	-54.2	175.5	0	0	0	106.5	I257 Y261	I257-I259 HydrophobicContact CG2-CG1 4.1Å; I257-I259 PolarHBondContact O-N 3.05Å; I257-I259 VanDerWaalsContact O-N 3.16Å; I259-Y261 PolarHBondContact O-N 3.16Å
260	D	59.4	Low	61.7	Low	142 Å²	142	144.9 Å²	144.9	76%	0.759	76%	0.764	S	S	*	*			trans	-72	119.3	171.1	-77.6	-26.2	0	0	0	109.2	E262	D260-E262 PolarHBondContact O-N 3.37Å
261	Y	68.6	Low	60.9	Low	201 Å²	201	147 Å²	147	79%	0.788	77%	0.769	S	S	*	*			trans	-81.3	97.8	175.1	-51.4	-83.2	0	0	0	109.1	I259 L263	I259-Y261 PolarHBondContact O-N 3.16Å; Y261-L263 PolarHBondContact O-N 3.47Å
262	E	62.5	Low	60.8	Low	160 Å²	160	149 Å²	149	75%	0.748	78%	0.779	S	S	*	*			trans	-83.2	99.8	164.6	-120.8	-172.1	-174.4	0	0	109.2	D260 R264	D260-E262 PolarHBondContact O-N 3.37Å; E262-R264 PolarHBondContact O-N 3.36Å
263	L	60.5	Low	60.5	Low	166 Å²	166	152.5 Å²	152.5	87%	0.869	79%	0.789	S	S	*	*			trans	-69.6	106.5	173.9	-66.6	173.5	0	0	0	109.3	Y261	Y261-L263 PolarHBondContact O-N 3.47Å
264	R	63	Low	60.7	Low	205 Å²	205	147.5 Å²	147.5	77%	0.774	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-87.7	130.1	171	-65.1	-172	-176.5	-177.8	1.5	110.3	E262	E262-R264 PolarHBondContact O-N 3.36Å
265	P	59.7	Low	60.8	Low	116 Å²	116	152.4 Å²	152.4	75%	0.753	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-65.7	140.9	177	25	-30.7	0	0	0	111
266	I	65.2	Low	61.1	Low	171 Å²	171	157 Å²	157	88%	0.877	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-81.4	118.9	172.9	-57.7	168.6	0	0	0	106.3
267	N	64.9	Low	61.9	Low	223 Å²	223	160 Å²	160	100%	1.193	80%	0.8	S	S	*	*			trans	-74.4	0	171.9	-74	-13.7	0	0	0	111.4

Retrieved 267 of 267 residues in 220 ms (Link to these results)

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