A0A087XMU5_POEFO Loading...

Potassium inwardly rectifying channel subfamily J member 12b

AlphaFold DB , UniProt , Accession A0A087XMU5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 420 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	R	31.5	Very low	27.3	Very low	309 Å²	309	187.5 Å²	187.5	100%	1.166	87%	0.871	S	S	*	*				0	119.9	0	-83.4	178.2	173.3	176.6	-2.6	108.7
2	S	29.6	Very low	27.2	Very low	118 Å²	118	185.2 Å²	185.2	83%	0.825	87%	0.868	S	S	*	*			trans	59.6	98.4	156.5	-147.7	0	0	0	0	123.3
3	C	27	Very low	26.9	Very low	109 Å²	109	178.3 Å²	178.3	74%	0.736	85%	0.853	S	S	*	*				7.8	132.8	121.1	-155.1	0	0	0	0	120.6
4	K	28.3	Very low	26.6	Very low	211 Å²	211	175.3 Å²	175.3	92%	0.917	86%	0.858	S	S	*	*				-162.8	131.7	125	-132.2	172.9	-175.7	175.2	0	113.9
5	R	30	Very low	26.7	Very low	227 Å²	227	175.5 Å²	175.5	86%	0.857	86%	0.856	S	S	*	*			trans	-70.4	154.5	173	-71	168.2	163	164.8	-5.3	112.8
6	R	26.1	Very low	27.1	Very low	254 Å²	254	176.7 Å²	176.7	96%	0.958	86%	0.859	S	S	*	*				-159.6	131.2	121.1	-120.2	174.7	-176.6	169.2	-1.1	112.8
7	N	25.7	Very low	27.1	Very low	144 Å²	144	177.9 Å²	177.9	77%	0.77	86%	0.863	S	S	*	*			trans	-91	131.6	174.1	-129	-4.5	0	0	0	106.8
8	E	26.7	Very low	27.2	Very low	195 Å²	195	171.7 Å²	171.7	91%	0.911	85%	0.853	S	S	*	*			trans	-118.5	118.3	161.9	-105.4	173.8	170.2	0	0	108.5
9	K	25.7	Very low	27.2	Very low	186 Å²	186	173.4 Å²	173.4	81%	0.809	86%	0.855	S	S	*	*			trans	-88.4	113.8	174.4	-70	176.3	175.1	-179.4	0	107
10	S	24.7	Very low	27.2	Very low	105 Å²	105	176.8 Å²	176.8	73%	0.734	86%	0.858	S	S	*	*			trans	-81.5	120	164.9	52	0	0	0	0	109.4
11	F	25.2	Very low	27.4	Very low	204 Å²	204	175.8 Å²	175.8	90%	0.895	86%	0.856	S	S	*	*			trans	-58	127.5	162.7	-87	-110.7	0	0	0	109.2
12	L	25.7	Very low	27.2	Very low	160 Å²	160	164.7 Å²	164.7	84%	0.838	84%	0.838	S	S	*	*			trans	-116.8	115.2	163.2	-91.4	155.5	0	0	0	107.5
13	S	23.4	Very low	27.3	Very low	96 Å²	96	165.8 Å²	165.8	67%	0.671	84%	0.839	S	S	*	*			trans	-60.4	136.7	171.9	39.4	0	0	0	0	110.9	E15	S13-E15 PolarHBondContact O-N 3.45Å
14	C	23.6	Very low	27.5	Very low	136 Å²	136	169.2 Å²	169.2	92%	0.919	85%	0.847	S	S	*	*			trans	-66.3	108.8	164.7	-73.7	0	0	0	0	108.9
15	E	28.2	Very low	27.8	Very low	179 Å²	179	165.1 Å²	165.1	84%	0.836	84%	0.842	S	S	*	*			trans	-88	141.8	158	-86.6	177.5	125.3	0	0	109.8	S13	S13-E15 PolarHBondContact O-N 3.45Å
16	E	31.8	Very low	27.8	Very low	194 Å²	194	159.1 Å²	159.1	91%	0.907	84%	0.841	S	S	*	*			trans	-54.6	125.9	178.2	-66.1	166.7	115.3	0	0	112.1
17	E	27.8	Very low	28.3	Very low	198 Å²	198	154.3 Å²	154.3	93%	0.925	84%	0.839	S	S	*	*			trans	-111.8	102.3	154.5	-74.3	-146.5	155.6	0	0	109.3
18	G	28.1	Very low	28.7	Very low	65 Å²	65	150.8 Å²	150.8	67%	0.67	84%	0.837	S	S	*	*			trans	-66.3	148.2	176.4	0	0	0	0	0	113.2	R20	G18-R20 PolarHBondContact O-N 2.94Å
19	F	27.8	Very low	28.8	Very low	205 Å²	205	147.1 Å²	147.1	90%	0.899	83%	0.833	S	S	*	*			trans	-43.2	123.8	165.9	-90.1	-103.5	0	0	0	112.1
20	R	27.7	Very low	29.6	Very low	240 Å²	240	148.9 Å²	148.9	91%	0.906	84%	0.841	S	S	*	*			trans	-111.5	102.9	156.3	-75.9	-170.6	175.4	-179.1	0.5	109.1	G18 G22	G18-R20 PolarHBondContact O-N 2.94Å; R20-G22 PolarHBondContact O-N 2.89Å
21	L	30.4	Very low	30	Very low	156 Å²	156	147 Å²	147	82%	0.817	84%	0.839	S	S	*	*			trans	-56.2	126.2	162.1	-119.1	81	0	0	0	108.5	T23	L21-T23 PolarHBondContact O-N 2.86Å
22	G	28.6	Very low	30.8	Very low	77 Å²	77	146 Å²	146	79%	0.794	84%	0.843	S	S	*	*			trans	-71.4	112.5	175.3	0	0	0	0	0	111.1	R20	R20-G22 PolarHBondContact O-N 2.89Å
23	T	31.4	Very low	31.2	Very low	140 Å²	140	140.8 Å²	140.8	86%	0.859	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-65.9	135	162	33.4	0	0	0	0	110.5	L21	L21-T23 PolarHBondContact O-N 2.86Å
24	M	30.9	Very low	31.8	Very low	181 Å²	181	146.1 Å²	146.1	89%	0.892	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-56.7	149.8	173.4	-70.1	-160.6	160.6	0	0	112.3	A26	M24-A26 PolarHBondContact O-N 3.2Å
25	P	33.5	Very low	32.6	Very low	126 Å²	126	146.7 Å²	146.7	82%	0.818	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-78.7	123.4	-179.2	31	-29.6	0	0	0	110.5
26	A	30.8	Very low	32.9	Very low	101 Å²	101	146.5 Å²	146.5	84%	0.835	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-73.5	138.6	165.1	0	0	0	0	0	110.2	M24	M24-A26 PolarHBondContact O-N 3.2Å
27	V	36.4	Very low	33.4	Very low	152 Å²	152	142.9 Å²	142.9	92%	0.921	82%	0.821	S	S	*	*	S	Bend	trans	-63.3	133.7	177.6	171.8	0	0	0	0	111
28	G	34.9	Very low	34	Very low	71 Å²	71	144.6 Å²	144.6	73%	0.732	82%	0.819	S	S	*	*			trans	111	90.1	155.2	0	0	0	0	0	116
29	S	28.1	Very low	34.9	Very low	118 Å²	118	150.5 Å²	150.5	83%	0.825	82%	0.821	S	S	*	*			trans	-165.6	114.8	142.7	-166.6	0	0	0	0	110.5	G31	S29-G31 PolarHBondContact O-N 3.43Å
30	F	41.5	Very low	36	Very low	222 Å²	222	149.5 Å²	149.5	97%	0.974	82%	0.816	S	S	*	*			trans	-75.3	99.4	172.7	-84.6	-95.1	0	0	0	109.2
31	G	33.3	Very low	37.2	Very low	66 Å²	66	141.8 Å²	141.8	68%	0.68	81%	0.811	S	S	*	*			trans	-123.2	113.3	172.5	0	0	0	0	0	110.2	S29 G33	S29-G31 PolarHBondContact O-N 3.43Å; G31-G33 VanDerWaalsContact C-N 3.27Å; G31-G33 PolarHBondContact O-N 3Å
32	N	42.6	Very low	38.8	Very low	184 Å²	184	139.5 Å²	139.5	98%	0.984	80%	0.796	S	S	*	*			trans	-70.5	79.3	179.3	-153.9	21.4	0	0	0	110.1
33	G	34.3	Very low	40.9	Very low	50 Å²	50	140.9 Å²	140.9	52%	0.515	79%	0.794	S	S	.	*			trans	-113.8	124.5	176.1	0	0	0	0	0	109.6	G31 I35	G31-G33 VanDerWaalsContact C-N 3.27Å; G31-G33 PolarHBondContact O-N 3Å; G33-I35 PolarHBondContact O-N 2.87Å
34	K	36.9	Very low	43.6	Very low	208 Å²	208	136.1 Å²	136.1	90%	0.904	76%	0.76	S	S	*	*			trans	-51.6	104.5	168.4	-75.7	175.2	177	175.4	0	108.4	H36	K34-H36 VanDerWaalsContact C-N 3.28Å; K34-H36 PolarHBondContact O-N 2.86Å
35	I	38.5	Very low	46.4	Very low	147 Å²	147	129.5 Å²	129.5	75%	0.754	73%	0.727	S	S	*	*			trans	-66.8	95	171.6	-58	173.5	0	0	0	105.5	G33 T37	G33-I35 PolarHBondContact O-N 2.87Å; I35-T37 HydrophobicContact CG2-CG2 3.88Å; I35-T37 PolarHBondContact O-N 2.73Å
36	H	36.3	Very low	49.3	Very low	175 Å²	175	123.6 Å²	123.6	81%	0.81	69%	0.689	S	S	*	*			trans	-62.7	97	154.5	-86.7	-4.8	0	0	0	105.8	K34 R38	K34-H36 VanDerWaalsContact C-N 3.28Å; K34-H36 PolarHBondContact O-N 2.86Å; H36-R38 PolarHBondContact O-N 2.92Å
37	T	42.3	Very low	52.2	Low	119 Å²	119	121.5 Å²	121.5	73%	0.73	66%	0.663	S	S	*	*			trans	-63.1	77.4	162.5	46.1	0	0	0	0	106.9	I35 R39	I35-T37 HydrophobicContact CG2-CG2 3.88Å; I35-T37 PolarHBondContact O-N 2.73Å; T37-R39 PolarHBondContact O-N 3.29Å
38	R	40.3	Very low	54.8	Low	234 Å²	234	117.1 Å²	117.1	88%	0.883	63%	0.632	S	S	*	*			trans	-64.2	90.8	165.2	-162.3	179.1	-170.9	-173.7	2.2	104	H36 K40	H36-R38 PolarHBondContact O-N 2.92Å; R38-K40 PolarHBondContact O-N 3.44Å
39	R	46.5	Very low	57.3	Low	188 Å²	188	118.9 Å²	118.9	71%	0.709	63%	0.629	S	S	*	*			trans	-42.4	111.4	171.6	-100.9	-179.4	168.8	167.1	-3.9	105.2	T37 G41 E287	T37-R39 PolarHBondContact O-N 3.29Å; R39-G41 PolarHBondContact O-N 2.92Å; R39-E287 PolarHBondContact NH2-O 2.95Å
40	K	49.8	Very low	60.1	Low	184 Å²	184	113.5 Å²	113.5	80%	0.8	59%	0.591	S	S	*	*			trans	-53	119.6	173.4	-92.4	179	173.1	178.2	0	104.9	R38 H42	R38-K40 PolarHBondContact O-N 3.44Å; K40-H42 PolarHBondContact O-CD2 2.89Å; K40-H42 VanDerWaalsContact O-CD2 3.22Å; K40-H42 PolarHBondContact O-N 2.76Å
41	G	53.7	Low	62.3	Low	78 Å²	78	109.1 Å²	109.1	80%	0.804	57%	0.574	S	S	*	*			trans	-62.3	106.6	172.2	0	0	0	0	0	106.6	R39 S43	R39-G41 PolarHBondContact O-N 2.92Å; G41-S43 PolarHBondContact O-N 3.43Å
42	H	63.5	Low	64.9	Low	108 Å²	108	109.2 Å²	109.2	50%	0.5	56%	0.563	S	S	.	*			trans	-60.9	131.8	178.1	-81	-99.9	0	0	0	108.6	K40 R44 D290	K40-H42 PolarHBondContact O-CD2 2.89Å; K40-H42 VanDerWaalsContact O-CD2 3.22Å; K40-H42 PolarHBondContact O-N 2.76Å; H42-R44 PolarHBondContact O-N 2.78Å; H42-D290 IonicContact CE1-OD1 2.89Å; H42-D290 PolarHBondContact CE1-OD1 3.28Å; H42-D290 VanDerWaalsContact CE1-OD1 3.28Å; H42-D290 IonicContact CE1-OD2 2.93Å; H42-D290 PolarHBondContact CE1-OD2 2.84Å; H42-D290 IonicContact CG-OD1 3.49Å; H42-D290 IonicContact ND1-OD1 3.04Å; H42-D290 PolarHBondContact ND1-OD1 3.03Å; H42-D290 IonicContact ND1-OD2 3.68Å; H42-D290 PolarHBondContact ND1-OD2 3.46Å
43	S	72.4	Confident	67	Low	107 Å²	107	105 Å²	105	75%	0.748	54%	0.541	S	S	*	.			trans	-68.6	113.2	174.4	55.3	0	0	0	0	108.3	G41	G41-S43 PolarHBondContact O-N 3.43Å
44	R	88.6	Confident	69.4	Low	39 Å²	39	106.3 Å²	106.3	15%	0.147	54%	0.535	C	S	.	.			trans	-69.9	137	177	-173.1	-171.4	-70.5	-114.1	7.5	110.9	H42 V46 N53 E292 S313 L315 E318	H42-R44 PolarHBondContact O-N 2.78Å; R44-V46 WeakPolarHBondContact CD-O 3.39Å; R44-V46 VanDerWaalsContact CG-O 3.23Å; R44-V46 WeakPolarHBondContact CG-O 3.23Å; R44-N53 VanDerWaalsContact O-CB 3.3Å; R44-N53 WeakPolarHBondContact O-CB 3.3Å; R44-N53 PolarHBondContact O-ND2 3.23Å; R44-E292 WeakPolarHBondContact CA-OE2 3.39Å; R44-E292 WeakPolarHBondContact CG-OE1 3.47Å; R44-S313 PolarHBondContact NH1-O 3.29Å; R44-S313 PolarHBondContact NH1-OG 3.42Å; R44-L315 HydrophobicContact CG-CD2 4.34Å; R44-E318 IonicContact CZ-OE1 3.33Å; R44-E318 IonicContact CZ-OE2 3Å; R44-E318 IonicContact NH1-OE1 3.82Å; R44-E318 IonicContact NH1-OE2 2.82Å; R44-E318 PolarHBondContact NH1-OE2 3.18Å; R44-E318 VanDerWaalsContact NH2-CD 3.27Å; R44-E318 IonicContact NH2-OE1 3.73Å; R44-E318 PolarHBondContact NH2-OE1 3.32Å; R44-E318 IonicContact NH2-OE2 3.93Å; R44-E318 PolarHBondContact NH2-OE2 3.42Å
45	F	90.3	Very high	71.4	Confident	42 Å²	42	104.3 Å²	104.3	18%	0.184	53%	0.529	C	S	.	.	S	Bend	trans	-74.7	-45.3	176.9	-176.1	-117	0	0	0	112.2	N53 I54 V231 L244 E292 V294	F45-N53 PolarHBondContact O-N 3.12Å; F45-I54 HydrophobicContact CD2-CD1 4.11Å; F45-I54 HydrophobicContact CD2-CG1 4.07Å; F45-I54 HydrophobicContact CE2-CD1 3.27Å; F45-I54 HydrophobicContact CE2-CG1 3.67Å; F45-I54 HydrophobicContact CZ-CD1 3.55Å; F45-I54 HydrophobicContact CZ-CG1 4.4Å; F45-V231 HydrophobicContact CD1-CG2 4.45Å; F45-L244 HydrophobicContact CD2-CD1 3.73Å; F45-L244 HydrophobicContact CE2-CD1 3.76Å; F45-E292 WeakPolarHBondContact CB-OE2 3.31Å; F45-E292 PolarHBondContact N-OE2 2.91Å; F45-V294 HydrophobicContact CD1-CG2 4.3Å
46	V	93.4	Very high	73.5	Confident	3 Å²	3	103.9 Å²	103.9	2%	0.018	52%	0.522	C	S	.	.	B	Isolated β-bridge	trans	-126.3	120	177.1	175.3	0	0	0	0	109.6	R44 E292 V294 R311 S313	R44-V46 WeakPolarHBondContact CD-O 3.39Å; R44-V46 VanDerWaalsContact CG-O 3.23Å; R44-V46 WeakPolarHBondContact CG-O 3.23Å; V46-E292 PolarHBondContact N-OE1 3.23Å; V46-V294 HydrophobicContact CB-CG2 4.44Å; V46-V294 HydrophobicContact CG2-CG1 4.19Å; V46-V294 HydrophobicContact CG2-CG2 4.21Å; V46-R311 HydrophobicContact CG1-CB 4.32Å; V46-S313 VanDerWaalsContact O-CB 3.29Å; V46-S313 WeakPolarHBondContact O-CB 3.14Å; V46-S313 PolarHBondContact O-OG 3.07Å
47	N	92.1	Very high	75.5	Confident	56 Å²	56	100 Å²	100	30%	0.299	51%	0.514	S	S	.	.			trans	-60	157.8	176.8	-71.7	-37.2	0	0	0	112.8	T49 G50 Q51	N47-T49 PolarHBondContact O-N 3.33Å; N47-G50 WeakPolarHBondContact O-CA 3.46Å; N47-G50 PolarHBondContact O-N 3.37Å; N47-Q51 HydrophobicContact CB-CB 4.41Å; N47-Q51 WeakPolarHBondContact CB-O 3.34Å; N47-Q51 PolarHBondContact N-O 2.73Å
48	K	90.8	Very high	77.1	Confident	60 Å²	60	101 Å²	101	26%	0.261	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53	-24.6	171.5	-75.7	-65.3	-172.8	-170.7	0	114	G50 H196 T312 S313 E318	K48-G50 VanDerWaalsContact C-N 3.29Å; K48-H196 PolarHBondContact NZ-O 3.07Å; K48-T312 PolarHBondContact O-OG1 3.25Å; K48-S313 VanDerWaalsContact CD-O 3.29Å; K48-S313 WeakPolarHBondContact CD-O 3.48Å; K48-S313 VanDerWaalsContact CE-O 3.26Å; K48-S313 WeakPolarHBondContact CE-O 3.48Å; K48-S313 PolarHBondContact NZ-O 2.87Å; K48-E318 WeakPolarHBondContact CE-OE1 3.42Å; K48-E318 WeakPolarHBondContact CE-OE2 3.43Å; K48-E318 VanDerWaalsContact NZ-CD 3.26Å; K48-E318 IonicContact NZ-OE1 3.77Å; K48-E318 IonicContact NZ-OE2 2.76Å; K48-E318 PolarHBondContact NZ-OE2 2.95Å
49	T	87.1	Confident	78.6	Confident	109 Å²	109	94.4 Å²	94.4	67%	0.669	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-2.3	176.4	57.3	0	0	0	0	113.5	N47	N47-T49 PolarHBondContact O-N 3.33Å
50	G	86.9	Confident	79.4	Confident	4 Å²	4	91.4 Å²	91.4	4%	0.041	49%	0.493	C	S	.	.	S	Bend	trans	82.6	6.3	-177.8	0	0	0	0	0	115.3	N47 K48 R311	N47-G50 WeakPolarHBondContact O-CA 3.46Å; N47-G50 PolarHBondContact O-N 3.37Å; K48-G50 VanDerWaalsContact C-N 3.29Å; G50-R311 WeakPolarHBondContact CA-O 2.93Å; G50-R311 PolarHBondContact N-O 3.09Å; G50-R311 PolarHBondContact O-NE 2.59Å; G50-R311 PolarHBondContact O-NH2 3.03Å
51	Q	87.8	Confident	80.3	Confident	131 Å²	131	88 Å²	88	61%	0.612	48%	0.48	S	S	*	.			trans	-79	124.7	173.8	-66.7	-176.6	-3.9	0	0	110.5	N47	N47-Q51 HydrophobicContact CB-CB 4.41Å; N47-Q51 WeakPolarHBondContact CB-O 3.34Å; N47-Q51 PolarHBondContact N-O 2.73Å
52	C	88.4	Confident	81.1	Confident	67 Å²	67	88.5 Å²	88.5	45%	0.453	46%	0.46	S	S	.	.	B	Isolated β-bridge	trans	-74.8	128.8	176.2	-50.6	0	0	0	0	110.2	I54	C52-I54 VanDerWaalsContact C-N 3.31Å; C52-I54 HydrophobicContact CB-CD1 4.2Å; C52-I54 HydrophobicContact CB-CG1 4.37Å; C52-I54 PolarHBondContact O-N 3.09Å
53	N	87.2	Confident	81.3	Confident	97 Å²	97	87.5 Å²	87.5	52%	0.519	47%	0.466	S	S	.	.			trans	-94.1	60.8	-178.8	-172.3	29.7	0	0	0	110.4	R44 F45	R44-N53 VanDerWaalsContact O-CB 3.3Å; R44-N53 WeakPolarHBondContact O-CB 3.3Å; R44-N53 PolarHBondContact O-ND2 3.23Å; F45-N53 PolarHBondContact O-N 3.12Å
54	I	84.3	Confident	81.2	Confident	77 Å²	77	88.9 Å²	88.9	40%	0.395	46%	0.46	S	S	.	.			trans	-122.3	126.9	-176.9	-53.1	168.6	0	0	0	108	F45 C52 F56	F45-I54 HydrophobicContact CD2-CD1 4.11Å; F45-I54 HydrophobicContact CD2-CG1 4.07Å; F45-I54 HydrophobicContact CE2-CD1 3.27Å; F45-I54 HydrophobicContact CE2-CG1 3.67Å; F45-I54 HydrophobicContact CZ-CD1 3.55Å; F45-I54 HydrophobicContact CZ-CG1 4.4Å; C52-I54 VanDerWaalsContact C-N 3.31Å; C52-I54 HydrophobicContact CB-CD1 4.2Å; C52-I54 HydrophobicContact CB-CG1 4.37Å; C52-I54 PolarHBondContact O-N 3.09Å; I54-F56 HydrophobicContact CG2-CD1 4.42Å; I54-F56 HydrophobicContact CG2-CE1 4.06Å; I54-F56 HydrophobicContact CG2-CE2 4.4Å; I54-F56 HydrophobicContact CG2-CZ 4.05Å
55	H	80.2	Confident	80.7	Confident	166 Å²	166	94.5 Å²	94.5	77%	0.769	48%	0.481	S	S	*	.			trans	-107.9	107.7	173.4	-174.2	-86.4	0	0	0	109.6	S57	H55-S57 PolarHBondContact O-N 3.18Å
56	F	80.8	Confident	80	Confident	138 Å²	138	98.5 Å²	98.5	61%	0.605	50%	0.496	S	S	*	.			trans	-73.3	121.9	173.6	-56.6	-78.2	0	0	0	109.6	I54 M59	I54-F56 HydrophobicContact CG2-CD1 4.42Å; I54-F56 HydrophobicContact CG2-CE1 4.06Å; I54-F56 HydrophobicContact CG2-CE2 4.4Å; I54-F56 HydrophobicContact CG2-CZ 4.05Å; F56-M59 HydrophobicContact CB-CG 4.26Å; F56-M59 HydrophobicContact CB-SD 3.61Å; F56-M59 HydrophobicContact CG-SD 4.2Å
57	S	78.6	Confident	78.9	Confident	93 Å²	93	104.4 Å²	104.4	65%	0.65	53%	0.525	S	S	*	.			trans	-117.7	156	174.8	63.1	0	0	0	0	110.1	H55 M59	H55-S57 PolarHBondContact O-N 3.18Å; S57-M59 PolarHBondContact O-N 3.11Å
58	N	75.5	Confident	78.4	Confident	139 Å²	139	106.5 Å²	106.5	74%	0.743	54%	0.544	S	S	*	.			trans	52.7	49	177.3	-152.8	45.3	0	0	0	115.1	D60	N58-D60 PolarHBondContact O-N 3.48Å
59	M	72	Confident	78	Confident	97 Å²	97	107.1 Å²	107.1	48%	0.478	55%	0.55	S	S	.	*			trans	-90.2	88.3	169.9	-62.5	-179.7	82.6	0	0	108.9	F56 S57 K62	F56-M59 HydrophobicContact CB-CG 4.26Å; F56-M59 HydrophobicContact CB-SD 3.61Å; F56-M59 HydrophobicContact CG-SD 4.2Å; S57-M59 PolarHBondContact O-N 3.11Å; M59-K62 HydrophobicContact CB-CB 4.13Å; M59-K62 HydrophobicContact CB-CD 4.35Å; M59-K62 WeakPolarHBondContact O-CB 3.29Å; M59-K62 PolarHBondContact O-N 3.38Å; M59-K62 HydrophobicContact SD-CD 4.18Å
60	D	64.1	Low	77.9	Confident	124 Å²	124	107.6 Å²	107.6	66%	0.663	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	141.5	170.7	-64.8	-37	0	0	0	109.4	N58 K62	N58-D60 PolarHBondContact O-N 3.48Å; D60-K62 VanDerWaalsContact C-N 3.31Å; D60-K62 PolarHBondContact O-N 3.13Å
61	E	69.8	Low	77.8	Confident	112 Å²	112	113 Å²	113	52%	0.523	57%	0.57	S	S	.	*	T	Hydrogen-bonded Turn	trans	68.4	9.3	-176.5	-48.9	176.6	156.3	0	0	117.5	S63 Q64 R65	E61-S63 VanDerWaalsContact C-N 3.32Å; E61-S63 PolarHBondContact O-N 3Å; E61-Q64 PolarHBondContact O-N 2.88Å; E61-R65 PolarHBondContact O-N 2.96Å; E61-R65 VanDerWaalsContact O-N 3.14Å; E61-R65 IonicContact OE2-CZ 2.7Å; E61-R65 IonicContact OE2-NE 3.36Å; E61-R65 IonicContact OE2-NH2 3.99Å; E61-R65 PolarHBondContact OE2-NH2 2.8Å
62	K	69.3	Low	77.7	Confident	90 Å²	90	109.1 Å²	109.1	39%	0.391	56%	0.555	S	S	.	*	H	α-helix	trans	-49	-52.1	179	-168.4	175.2	-177.6	174	0	112	M59 D60 Q64 R65 Y66	M59-K62 HydrophobicContact CB-CB 4.13Å; M59-K62 HydrophobicContact CB-CD 4.35Å; M59-K62 WeakPolarHBondContact O-CB 3.29Å; M59-K62 PolarHBondContact O-N 3.38Å; M59-K62 HydrophobicContact SD-CD 4.18Å; D60-K62 VanDerWaalsContact C-N 3.31Å; D60-K62 PolarHBondContact O-N 3.13Å; K62-Q64 VanDerWaalsContact C-N 3.28Å; K62-Q64 PolarHBondContact O-N 3.22Å; K62-R65 PolarHBondContact O-N 3.03Å; K62-Y66 HydrophobicContact CD-CE2 4.07Å; K62-Y66 VanDerWaalsContact CE-CE2 3.45Å; K62-Y66 HydrophobicContact CG-CD2 3.58Å; K62-Y66 HydrophobicContact CG-CE2 3.44Å; K62-Y66 VanDerWaalsContact CG-CE2 3.44Å; K62-Y66 VanDerWaalsContact O-CD2 3.23Å; K62-Y66 WeakPolarHBondContact O-CD2 3.44Å; K62-Y66 PolarHBondContact O-N 3.27Å
63	S	67.1	Low	77.6	Confident	87 Å²	87	107.9 Å²	107.9	61%	0.608	55%	0.546	S	S	*	.	H	α-helix	trans	-58.7	-37.8	-178.4	-167.3	0	0	0	0	113.2	E61 M67	E61-S63 VanDerWaalsContact C-N 3.32Å; E61-S63 PolarHBondContact O-N 3Å; S63-M67 VanDerWaalsContact O-CB 3.3Å; S63-M67 WeakPolarHBondContact O-CB 3.12Å; S63-M67 WeakPolarHBondContact O-CG 3.28Å; S63-M67 PolarHBondContact O-N 3.03Å
64	Q	71.9	Confident	77.7	Confident	136 Å²	136	104.1 Å²	104.1	64%	0.636	53%	0.527	S	S	*	.	H	α-helix	trans	-70.3	-41	-179.1	-71.4	-176.9	-13.4	0	0	111.6	E61 K62 M67 S68	E61-Q64 PolarHBondContact O-N 2.88Å; K62-Q64 VanDerWaalsContact C-N 3.28Å; K62-Q64 PolarHBondContact O-N 3.22Å; Q64-M67 CarbonylContact O-C 3.52Å; Q64-M67 PolarHBondContact O-N 2.92Å; Q64-S68 PolarHBondContact O-N 3.12Å; Q64-S68 PolarHBondContact O-OG 3.33Å
65	R	76.4	Confident	77.9	Confident	157 Å²	157	100.6 Å²	100.6	59%	0.592	51%	0.509	S	S	*	.	H	α-helix	trans	-68.6	-38.9	177.9	-63	-176.3	-170.3	-177.9	4.7	112.7	E61 K62 M67 S68 D69	E61-R65 PolarHBondContact O-N 2.96Å; E61-R65 VanDerWaalsContact O-N 3.14Å; E61-R65 IonicContact OE2-CZ 2.7Å; E61-R65 IonicContact OE2-NE 3.36Å; E61-R65 IonicContact OE2-NH2 3.99Å; E61-R65 PolarHBondContact OE2-NH2 2.8Å; K62-R65 PolarHBondContact O-N 3.03Å; R65-M67 VanDerWaalsContact C-N 3.31Å; R65-S68 WeakPolarHBondContact CA-OG 3.47Å; R65-S68 PolarHBondContact O-N 3.04Å; R65-S68 PolarHBondContact O-OG 3.32Å; R65-D69 PolarHBondContact O-N 3.48Å
66	Y	75.8	Confident	78.2	Confident	125 Å²	125	97.1 Å²	97.1	49%	0.49	50%	0.496	S	S	.	.	H	α-helix	trans	-67.5	-32.8	172.4	-81.7	-87.7	0	0	0	111.8	K62 D69 T73	K62-Y66 HydrophobicContact CD-CE2 4.07Å; K62-Y66 VanDerWaalsContact CE-CE2 3.45Å; K62-Y66 HydrophobicContact CG-CD2 3.58Å; K62-Y66 HydrophobicContact CG-CE2 3.44Å; K62-Y66 VanDerWaalsContact CG-CE2 3.44Å; K62-Y66 VanDerWaalsContact O-CD2 3.23Å; K62-Y66 WeakPolarHBondContact O-CD2 3.44Å; K62-Y66 PolarHBondContact O-N 3.27Å; Y66-D69 CarbonylContact O-C 3.59Å; Y66-D69 PolarHBondContact O-N 3.42Å; Y66-T73 HydrophobicContact CD1-CG2 4.36Å; Y66-T73 PolarHBondContact O-OG1 3.28Å
67	M	72	Confident	78.6	Confident	127 Å²	127	93 Å²	93	63%	0.626	48%	0.48	S	S	*	.	H	α-helix	trans	-75.5	-25.4	174.7	-77.1	-175.6	68.5	0	0	113.9	S63 Q64 R65 D69 I70	S63-M67 VanDerWaalsContact O-CB 3.3Å; S63-M67 WeakPolarHBondContact O-CB 3.12Å; S63-M67 WeakPolarHBondContact O-CG 3.28Å; S63-M67 PolarHBondContact O-N 3.03Å; Q64-M67 CarbonylContact O-C 3.52Å; Q64-M67 PolarHBondContact O-N 2.92Å; R65-M67 VanDerWaalsContact C-N 3.31Å; M67-D69 VanDerWaalsContact C-N 3.27Å; M67-I70 WeakPolarHBondContact O-CG1 3.44Å
68	S	79.5	Confident	79.2	Confident	101 Å²	101	97.4 Å²	97.4	71%	0.706	48%	0.482	S	S	*	.	H	α-helix	trans	-71.5	-25.8	171	53.5	0	0	0	0	112.3	Q64 R65	Q64-S68 PolarHBondContact O-N 3.12Å; Q64-S68 PolarHBondContact O-OG 3.33Å; R65-S68 WeakPolarHBondContact CA-OG 3.47Å; R65-S68 PolarHBondContact O-N 3.04Å; R65-S68 PolarHBondContact O-OG 3.32Å
69	D	84.4	Confident	80	Confident	73 Å²	73	95.8 Å²	95.8	39%	0.39	47%	0.466	S	S	.	.			trans	-112.2	62.1	178.4	-164.5	2.9	0	0	0	111.8	R65 Y66 M67 F71 T72 T73	R65-D69 PolarHBondContact O-N 3.48Å; Y66-D69 CarbonylContact O-C 3.59Å; Y66-D69 PolarHBondContact O-N 3.42Å; M67-D69 VanDerWaalsContact C-N 3.27Å; D69-F71 VanDerWaalsContact C-N 3.28Å; D69-F71 PolarHBondContact O-N 3.35Å; D69-T72 PolarHBondContact O-OG1 3.22Å; D69-T72 VanDerWaalsContact OD1-CG2 3.25Å; D69-T72 WeakPolarHBondContact OD1-CG2 3.46Å; D69-T72 PolarHBondContact OD1-N 2.94Å; D69-T72 PolarHBondContact OD1-OG1 3.22Å; D69-T72 VanDerWaalsContact OD1-OG1 3.07Å; D69-T72 WeakPolarHBondContact OD2-CB 3.48Å; D69-T72 WeakPolarHBondContact OD2-CG2 3.41Å; D69-T72 PolarHBondContact OD2-OG1 2.96Å; D69-T73 VanDerWaalsContact O-CB 3.31Å; D69-T73 WeakPolarHBondContact O-CB 3.48Å; D69-T73 PolarHBondContact O-N 3.06Å; D69-T73 VanDerWaalsContact O-N 3.15Å; D69-T73 PolarHBondContact O-OG1 2.85Å
70	I	83.9	Confident	81	Confident	119 Å²	119	101.4 Å²	101.4	61%	0.61	48%	0.482	S	S	*	.	H	α-helix	trans	-61.5	-38.4	-176.3	-55.2	-176.6	0	0	0	111.2	M67 C74	M67-I70 WeakPolarHBondContact O-CG1 3.44Å; I70-C74 WeakPolarHBondContact O-CB 3.34Å; I70-C74 PolarHBondContact O-N 2.63Å
71	F	84.6	Confident	82.4	Confident	118 Å²	118	102 Å²	102	52%	0.518	48%	0.475	S	S	.	.	H	α-helix	trans	-67.5	-50.7	-175.6	-179.1	-100.4	0	0	0	111.5	D69 T73 C74 V75 A180	D69-F71 VanDerWaalsContact C-N 3.28Å; D69-F71 PolarHBondContact O-N 3.35Å; F71-T73 VanDerWaalsContact C-N 3.3Å; F71-T73 PolarHBondContact O-N 2.78Å; F71-C74 PolarHBondContact O-N 2.73Å; F71-V75 HydrophobicContact CE1-CG2 4.19Å; F71-V75 HydrophobicContact CE2-CG2 4.2Å; F71-V75 HydrophobicContact CZ-CG2 4.01Å; F71-V75 WeakPolarHBondContact O-CG2 3.23Å; F71-V75 PolarHBondContact O-N 3.24Å; F71-A180 HydrophobicContact CZ-CB 3.96Å
72	T	85.8	Confident	83.5	Confident	48 Å²	48	96.6 Å²	96.6	29%	0.294	45%	0.45	S	S	.	.	H	α-helix	trans	-64	-41.3	178.5	67.9	0	0	0	0	110.6	D69 C74 V75 D76	D69-T72 PolarHBondContact O-OG1 3.22Å; D69-T72 VanDerWaalsContact OD1-CG2 3.25Å; D69-T72 WeakPolarHBondContact OD1-CG2 3.46Å; D69-T72 PolarHBondContact OD1-N 2.94Å; D69-T72 PolarHBondContact OD1-OG1 3.22Å; D69-T72 VanDerWaalsContact OD1-OG1 3.07Å; D69-T72 WeakPolarHBondContact OD2-CB 3.48Å; D69-T72 WeakPolarHBondContact OD2-CG2 3.41Å; D69-T72 PolarHBondContact OD2-OG1 2.96Å; T72-C74 PolarHBondContact O-N 3.06Å; T72-V75 CarbonylContact O-C 3.38Å; T72-V75 PolarHBondContact O-N 3.23Å; T72-V75 VanDerWaalsContact O-N 3.14Å; T72-D76 WeakPolarHBondContact O-CB 3.42Å; T72-D76 PolarHBondContact O-N 3.02Å
73	T	87.4	Confident	84.6	Confident	42 Å²	42	97.2 Å²	97.2	26%	0.258	45%	0.453	S	S	.	.	H	α-helix	trans	-58.2	-46.6	177.1	-59.2	0	0	0	0	111.5	Y66 D69 F71 V75 D76 I77	Y66-T73 HydrophobicContact CD1-CG2 4.36Å; Y66-T73 PolarHBondContact O-OG1 3.28Å; D69-T73 VanDerWaalsContact O-CB 3.31Å; D69-T73 WeakPolarHBondContact O-CB 3.48Å; D69-T73 PolarHBondContact O-N 3.06Å; D69-T73 VanDerWaalsContact O-N 3.15Å; D69-T73 PolarHBondContact O-OG1 2.85Å; F71-T73 VanDerWaalsContact C-N 3.3Å; F71-T73 PolarHBondContact O-N 2.78Å; T73-V75 VanDerWaalsContact C-N 3.33Å; T73-V75 PolarHBondContact O-N 2.89Å; T73-D76 PolarHBondContact O-N 3.04Å; T73-I77 WeakPolarHBondContact O-CG2 3.35Å; T73-I77 PolarHBondContact O-N 3.47Å; T73-I77 VanDerWaalsContact O-N 3.11Å
74	C	88.1	Confident	86	Confident	18 Å²	18	98.3 Å²	98.3	12%	0.122	45%	0.451	C	S	.	.	H	α-helix	trans	-63.6	-36.5	177.4	-174.8	0	0	0	0	112.5	I70 F71 T72 I77	I70-C74 WeakPolarHBondContact O-CB 3.34Å; I70-C74 PolarHBondContact O-N 2.63Å; F71-C74 PolarHBondContact O-N 2.73Å; T72-C74 PolarHBondContact O-N 3.06Å; C74-I77 WeakPolarHBondContact O-CG1 3.43Å
75	V	88.9	Confident	87	Confident	2 Å²	2	95.3 Å²	95.3	1%	0.012	44%	0.44	C	S	.	.	H	α-helix	trans	-77	-26.2	177.6	-177.9	0	0	0	0	111.4	F71 T72 T73 A180 K181 R184	F71-V75 HydrophobicContact CE1-CG2 4.19Å; F71-V75 HydrophobicContact CE2-CG2 4.2Å; F71-V75 HydrophobicContact CZ-CG2 4.01Å; F71-V75 WeakPolarHBondContact O-CG2 3.23Å; F71-V75 PolarHBondContact O-N 3.24Å; T72-V75 CarbonylContact O-C 3.38Å; T72-V75 PolarHBondContact O-N 3.23Å; T72-V75 VanDerWaalsContact O-N 3.14Å; T73-V75 VanDerWaalsContact C-N 3.33Å; T73-V75 PolarHBondContact O-N 2.89Å; V75-A180 HydrophobicContact CG1-CB 4.48Å; V75-A180 HydrophobicContact CG2-CB 4.25Å; V75-K181 HydrophobicContact CG1-CB 3.92Å; V75-K181 HydrophobicContact CG1-CG 4.33Å; V75-K181 PolarHBondContact O-NZ 3.42Å; V75-R184 HydrophobicContact CG1-CG 4.43Å
76	D	87.1	Confident	87.9	Confident	94 Å²	94	88.9 Å²	88.9	50%	0.503	42%	0.416	S	S	.	.	H	α-helix	trans	-85	-24.2	-178.6	-86.6	-56.5	0	0	0	115.1	T72 T73 R184	T72-D76 WeakPolarHBondContact O-CB 3.42Å; T72-D76 PolarHBondContact O-N 3.02Å; T73-D76 PolarHBondContact O-N 3.04Å; D76-R184 IonicContact OD1-CZ 3.82Å; D76-R184 IonicContact OD1-NH1 2.72Å; D76-R184 PolarHBondContact OD1-NH1 3.05Å; D76-R184 IonicContact OD1-NH2 3.89Å; D76-R184 IonicContact OD2-CZ 3.66Å; D76-R184 IonicContact OD2-NH1 3.32Å; D76-R184 PolarHBondContact OD2-NH1 3.16Å; D76-R184 IonicContact OD2-NH2 3.2Å; D76-R184 PolarHBondContact OD2-NH2 2.98Å
77	I	89.1	Confident	88.8	Confident	50 Å²	50	86.2 Å²	86.2	26%	0.256	42%	0.416	S	S	.	.	S	Bend	trans	-60.1	156.7	175.4	53	167.2	0	0	0	112.6	T73 C74 M82 L85 K181	T73-I77 WeakPolarHBondContact O-CG2 3.35Å; T73-I77 PolarHBondContact O-N 3.47Å; T73-I77 VanDerWaalsContact O-N 3.11Å; C74-I77 WeakPolarHBondContact O-CG1 3.43Å; I77-M82 HydrophobicContact CD1-CB 3.91Å; I77-M82 HydrophobicContact CD1-CG 4.44Å; I77-M82 HydrophobicContact CG1-CB 4.19Å; I77-L85 HydrophobicContact CD1-CD2 4.45Å; I77-K181 VanDerWaalsContact O-CE 3.3Å; I77-K181 WeakPolarHBondContact O-CE 3.37Å; I77-K181 PolarHBondContact O-NZ 3.04Å
78	R	91.3	Very high	89.9	Confident	186 Å²	186	84.8 Å²	84.8	70%	0.702	41%	0.41	S	S	*	.			trans	-63.1	148.1	177.6	-61.1	-178.4	-178.9	155.8	0.1	110.6	R80 Y81 M82	R78-R80 PolarHBondContact O-N 3Å; R78-R80 VanDerWaalsContact O-N 3.07Å; R78-Y81 HydrophobicContact CB-CD2 3.91Å; R78-Y81 HydrophobicContact CB-CE2 4.38Å; R78-Y81 HydrophobicContact CG-CD2 4.44Å; R78-Y81 PolarHBondContact O-N 2.85Å; R78-M82 PolarHBondContact O-N 2.92Å; R78-M82 VanDerWaalsContact O-N 3.07Å
79	W	91.5	Very high	90.7	Very high	105 Å²	105	82.8 Å²	82.8	40%	0.398	39%	0.394	S	S	.	.	H	α-helix	trans	-46	-42.7	178	-78.2	104.9	0	0	0	114.1	Y81 M82 F83 I178 K181 M182	W79-Y81 VanDerWaalsContact C-N 3.34Å; W79-Y81 PolarHBondContact O-N 2.8Å; W79-M82 HydrophobicContact CE3-CE 3.5Å; W79-M82 VanDerWaalsContact CE3-CE 3.5Å; W79-M82 HydrophobicContact CH2-CE 4.29Å; W79-M82 HydrophobicContact CZ3-CE 3.33Å; W79-M82 PolarHBondContact O-N 3.1Å; W79-F83 HydrophobicContact CB-CE2 4.35Å; W79-F83 HydrophobicContact CD2-CE2 4.38Å; W79-F83 HydrophobicContact CE3-CD2 4.32Å; W79-F83 AromaticContact CE3-CE2 3.49Å; W79-F83 HydrophobicContact CE3-CE2 3.49Å; W79-F83 VanDerWaalsContact CE3-CE2 3.49Å; W79-F83 AromaticContact CE3-CZ 3.59Å; W79-F83 HydrophobicContact CE3-CZ 3.59Å; W79-F83 HydrophobicContact CZ3-CE2 4.15Å; W79-F83 AromaticContact CZ3-CZ 3.76Å; W79-F83 HydrophobicContact CZ3-CZ 3.76Å; W79-F83 WeakPolarHBondContact O-CD2 3.31Å; W79-F83 PolarHBondContact O-N 2.73Å; W79-I178 HydrophobicContact CZ3-CG2 4.49Å; W79-K181 HydrophobicContact CD2-CD 3.95Å; W79-K181 HydrophobicContact CE3-CD 4.07Å; W79-K181 HydrophobicContact CH2-CB 4.2Å; W79-K181 HydrophobicContact CH2-CD 3.97Å; W79-K181 HydrophobicContact CH2-CG 4.04Å; W79-K181 HydrophobicContact CZ2-CB 4.3Å; W79-K181 HydrophobicContact CZ2-CD 3.84Å; W79-K181 HydrophobicContact CZ2-CG 3.73Å; W79-K181 HydrophobicContact CZ3-CD 4.11Å; W79-M182 HydrophobicContact CH2-CG 3.72Å; W79-M182 HydrophobicContact CZ2-CG 4.16Å
80	R	93.6	Very high	91.2	Very high	216 Å²	216	80.8 Å²	80.8	82%	0.815	38%	0.381	S	S	*	.	H	α-helix	trans	-58.7	-43.3	178.9	-63.8	-177.2	-175.3	163.4	1.9	112.7	R78 L84	R78-R80 PolarHBondContact O-N 3Å; R78-R80 VanDerWaalsContact O-N 3.07Å; R80-L84 VanDerWaalsContact O-CB 3.29Å; R80-L84 WeakPolarHBondContact O-CB 3.35Å; R80-L84 PolarHBondContact O-N 3.36Å; R80-L84 VanDerWaalsContact O-N 3.08Å
81	Y	93.4	Very high	91.8	Very high	135 Å²	135	78 Å²	78	53%	0.529	37%	0.37	S	S	.	.	H	α-helix	trans	-75.4	-33.8	179.8	-60.4	-55.2	0	0	0	111.6	R78 W79 L84 L85	R78-Y81 HydrophobicContact CB-CD2 3.91Å; R78-Y81 HydrophobicContact CB-CE2 4.38Å; R78-Y81 HydrophobicContact CG-CD2 4.44Å; R78-Y81 PolarHBondContact O-N 2.85Å; W79-Y81 VanDerWaalsContact C-N 3.34Å; W79-Y81 PolarHBondContact O-N 2.8Å; Y81-L84 PolarHBondContact O-N 3.38Å; Y81-L85 VanDerWaalsContact O-CB 3.28Å; Y81-L85 WeakPolarHBondContact O-CB 3.49Å; Y81-L85 PolarHBondContact O-N 3.22Å
82	M	92.6	Very high	92.3	Very high	0 Å²	0	76 Å²	76	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-64.4	-48.2	176	-168.1	-171	76.7	0	0	111.3	I77 R78 W79 L84 L85 F86 I178 K181	I77-M82 HydrophobicContact CD1-CB 3.91Å; I77-M82 HydrophobicContact CD1-CG 4.44Å; I77-M82 HydrophobicContact CG1-CB 4.19Å; R78-M82 PolarHBondContact O-N 2.92Å; R78-M82 VanDerWaalsContact O-N 3.07Å; W79-M82 HydrophobicContact CE3-CE 3.5Å; W79-M82 VanDerWaalsContact CE3-CE 3.5Å; W79-M82 HydrophobicContact CH2-CE 4.29Å; W79-M82 HydrophobicContact CZ3-CE 3.33Å; W79-M82 PolarHBondContact O-N 3.1Å; M82-L84 VanDerWaalsContact C-N 3.34Å; M82-L84 PolarHBondContact O-N 3.17Å; M82-L85 PolarHBondContact O-N 3.18Å; M82-F86 HydrophobicContact CG-CD2 3.93Å; M82-F86 HydrophobicContact CG-CE2 3.68Å; M82-F86 VanDerWaalsContact O-CD2 3.24Å; M82-F86 WeakPolarHBondContact O-CD2 3.09Å; M82-F86 PolarHBondContact O-N 3.09Å; M82-F86 HydrophobicContact SD-CE2 4.27Å; M82-I178 HydrophobicContact CE-CG1 3.66Å; M82-K181 HydrophobicContact CE-CD 3.93Å; M82-K181 HydrophobicContact SD-CB 4.37Å; M82-K181 HydrophobicContact SD-CD 3.33Å; M82-K181 WeakPolarHBondContact SD-CD 3.38Å; M82-K181 HydrophobicContact SD-CG 4.49Å
83	F	93.1	Very high	92.9	Very high	102 Å²	102	74.3 Å²	74.3	45%	0.447	36%	0.357	S	S	.	.	H	α-helix	trans	-62.8	-41.7	175.2	-71.1	-55.4	0	0	0	111.9	W79 L85 F86 S87 I178	W79-F83 HydrophobicContact CB-CE2 4.35Å; W79-F83 HydrophobicContact CD2-CE2 4.38Å; W79-F83 HydrophobicContact CE3-CD2 4.32Å; W79-F83 AromaticContact CE3-CE2 3.49Å; W79-F83 HydrophobicContact CE3-CE2 3.49Å; W79-F83 VanDerWaalsContact CE3-CE2 3.49Å; W79-F83 AromaticContact CE3-CZ 3.59Å; W79-F83 HydrophobicContact CE3-CZ 3.59Å; W79-F83 HydrophobicContact CZ3-CE2 4.15Å; W79-F83 AromaticContact CZ3-CZ 3.76Å; W79-F83 HydrophobicContact CZ3-CZ 3.76Å; W79-F83 WeakPolarHBondContact O-CD2 3.31Å; W79-F83 PolarHBondContact O-N 2.73Å; F83-L85 VanDerWaalsContact C-N 3.34Å; F83-L85 PolarHBondContact O-N 3.37Å; F83-F86 PolarHBondContact O-N 2.76Å; F83-S87 WeakPolarHBondContact O-CB 3.29Å; F83-S87 PolarHBondContact O-N 2.75Å; F83-S87 PolarHBondContact O-OG 2.78Å; F83-I178 HydrophobicContact CE1-CD1 4.39Å
84	L	95.1	Very high	93.3	Very high	110 Å²	110	74.8 Å²	74.8	58%	0.576	35%	0.354	S	S	*	.	H	α-helix	trans	-60.5	-43.2	175.9	-173	155.7	0	0	0	111.8	R80 Y81 M82 S87 L88	R80-L84 VanDerWaalsContact O-CB 3.29Å; R80-L84 WeakPolarHBondContact O-CB 3.35Å; R80-L84 PolarHBondContact O-N 3.36Å; R80-L84 VanDerWaalsContact O-N 3.08Å; Y81-L84 PolarHBondContact O-N 3.38Å; M82-L84 VanDerWaalsContact C-N 3.34Å; M82-L84 PolarHBondContact O-N 3.17Å; L84-S87 PolarHBondContact O-N 3.2Å; L84-L88 WeakPolarHBondContact O-CB 3.24Å; L84-L88 PolarHBondContact O-N 2.83Å
85	L	93.7	Very high	93.7	Very high	74 Å²	74	77.4 Å²	77.4	39%	0.387	37%	0.367	S	S	.	.	H	α-helix	trans	-60.9	-50.1	177.8	-179.2	68.4	0	0	0	111.3	I77 Y81 M82 F83 L88 V89	I77-L85 HydrophobicContact CD1-CD2 4.45Å; Y81-L85 VanDerWaalsContact O-CB 3.28Å; Y81-L85 WeakPolarHBondContact O-CB 3.49Å; Y81-L85 PolarHBondContact O-N 3.22Å; M82-L85 PolarHBondContact O-N 3.18Å; F83-L85 VanDerWaalsContact C-N 3.34Å; F83-L85 PolarHBondContact O-N 3.37Å; L85-L88 WeakPolarHBondContact O-CB 3.5Å; L85-L88 PolarHBondContact O-N 2.89Å; L85-V89 WeakPolarHBondContact O-CG2 3.31Å; L85-V89 PolarHBondContact O-N 3.04Å
86	F	94.3	Very high	94	Very high	21 Å²	21	81.3 Å²	81.3	9%	0.092	39%	0.391	C	S	.	.	H	α-helix	trans	-64	-42.9	177.6	-76.7	-63.6	0	0	0	112.2	M82 F83 L88 V89 F90 M174 A177	M82-F86 HydrophobicContact CG-CD2 3.93Å; M82-F86 HydrophobicContact CG-CE2 3.68Å; M82-F86 VanDerWaalsContact O-CD2 3.24Å; M82-F86 WeakPolarHBondContact O-CD2 3.09Å; M82-F86 PolarHBondContact O-N 3.09Å; M82-F86 HydrophobicContact SD-CE2 4.27Å; F83-F86 PolarHBondContact O-N 2.76Å; F86-L88 VanDerWaalsContact C-N 3.27Å; F86-L88 PolarHBondContact O-N 2.87Å; F86-V89 PolarHBondContact O-N 2.86Å; F86-F90 WeakPolarHBondContact O-CD2 3.16Å; F86-F90 PolarHBondContact O-N 3.12Å; F86-M174 HydrophobicContact CD1-CB 3.88Å; F86-M174 HydrophobicContact CD1-CG 4.06Å; F86-M174 HydrophobicContact CD2-CG 4.29Å; F86-M174 HydrophobicContact CE1-CB 3.9Å; F86-M174 HydrophobicContact CE1-CG 4.35Å; F86-M174 HydrophobicContact CG-CB 4.4Å; F86-M174 HydrophobicContact CG-CG 4.05Å; F86-M174 HydrophobicContact CZ-CB 4.41Å; F86-A177 HydrophobicContact CE2-CB 3.97Å; F86-A177 HydrophobicContact CZ-CB 3.6Å
87	S	94.8	Very high	94.4	Very high	70 Å²	70	77.5 Å²	77.5	49%	0.49	37%	0.37	S	S	.	.	H	α-helix	trans	-58.6	-40.1	174	-63.6	0	0	0	0	112.1	F83 L84 F90 V91	F83-S87 WeakPolarHBondContact O-CB 3.29Å; F83-S87 PolarHBondContact O-N 2.75Å; F83-S87 PolarHBondContact O-OG 2.78Å; L84-S87 PolarHBondContact O-N 3.2Å; S87-F90 PolarHBondContact O-N 3.18Å; S87-V91 VanDerWaalsContact O-CG2 3.27Å; S87-V91 WeakPolarHBondContact O-CG2 3.36Å; S87-V91 PolarHBondContact O-N 3.04Å
88	L	95.9	Very high	94.7	Very high	96 Å²	96	75.1 Å²	75.1	50%	0.503	36%	0.357	S	S	.	.	H	α-helix	trans	-64.5	-44	175.9	-176.9	67.2	0	0	0	111.5	L84 L85 F86 F90 V91 V92	L84-L88 WeakPolarHBondContact O-CB 3.24Å; L84-L88 PolarHBondContact O-N 2.83Å; L85-L88 WeakPolarHBondContact O-CB 3.5Å; L85-L88 PolarHBondContact O-N 2.89Å; F86-L88 VanDerWaalsContact C-N 3.27Å; F86-L88 PolarHBondContact O-N 2.87Å; L88-F90 PolarHBondContact O-N 3Å; L88-V91 PolarHBondContact O-N 3.25Å; L88-V92 HydrophobicContact CD1-CG2 4.19Å; L88-V92 HydrophobicContact CG-CG2 4.32Å; L88-V92 WeakPolarHBondContact O-CB 3.05Å; L88-V92 VanDerWaalsContact O-CG2 3.25Å; L88-V92 WeakPolarHBondContact O-CG2 3.42Å; L88-V92 PolarHBondContact O-N 3.01Å
89	V	95.5	Very high	94.9	Very high	60 Å²	60	70.4 Å²	70.4	36%	0.364	35%	0.346	S	S	.	.	H	α-helix	trans	-59.8	-45.6	177	171.2	0	0	0	0	111.1	L85 F86 V92 S93 I170	L85-V89 WeakPolarHBondContact O-CG2 3.31Å; L85-V89 PolarHBondContact O-N 3.04Å; F86-V89 PolarHBondContact O-N 2.86Å; V89-V92 PolarHBondContact O-N 3.01Å; V89-S93 WeakPolarHBondContact O-CB 3.11Å; V89-S93 PolarHBondContact O-N 3.32Å; V89-S93 PolarHBondContact O-OG 2.73Å; V89-I170 HydrophobicContact CG1-CD1 4.26Å; V89-I170 HydrophobicContact CG1-CG1 4.4Å; V89-I170 HydrophobicContact CG1-CG2 3.98Å
90	F	95.6	Very high	95.1	Very high	30 Å²	30	66.7 Å²	66.7	13%	0.132	34%	0.338	C	S	.	.	H	α-helix	trans	-60.3	-51	175	-78.7	-66	0	0	0	112.1	F86 S87 L88 V92 S93 W94 I170 D171 M174	F86-F90 WeakPolarHBondContact O-CD2 3.16Å; F86-F90 PolarHBondContact O-N 3.12Å; S87-F90 PolarHBondContact O-N 3.18Å; L88-F90 PolarHBondContact O-N 3Å; F90-V92 VanDerWaalsContact C-N 3.34Å; F90-V92 PolarHBondContact O-N 2.91Å; F90-S93 WeakPolarHBondContact CA-OG 3.38Å; F90-S93 PolarHBondContact O-N 3.2Å; F90-S93 VanDerWaalsContact O-N 3.15Å; F90-S93 PolarHBondContact O-OG 3.42Å; F90-W94 HydrophobicContact CB-CD2 4.46Å; F90-W94 HydrophobicContact CB-CH2 4.07Å; F90-W94 HydrophobicContact CB-CZ2 3.84Å; F90-W94 HydrophobicContact CB-CZ3 4.47Å; F90-W94 HydrophobicContact CD1-CZ2 4.18Å; F90-W94 HydrophobicContact CG-CZ2 4.24Å; F90-W94 PolarHBondContact O-N 3.27Å; F90-I170 HydrophobicContact CD1-CG2 4.15Å; F90-I170 HydrophobicContact CE1-CG2 3.65Å; F90-I170 HydrophobicContact CE2-CG2 4.33Å; F90-I170 HydrophobicContact CZ-CG2 3.74Å; F90-D171 VanDerWaalsContact CE1-OD1 3.31Å; F90-D171 WeakPolarHBondContact CE1-OD1 3.42Å; F90-D171 WeakPolarHBondContact CZ-OD1 3.47Å; F90-M174 HydrophobicContact CE2-CE 4.22Å; F90-M174 HydrophobicContact CE2-SD 3.63Å; F90-M174 HydrophobicContact CZ-CE 4.09Å; F90-M174 HydrophobicContact CZ-SD 4.08Å
91	V	95.9	Very high	95.1	Very high	62 Å²	62	56.7 Å²	56.7	38%	0.376	30%	0.3	S	S	.	.	H	α-helix	trans	-59.3	-44.1	179.8	170.7	0	0	0	0	111.6	S87 L88 W94 L95	S87-V91 VanDerWaalsContact O-CG2 3.27Å; S87-V91 WeakPolarHBondContact O-CG2 3.36Å; S87-V91 PolarHBondContact O-N 3.04Å; L88-V91 PolarHBondContact O-N 3.25Å; V91-W94 HydrophobicContact CG2-CE3 4.25Å; V91-W94 HydrophobicContact CG2-CZ3 4.19Å; V91-W94 PolarHBondContact O-N 3.21Å; V91-L95 HydrophobicContact CG1-CD1 3.87Å; V91-L95 HydrophobicContact CG1-CG 4.38Å; V91-L95 WeakPolarHBondContact O-CB 3.29Å; V91-L95 VanDerWaalsContact O-CG 3.27Å; V91-L95 WeakPolarHBondContact O-CG 3.31Å; V91-L95 PolarHBondContact O-N 2.67Å
92	V	96.9	Very high	95.1	Very high	76 Å²	76	54.2 Å²	54.2	46%	0.461	29%	0.29	S	S	.	.	H	α-helix	trans	-63.6	-42.1	177.2	170.4	0	0	0	0	111.1	L88 V89 F90 L95 T96	L88-V92 HydrophobicContact CD1-CG2 4.19Å; L88-V92 HydrophobicContact CG-CG2 4.32Å; L88-V92 WeakPolarHBondContact O-CB 3.05Å; L88-V92 VanDerWaalsContact O-CG2 3.25Å; L88-V92 WeakPolarHBondContact O-CG2 3.42Å; L88-V92 PolarHBondContact O-N 3.01Å; V89-V92 PolarHBondContact O-N 3.01Å; F90-V92 VanDerWaalsContact C-N 3.34Å; F90-V92 PolarHBondContact O-N 2.91Å; V92-L95 PolarHBondContact O-N 2.85Å; V92-T96 WeakPolarHBondContact O-CB 3.39Å; V92-T96 PolarHBondContact O-N 2.77Å; V92-T96 PolarHBondContact O-OG1 2.93Å
93	S	96.6	Very high	95.1	Very high	11 Å²	11	57.1 Å²	57.1	8%	0.077	31%	0.307	C	S	.	.	H	α-helix	trans	-62.5	-47.2	176.1	67.8	0	0	0	0	111.9	V89 F90 L95 T96 F97 Q139	V89-S93 WeakPolarHBondContact O-CB 3.11Å; V89-S93 PolarHBondContact O-N 3.32Å; V89-S93 PolarHBondContact O-OG 2.73Å; F90-S93 WeakPolarHBondContact CA-OG 3.38Å; F90-S93 PolarHBondContact O-N 3.2Å; F90-S93 VanDerWaalsContact O-N 3.15Å; F90-S93 PolarHBondContact O-OG 3.42Å; S93-L95 VanDerWaalsContact C-N 3.33Å; S93-L95 PolarHBondContact O-N 2.93Å; S93-T96 PolarHBondContact O-N 3.18Å; S93-F97 VanDerWaalsContact O-CD2 3.24Å; S93-F97 WeakPolarHBondContact O-CD2 3.43Å; S93-F97 PolarHBondContact O-N 3.01Å; S93-Q139 PolarHBondContact OG-NE2 3.33Å; S93-Q139 PolarHBondContact OG-OE1 2.97Å
94	W	96.6	Very high	95	Very high	53 Å²	53	53.8 Å²	53.8	20%	0.201	29%	0.294	C	S	.	.	H	α-helix	trans	-62.4	-38.7	178	-59.6	-26.3	0	0	0	112.3	F90 V91 G98 F132 S135 I136 T140	F90-W94 HydrophobicContact CB-CD2 4.46Å; F90-W94 HydrophobicContact CB-CH2 4.07Å; F90-W94 HydrophobicContact CB-CZ2 3.84Å; F90-W94 HydrophobicContact CB-CZ3 4.47Å; F90-W94 HydrophobicContact CD1-CZ2 4.18Å; F90-W94 HydrophobicContact CG-CZ2 4.24Å; F90-W94 PolarHBondContact O-N 3.27Å; V91-W94 HydrophobicContact CG2-CE3 4.25Å; V91-W94 HydrophobicContact CG2-CZ3 4.19Å; V91-W94 PolarHBondContact O-N 3.21Å; W94-G98 WeakPolarHBondContact O-CA 3.23Å; W94-G98 PolarHBondContact O-N 2.68Å; W94-F132 HydrophobicContact CB-CD2 4.26Å; W94-F132 HydrophobicContact CB-CE2 3.58Å; W94-F132 HydrophobicContact CB-CZ 4.32Å; W94-S135 PolarHBondContact O-OG 2.81Å; W94-S135 VanDerWaalsContact O-OG 3.11Å; W94-I136 HydrophobicContact CB-CG1 4.05Å; W94-I136 HydrophobicContact CD2-CG1 3.82Å; W94-I136 HydrophobicContact CE3-CD1 4.28Å; W94-I136 HydrophobicContact CE3-CG1 4.04Å; W94-I136 HydrophobicContact CG-CG1 3.84Å; W94-T140 HydrophobicContact CZ2-CG2 3.83Å
95	L	96.4	Very high	94.7	Very high	73 Å²	73	48.7 Å²	48.7	38%	0.382	27%	0.268	S	S	.	.	H	α-helix	trans	-67.4	-40.9	175.4	-74	172.3	0	0	0	111.9	V91 V92 S93 L99 F128 F132	V91-L95 HydrophobicContact CG1-CD1 3.87Å; V91-L95 HydrophobicContact CG1-CG 4.38Å; V91-L95 WeakPolarHBondContact O-CB 3.29Å; V91-L95 VanDerWaalsContact O-CG 3.27Å; V91-L95 WeakPolarHBondContact O-CG 3.31Å; V91-L95 PolarHBondContact O-N 2.67Å; V92-L95 PolarHBondContact O-N 2.85Å; S93-L95 VanDerWaalsContact C-N 3.33Å; S93-L95 PolarHBondContact O-N 2.93Å; L95-L99 VanDerWaalsContact O-CB 3.22Å; L95-L99 WeakPolarHBondContact O-CB 3.31Å; L95-L99 PolarHBondContact O-N 3.1Å; L95-F128 HydrophobicContact CD2-CE1 4.41Å; L95-F128 HydrophobicContact CD2-CZ 4.12Å; L95-F132 HydrophobicContact CD2-CD2 3.84Å; L95-F132 HydrophobicContact CD2-CE2 3.69Å; L95-F132 HydrophobicContact CD2-CZ 4.44Å; L95-F132 HydrophobicContact CG-CD2 4.42Å; L95-F132 HydrophobicContact CG-CE2 3.94Å
96	T	95.9	Very high	94.5	Very high	84 Å²	84	49 Å²	49	52%	0.515	27%	0.269	S	S	.	.	H	α-helix	trans	-66.3	-47.7	-179.5	-55.3	0	0	0	0	111.1	V92 S93 L99 A100	V92-T96 WeakPolarHBondContact O-CB 3.39Å; V92-T96 PolarHBondContact O-N 2.77Å; V92-T96 PolarHBondContact O-OG1 2.93Å; S93-T96 PolarHBondContact O-N 3.18Å; T96-L99 PolarHBondContact O-N 2.83Å; T96-A100 PolarHBondContact O-N 2.71Å
97	F	95.8	Very high	94.2	Very high	14 Å²	14	55 Å²	55	6%	0.061	30%	0.302	C	S	.	.	H	α-helix	trans	-70.2	-40	177.1	-77.7	-70.9	0	0	0	112.2	S93 L99 A100 F101 S135 M159 F162 Q163 M166	S93-F97 VanDerWaalsContact O-CD2 3.24Å; S93-F97 WeakPolarHBondContact O-CD2 3.43Å; S93-F97 PolarHBondContact O-N 3.01Å; F97-L99 VanDerWaalsContact C-N 3.31Å; F97-L99 PolarHBondContact O-N 2.87Å; F97-A100 WeakPolarHBondContact O-CB 3.46Å; F97-A100 PolarHBondContact O-N 2.79Å; F97-A100 VanDerWaalsContact O-N 3.13Å; F97-F101 HydrophobicContact CB-CE2 4.42Å; F97-F101 WeakPolarHBondContact O-CD2 3.41Å; F97-F101 PolarHBondContact O-N 2.68Å; F97-S135 WeakPolarHBondContact CB-OG 3.27Å; F97-M159 HydrophobicContact CD1-CE 3.7Å; F97-M159 HydrophobicContact CE1-CE 3.78Å; F97-F162 AromaticContact CE1-CD1 3.68Å; F97-F162 HydrophobicContact CE1-CD1 3.68Å; F97-F162 HydrophobicContact CE1-CE1 4.07Å; F97-F162 AromaticContact CZ-CD1 3.81Å; F97-F162 HydrophobicContact CZ-CD1 3.81Å; F97-F162 AromaticContact CZ-CE1 3.85Å; F97-F162 HydrophobicContact CZ-CE1 3.85Å; F97-Q163 HydrophobicContact CB-CG 4.29Å; F97-Q163 HydrophobicContact CD1-CB 3.68Å; F97-Q163 HydrophobicContact CD1-CG 3.77Å; F97-Q163 HydrophobicContact CD2-CB 4.42Å; F97-Q163 HydrophobicContact CD2-CG 3.76Å; F97-Q163 HydrophobicContact CE1-CB 3.54Å; F97-Q163 HydrophobicContact CE1-CG 3.96Å; F97-Q163 HydrophobicContact CE2-CB 4.34Å; F97-Q163 HydrophobicContact CE2-CG 3.97Å; F97-Q163 HydrophobicContact CG-CB 4.14Å; F97-Q163 HydrophobicContact CG-CG 3.68Å; F97-Q163 HydrophobicContact CZ-CB 3.92Å; F97-Q163 HydrophobicContact CZ-CG 4.08Å; F97-M166 HydrophobicContact CE2-CB 4.3Å; F97-M166 HydrophobicContact CE2-CG 4.26Å; F97-M166 HydrophobicContact CZ-CB 4.16Å; F97-M166 HydrophobicContact CZ-CG 4.42Å
98	G	95.4	Very high	93.8	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-59.3	-41.1	173.3	0	0	0	0	0	112.6	W94 W102 A131 S135	W94-G98 WeakPolarHBondContact O-CA 3.23Å; W94-G98 PolarHBondContact O-N 2.68Å; G98-W102 WeakPolarHBondContact O-CB 3.23Å; G98-W102 PolarHBondContact O-N 3.41Å; G98-A131 WeakPolarHBondContact O-CB 2.97Å; G98-S135 PolarHBondContact N-OG 2.87Å
99	L	95.4	Very high	93.2	Very high	86 Å²	86	51.7 Å²	51.7	45%	0.45	28%	0.282	S	S	.	.	H	α-helix	trans	-64.7	-42.7	172.6	-176.1	67.6	0	0	0	111.5	L95 T96 F97 W102 V103 F128	L95-L99 VanDerWaalsContact O-CB 3.22Å; L95-L99 WeakPolarHBondContact O-CB 3.31Å; L95-L99 PolarHBondContact O-N 3.1Å; T96-L99 PolarHBondContact O-N 2.83Å; F97-L99 VanDerWaalsContact C-N 3.31Å; F97-L99 PolarHBondContact O-N 2.87Å; L99-W102 HydrophobicContact CD1-CE3 3.82Å; L99-W102 HydrophobicContact CD1-CZ3 4.25Å; L99-W102 PolarHBondContact O-N 2.77Å; L99-V103 HydrophobicContact CG-CG2 4.48Å; L99-V103 WeakPolarHBondContact O-CG2 3.33Å; L99-V103 PolarHBondContact O-N 3.01Å; L99-F128 HydrophobicContact CB-CE2 4.17Å; L99-F128 HydrophobicContact CD1-CE2 4.09Å
100	A	94.6	Very high	92.5	Very high	28 Å²	28	49.7 Å²	49.7	23%	0.231	27%	0.27	C	S	.	.	H	α-helix	trans	-61.9	-45.4	178.1	0	0	0	0	0	112.3	T96 F97 W102 V103 I104 M159	T96-A100 PolarHBondContact O-N 2.71Å; F97-A100 WeakPolarHBondContact O-CB 3.46Å; F97-A100 PolarHBondContact O-N 2.79Å; F97-A100 VanDerWaalsContact O-N 3.13Å; A100-W102 VanDerWaalsContact C-N 3.33Å; A100-W102 PolarHBondContact O-N 2.78Å; A100-V103 PolarHBondContact O-N 3.3Å; A100-I104 VanDerWaalsContact O-CG1 3.29Å; A100-I104 WeakPolarHBondContact O-CG1 3Å; A100-I104 PolarHBondContact O-N 2.86Å; A100-M159 HydrophobicContact CB-CE 3.63Å
101	F	93.8	Very high	91.4	Very high	5 Å²	5	50.8 Å²	50.8	2%	0.022	28%	0.276	C	S	.	.	H	α-helix	trans	-65	-36.6	174.3	-70.8	-62.7	0	0	0	112.6	F97 I104 G105 V122 A131 F134 M159 V160	F97-F101 HydrophobicContact CB-CE2 4.42Å; F97-F101 WeakPolarHBondContact O-CD2 3.41Å; F97-F101 PolarHBondContact O-N 2.68Å; F101-I104 PolarHBondContact O-N 3.08Å; F101-G105 PolarHBondContact O-N 2.97Å; F101-V122 HydrophobicContact CD1-CG2 4.49Å; F101-A131 HydrophobicContact CB-CB 4.48Å; F101-F134 HydrophobicContact CB-CD1 4.49Å; F101-F134 HydrophobicContact CD1-CD1 4.23Å; F101-F134 AromaticContact CD1-CE1 3.89Å; F101-F134 HydrophobicContact CD1-CE1 3.89Å; F101-F134 AromaticContact CD2-CD1 3.83Å; F101-F134 HydrophobicContact CD2-CD1 3.83Å; F101-F134 HydrophobicContact CD2-CE1 4.08Å; F101-F134 HydrophobicContact CE1-CD1 4.45Å; F101-F134 AromaticContact CE1-CE1 3.77Å; F101-F134 HydrophobicContact CE1-CE1 3.77Å; F101-F134 HydrophobicContact CE2-CD1 4.07Å; F101-F134 AromaticContact CE2-CE1 3.96Å; F101-F134 HydrophobicContact CE2-CE1 3.96Å; F101-F134 AromaticContact CG-CD1 3.93Å; F101-F134 HydrophobicContact CG-CD1 3.93Å; F101-F134 HydrophobicContact CG-CE1 4.06Å; F101-F134 HydrophobicContact CZ-CD1 4.38Å; F101-F134 AromaticContact CZ-CE1 3.81Å; F101-F134 HydrophobicContact CZ-CE1 3.81Å; F101-M159 HydrophobicContact CE1-CB 3.83Å; F101-M159 HydrophobicContact CZ-CB 4.01Å; F101-V160 HydrophobicContact CE1-CG2 3.91Å; F101-V160 HydrophobicContact CZ-CG2 3.77Å
102	W	92.7	Very high	90.4	Very high	84 Å²	84	54.1 Å²	54.1	32%	0.318	29%	0.287	S	S	.	.	H	α-helix	trans	-63.7	-42.8	174.8	-176.6	67.9	0	0	0	111.8	G98 L99 A100 G105 L106 F128 A131	G98-W102 WeakPolarHBondContact O-CB 3.23Å; G98-W102 PolarHBondContact O-N 3.41Å; L99-W102 HydrophobicContact CD1-CE3 3.82Å; L99-W102 HydrophobicContact CD1-CZ3 4.25Å; L99-W102 PolarHBondContact O-N 2.77Å; A100-W102 VanDerWaalsContact C-N 3.33Å; A100-W102 PolarHBondContact O-N 2.78Å; W102-G105 PolarHBondContact O-N 2.76Å; W102-L106 HydrophobicContact CD2-CD1 3.68Å; W102-L106 HydrophobicContact CD2-CG 4.31Å; W102-L106 HydrophobicContact CE3-CD1 3.64Å; W102-L106 HydrophobicContact CH2-CD1 3.52Å; W102-L106 HydrophobicContact CZ2-CD1 3.52Å; W102-L106 HydrophobicContact CZ2-CG 4.34Å; W102-L106 HydrophobicContact CZ3-CD1 3.56Å; W102-L106 WeakPolarHBondContact O-CB 3.45Å; W102-L106 VanDerWaalsContact O-CG 3.32Å; W102-L106 WeakPolarHBondContact O-CG 3.35Å; W102-L106 PolarHBondContact O-N 2.98Å; W102-F128 HydrophobicContact CB-CD2 4.17Å; W102-F128 HydrophobicContact CD2-CD2 4.24Å; W102-F128 HydrophobicContact CG-CB 4.35Å; W102-F128 HydrophobicContact CG-CD2 4.09Å; W102-A131 HydrophobicContact CB-CB 3.79Å
103	V	92.7	Very high	88.7	Confident	61 Å²	61	60.3 Å²	60.3	37%	0.37	31%	0.308	S	S	.	.	H	α-helix	trans	-65.5	-41.6	175.7	171.3	0	0	0	0	111.4	L99 A100 L106 L107	L99-V103 HydrophobicContact CG-CG2 4.48Å; L99-V103 WeakPolarHBondContact O-CG2 3.33Å; L99-V103 PolarHBondContact O-N 3.01Å; A100-V103 PolarHBondContact O-N 3.3Å; V103-L106 PolarHBondContact O-N 3.48Å; V103-L107 HydrophobicContact CG1-CD1 3.93Å; V103-L107 HydrophobicContact CG1-CG 4.3Å; V103-L107 WeakPolarHBondContact O-CG 3.15Å; V103-L107 PolarHBondContact O-N 3.39Å
104	I	91.3	Very high	86.8	Confident	31 Å²	31	64.9 Å²	64.9	16%	0.159	33%	0.331	C	S	.	.	H	α-helix	trans	-60.2	-47.7	175.5	-69.7	165.8	0	0	0	110.4	A100 F101 L106 L107 H108 C121 A156 M159	A100-I104 VanDerWaalsContact O-CG1 3.29Å; A100-I104 WeakPolarHBondContact O-CG1 3Å; A100-I104 PolarHBondContact O-N 2.86Å; F101-I104 PolarHBondContact O-N 3.08Å; I104-L106 VanDerWaalsContact C-N 3.32Å; I104-L106 PolarHBondContact O-N 2.85Å; I104-L107 PolarHBondContact O-N 2.62Å; I104-H108 WeakPolarHBondContact O-CB 2.93Å; I104-H108 PolarHBondContact O-N 2.88Å; I104-C121 HydrophobicContact CG2-CB 4.42Å; I104-A156 HydrophobicContact CG2-CB 4.36Å; I104-M159 HydrophobicContact CD1-CB 4.38Å; I104-M159 HydrophobicContact CD1-CG 3.71Å
105	G	88.8	Confident	84.7	Confident	3 Å²	3	74.8 Å²	74.8	3%	0.031	37%	0.369	C	S	.	.	H	α-helix	trans	-63.3	-36.2	177.1	0	0	0	0	0	113	F101 W102 G109 D110	F101-G105 PolarHBondContact O-N 2.97Å; W102-G105 PolarHBondContact O-N 2.76Å; G105-G109 PolarHBondContact O-N 3.39Å; G105-D110 WeakPolarHBondContact O-CB 3.34Å; G105-D110 PolarHBondContact O-N 3.4Å
106	L	89	Confident	82.9	Confident	80 Å²	80	74 Å²	74	42%	0.419	38%	0.378	S	S	.	.	H	α-helix	trans	-66.1	-44.1	174.4	-78.8	174.4	0	0	0	112.9	W102 V103 I104 H108 G109 M111	W102-L106 HydrophobicContact CD2-CD1 3.68Å; W102-L106 HydrophobicContact CD2-CG 4.31Å; W102-L106 HydrophobicContact CE3-CD1 3.64Å; W102-L106 HydrophobicContact CH2-CD1 3.52Å; W102-L106 HydrophobicContact CZ2-CD1 3.52Å; W102-L106 HydrophobicContact CZ2-CG 4.34Å; W102-L106 HydrophobicContact CZ3-CD1 3.56Å; W102-L106 WeakPolarHBondContact O-CB 3.45Å; W102-L106 VanDerWaalsContact O-CG 3.32Å; W102-L106 WeakPolarHBondContact O-CG 3.35Å; W102-L106 PolarHBondContact O-N 2.98Å; V103-L106 PolarHBondContact O-N 3.48Å; I104-L106 VanDerWaalsContact C-N 3.32Å; I104-L106 PolarHBondContact O-N 2.85Å; L106-H108 VanDerWaalsContact C-N 3.33Å; L106-G109 PolarHBondContact O-N 3.02Å; L106-M111 HydrophobicContact CD2-CB 4.43Å; L106-M111 HydrophobicContact CD2-CG 3.85Å; L106-M111 HydrophobicContact CG-CG 4.44Å
107	L	88.3	Confident	81.6	Confident	148 Å²	148	78.5 Å²	78.5	78%	0.775	40%	0.4	S	S	*	.	H	α-helix	trans	-69.1	-33.8	179.8	-70.6	174	0	0	0	112.1	V103 I104 G109	V103-L107 HydrophobicContact CG1-CD1 3.93Å; V103-L107 HydrophobicContact CG1-CG 4.3Å; V103-L107 WeakPolarHBondContact O-CG 3.15Å; V103-L107 PolarHBondContact O-N 3.39Å; I104-L107 PolarHBondContact O-N 2.62Å; L107-G109 VanDerWaalsContact C-N 3.34Å
108	H	86.2	Confident	80.8	Confident	72 Å²	72	82 Å²	82	33%	0.333	42%	0.415	S	S	.	.	H	α-helix	trans	-77	-21.8	176.5	-167.4	-110.3	0	0	0	112.9	I104 L106 D110 F118 C121	I104-H108 WeakPolarHBondContact O-CB 2.93Å; I104-H108 PolarHBondContact O-N 2.88Å; L106-H108 VanDerWaalsContact C-N 3.33Å; H108-D110 IonicContact CE1-OD1 3.68Å; H108-D110 IonicContact CG-OD1 3.64Å; H108-D110 IonicContact ND1-OD1 2.7Å; H108-D110 PolarHBondContact ND1-OD1 3.11Å; H108-F118 AromaticContact CE1-CE2 3.82Å; H108-F118 AromaticContact CE1-CZ 3.39Å; H108-F118 WeakPolarHBondContact CE1-CZ 3.29Å; H108-F118 AromaticContact ND1-CE1 3.98Å; H108-F118 AromaticContact ND1-CZ 3.3Å; H108-F118 VanDerWaalsContact ND1-CZ 3.3Å; H108-F118 WeakPolarHBondContact ND1-CZ 3.33Å; H108-C121 VanDerWaalsContact CB-SG 3.58Å; H108-C121 PolarHBondContact ND1-SG 2.84Å
109	G	84.5	Confident	80.2	Confident	24 Å²	24	85.1 Å²	85.1	25%	0.247	43%	0.434	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.9	15.4	-177.6	0	0	0	0	0	114.4	G105 L106 L107 M111 E112	G105-G109 PolarHBondContact O-N 3.39Å; L106-G109 PolarHBondContact O-N 3.02Å; L107-G109 VanDerWaalsContact C-N 3.34Å; G109-M111 PolarHBondContact O-N 2.7Å; G109-E112 PolarHBondContact O-N 3.45Å
110	D	80.3	Confident	79.8	Confident	19 Å²	19	82.8 Å²	82.8	10%	0.102	42%	0.424	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-22.9	-178.6	-70.1	-9.6	0	0	0	113.6	G105 H108 F118 P120 C121	G105-D110 WeakPolarHBondContact O-CB 3.34Å; G105-D110 PolarHBondContact O-N 3.4Å; H108-D110 IonicContact CE1-OD1 3.68Å; H108-D110 IonicContact CG-OD1 3.64Å; H108-D110 IonicContact ND1-OD1 2.7Å; H108-D110 PolarHBondContact ND1-OD1 3.11Å; D110-F118 VanDerWaalsContact OD1-CE1 3.3Å; D110-F118 WeakPolarHBondContact OD1-CE1 3.34Å; D110-P120 HydrophobicContact CB-CB 4.37Å; D110-P120 WeakPolarHBondContact OD1-CA 3.38Å; D110-C121 PolarHBondContact OD1-N 2.78Å; D110-C121 WeakPolarHBondContact OD2-CB 3.39Å; D110-C121 PolarHBondContact OD2-N 2.99Å
111	M	73	Confident	79.4	Confident	53 Å²	53	81.5 Å²	81.5	26%	0.261	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-17.9	-178	-58.3	-70.6	166.6	0	0	112.8	L106 G109 V125 N126	L106-M111 HydrophobicContact CD2-CB 4.43Å; L106-M111 HydrophobicContact CD2-CG 3.85Å; L106-M111 HydrophobicContact CG-CG 4.44Å; G109-M111 PolarHBondContact O-N 2.7Å; M111-V125 HydrophobicContact CE-CG1 3.94Å; M111-V125 WeakPolarHBondContact CE-O 3.25Å; M111-V125 VanDerWaalsContact SD-O 3.39Å; M111-N126 WeakPolarHBondContact SD-CA 3.44Å
112	E	73.4	Confident	79.2	Confident	132 Å²	132	81.7 Å²	81.7	62%	0.617	41%	0.414	S	S	*	.	S	Bend	trans	-88.5	120.3	-179.9	-164.8	165.1	-154	0	0	109.2	G109 N114	G109-E112 PolarHBondContact O-N 3.45Å; E112-N114 PolarHBondContact O-N 3.02Å
113	K	61.5	Low	78.9	Confident	205 Å²	205	79.8 Å²	79.8	89%	0.891	41%	0.412	S	S	*	.			trans	-71.6	74.4	179.2	-81.8	-176.8	175.4	176.5	0	110.9
114	N	57.5	Low	78.6	Confident	107 Å²	107	82.7 Å²	82.7	57%	0.572	42%	0.422	S	S	*	.			trans	-81.9	125.8	170.5	-79.4	-31.1	0	0	0	110.4	E112 G116	E112-N114 PolarHBondContact O-N 3.02Å; N114-G116 VanDerWaalsContact C-N 3.27Å; N114-G116 PolarHBondContact O-N 3.22Å; N114-G116 VanDerWaalsContact O-N 3.08Å
115	R	52.3	Low	78.3	Confident	261 Å²	261	81.5 Å²	81.5	99%	0.985	42%	0.416	S	S	*	.			trans	-82.6	52.6	-174.6	-69.9	-178.8	172.2	-176.5	-2.1	112.6
116	G	59.4	Low	78	Confident	57 Å²	57	85.9 Å²	85.9	59%	0.588	44%	0.439	S	S	*	.	S	Bend	trans	-139.8	-172.7	178.3	0	0	0	0	0	113.8	N114 F118	N114-G116 VanDerWaalsContact C-N 3.27Å; N114-G116 PolarHBondContact O-N 3.22Å; N114-G116 VanDerWaalsContact O-N 3.08Å; G116-F118 PolarHBondContact O-N 2.83Å
117	D	68.1	Low	78	Confident	179 Å²	179	85.3 Å²	85.3	96%	0.957	44%	0.439	S	S	*	.	S	Bend	trans	-69	45.4	175.1	-66.9	-30.5	0	0	0	112.7
118	F	79.1	Confident	78.1	Confident	87 Å²	87	81.9 Å²	81.9	38%	0.382	42%	0.418	S	S	.	.			trans	-87.3	116.5	178.6	-177.3	-94.5	0	0	0	109.7	H108 D110 G116	H108-F118 AromaticContact CE1-CE2 3.82Å; H108-F118 AromaticContact CE1-CZ 3.39Å; H108-F118 WeakPolarHBondContact CE1-CZ 3.29Å; H108-F118 AromaticContact ND1-CE1 3.98Å; H108-F118 AromaticContact ND1-CZ 3.3Å; H108-F118 VanDerWaalsContact ND1-CZ 3.3Å; H108-F118 WeakPolarHBondContact ND1-CZ 3.33Å; D110-F118 VanDerWaalsContact OD1-CE1 3.3Å; D110-F118 WeakPolarHBondContact OD1-CE1 3.34Å; G116-F118 PolarHBondContact O-N 2.83Å
119	V	82.8	Confident	78.4	Confident	66 Å²	66	83 Å²	83	40%	0.4	43%	0.429	S	S	.	.			trans	-92.1	115.9	176.9	-178.4	0	0	0	0	108.2	T150 E152	V119-T150 HydrophobicContact CG1-CG2 4.09Å; V119-E152 HydrophobicContact CB-CG 3.7Å; V119-E152 HydrophobicContact CG1-CG 3.46Å; V119-E152 VanDerWaalsContact CG1-CG 3.46Å
120	P	86.6	Confident	78.8	Confident	36 Å²	36	83 Å²	83	23%	0.234	42%	0.424	C	S	.	.			trans	-72.5	155.9	-178.9	30.5	-35.4	0	0	0	111.2	D110 V122 T123 T150	D110-P120 HydrophobicContact CB-CB 4.37Å; D110-P120 WeakPolarHBondContact OD1-CA 3.38Å; P120-V122 VanDerWaalsContact C-N 3.33Å; P120-V122 PolarHBondContact O-N 2.82Å; P120-T123 HydrophobicContact CG-CG2 4.29Å; P120-T150 WeakPolarHBondContact O-CB 3.26Å; P120-T150 WeakPolarHBondContact O-CG2 3.29Å; P120-T150 PolarHBondContact O-OG1 2.99Å
121	C	87.1	Confident	79.4	Confident	2 Å²	2	82 Å²	82	1%	0.014	42%	0.419	C	S	.	.	S	Bend	trans	-63.3	-40	175.2	-62.5	0	0	0	0	112	I104 H108 D110 T150 C153 A156	I104-C121 HydrophobicContact CG2-CB 4.42Å; H108-C121 VanDerWaalsContact CB-SG 3.58Å; H108-C121 PolarHBondContact ND1-SG 2.84Å; D110-C121 PolarHBondContact OD1-N 2.78Å; D110-C121 WeakPolarHBondContact OD2-CB 3.39Å; D110-C121 PolarHBondContact OD2-N 2.99Å; C121-T150 WeakPolarHBondContact CA-OG1 3.3Å; C121-T150 PolarHBondContact O-N 2.99Å; C121-T150 PolarHBondContact O-OG1 3.25Å; C121-T150 VanDerWaalsContact O-OG1 3.13Å; C121-C153 WeakPolarHBondContact CA-SG 3.38Å; C121-C153 HydrophobicContact CB-CB 3.59Å; C121-C153 WeakPolarHBondContact CB-SG 3.47Å; C121-C153 WeakPolarHBondContact SG-CB 2.91Å; C121-C153 CovalentContact SG-SG 2.03Å; C121-C153 PolarHBondContact SG-SG 2.83Å; C121-A156 HydrophobicContact CB-CB 4.24Å
122	V	88.1	Confident	80.4	Confident	8 Å²	8	81.8 Å²	81.8	5%	0.048	42%	0.417	C	S	.	.	B	Isolated β-bridge	trans	-134.5	125.6	174.4	-173.7	0	0	0	0	108.7	F101 P120 V125 F134 C148	F101-V122 HydrophobicContact CD1-CG2 4.49Å; P120-V122 VanDerWaalsContact C-N 3.33Å; P120-V122 PolarHBondContact O-N 2.82Å; V122-V125 HydrophobicContact CB-CB 4.46Å; V122-V125 HydrophobicContact CB-CG2 3.81Å; V122-V125 HydrophobicContact CG1-CG2 3.51Å; V122-F134 HydrophobicContact CG1-CD1 4Å; V122-F134 HydrophobicContact CG1-CD2 3.86Å; V122-F134 HydrophobicContact CG1-CE1 3.87Å; V122-F134 HydrophobicContact CG1-CE2 3.71Å; V122-F134 HydrophobicContact CG1-CG 3.99Å; V122-F134 HydrophobicContact CG1-CZ 3.72Å; V122-F134 HydrophobicContact CG2-CD1 4.49Å; V122-F134 HydrophobicContact CG2-CE1 3.93Å; V122-F134 HydrophobicContact CG2-CZ 4.19Å; V122-C148 WeakPolarHBondContact CA-O 3.17Å
123	T	87.7	Confident	81.4	Confident	45 Å²	45	78.7 Å²	78.7	28%	0.276	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	140.8	-178.3	60.3	0	0	0	0	111.3	P120 V125 R147 C148 T150	P120-T123 HydrophobicContact CG-CG2 4.29Å; T123-V125 VanDerWaalsContact C-N 3.28Å; T123-V125 PolarHBondContact O-N 3.18Å; T123-R147 WeakPolarHBondContact O-CA 3.43Å; T123-C148 PolarHBondContact N-O 2.88Å; T123-C148 PolarHBondContact OG1-N 3.05Å; T123-C148 PolarHBondContact OG1-O 3.14Å; T123-T150 HydrophobicContact CG2-CG2 4.15Å
124	Q	84.8	Confident	83	Confident	121 Å²	121	69.2 Å²	69.2	57%	0.565	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.8	25.3	173.6	-59	-70.1	-11.2	0	0	115.6	R147	Q124-R147 HydrophobicContact CB-CG 4.17Å
125	V	86.1	Confident	84.8	Confident	6 Å²	6	64.1 Å²	64.1	4%	0.036	34%	0.336	C	S	.	.			trans	-99.1	87.4	172.6	-179.6	0	0	0	0	109.7	M111 V122 T123 A131 F134	M111-V125 HydrophobicContact CE-CG1 3.94Å; M111-V125 WeakPolarHBondContact CE-O 3.25Å; M111-V125 VanDerWaalsContact SD-O 3.39Å; V122-V125 HydrophobicContact CB-CB 4.46Å; V122-V125 HydrophobicContact CB-CG2 3.81Å; V122-V125 HydrophobicContact CG1-CG2 3.51Å; T123-V125 VanDerWaalsContact C-N 3.28Å; T123-V125 PolarHBondContact O-N 3.18Å; V125-A131 HydrophobicContact CG1-CB 3.63Å; V125-F134 HydrophobicContact CG2-CB 4.39Å
126	N	82.9	Confident	86.9	Confident	95 Å²	95	53.3 Å²	53.3	51%	0.508	30%	0.297	S	S	.	.			trans	-107.4	-10.6	-174.2	-55.4	-29	0	0	0	113.8	M111 T130	M111-N126 WeakPolarHBondContact SD-CA 3.44Å; N126-T130 PolarHBondContact N-OG1 2.87Å
127	T	88.8	Confident	88.6	Confident	68 Å²	68	50.9 Å²	50.9	42%	0.417	27%	0.27	S	S	.	.	S	Bend	trans	-145.7	164.4	-178.1	62.2	0	0	0	0	110.5	V129 T130 A131	T127-V129 PolarHBondContact O-N 2.79Å; T127-T130 PolarHBondContact N-OG1 2.85Å; T127-T130 PolarHBondContact O-N 3.19Å; T127-T130 PolarHBondContact O-OG1 3.4Å; T127-T130 PolarHBondContact OG1-N 3.32Å; T127-T130 PolarHBondContact OG1-OG1 3.12Å; T127-T130 VanDerWaalsContact OG1-OG1 3.07Å; T127-A131 PolarHBondContact O-N 3.21Å; T127-A131 VanDerWaalsContact O-N 3.08Å
128	F	90.5	Very high	89.8	Confident	77 Å²	77	43.5 Å²	43.5	34%	0.338	23%	0.232	S	C	.	.	H	α-helix	trans	-56.5	-39.6	172.4	176.8	-101.2	0	0	0	112.2	L95 L99 W102 T130 A131 F132	L95-F128 HydrophobicContact CD2-CE1 4.41Å; L95-F128 HydrophobicContact CD2-CZ 4.12Å; L99-F128 HydrophobicContact CB-CE2 4.17Å; L99-F128 HydrophobicContact CD1-CE2 4.09Å; W102-F128 HydrophobicContact CB-CD2 4.17Å; W102-F128 HydrophobicContact CD2-CD2 4.24Å; W102-F128 HydrophobicContact CG-CB 4.35Å; W102-F128 HydrophobicContact CG-CD2 4.09Å; F128-T130 VanDerWaalsContact C-N 3.34Å; F128-T130 PolarHBondContact O-N 2.81Å; F128-A131 WeakPolarHBondContact O-CB 3.36Å; F128-A131 PolarHBondContact O-N 3.04Å; F128-F132 WeakPolarHBondContact O-CB 3.31Å; F128-F132 PolarHBondContact O-N 3.3Å
129	V	93	Very high	90.6	Very high	94 Å²	94	39.9 Å²	39.9	57%	0.57	22%	0.216	S	C	*	.	H	α-helix	trans	-63	-41.3	179.2	-179.3	0	0	0	0	111.2	T127 A131 F132 L133	T127-V129 PolarHBondContact O-N 2.79Å; V129-A131 VanDerWaalsContact C-N 3.34Å; V129-F132 PolarHBondContact O-N 3.36Å; V129-L133 HydrophobicContact CG1-CD1 4.34Å; V129-L133 VanDerWaalsContact O-CG 3.31Å; V129-L133 WeakPolarHBondContact O-CG 3.47Å; V129-L133 PolarHBondContact O-N 2.93Å
130	T	91.4	Very high	91.1	Very high	24 Å²	24	39 Å²	39	15%	0.147	21%	0.211	C	C	.	.	H	α-helix	trans	-68.5	-32.2	176.3	47.3	0	0	0	0	112.9	N126 T127 F128 F134	N126-T130 PolarHBondContact N-OG1 2.87Å; T127-T130 PolarHBondContact N-OG1 2.85Å; T127-T130 PolarHBondContact O-N 3.19Å; T127-T130 PolarHBondContact O-OG1 3.4Å; T127-T130 PolarHBondContact OG1-N 3.32Å; T127-T130 PolarHBondContact OG1-OG1 3.12Å; T127-T130 VanDerWaalsContact OG1-OG1 3.07Å; F128-T130 VanDerWaalsContact C-N 3.34Å; F128-T130 PolarHBondContact O-N 2.81Å; T130-F134 WeakPolarHBondContact O-CB 3.22Å; T130-F134 PolarHBondContact O-N 3.35Å
131	A	92.8	Very high	91.5	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-70.2	-39.1	173.3	0	0	0	0	0	111.7	G98 F101 W102 V125 T127 F128 V129 F134 S135	G98-A131 WeakPolarHBondContact O-CB 2.97Å; F101-A131 HydrophobicContact CB-CB 4.48Å; W102-A131 HydrophobicContact CB-CB 3.79Å; V125-A131 HydrophobicContact CG1-CB 3.63Å; T127-A131 PolarHBondContact O-N 3.21Å; T127-A131 VanDerWaalsContact O-N 3.08Å; F128-A131 WeakPolarHBondContact O-CB 3.36Å; F128-A131 PolarHBondContact O-N 3.04Å; V129-A131 VanDerWaalsContact C-N 3.34Å; A131-F134 PolarHBondContact O-N 2.99Å; A131-S135 PolarHBondContact O-N 2.97Å
132	F	94.6	Very high	91.9	Very high	48 Å²	48	47.3 Å²	47.3	21%	0.211	26%	0.257	C	S	.	.	H	α-helix	trans	-63.8	-43.9	173.4	176.4	-110.3	0	0	0	112	W94 L95 F128 V129 F134 S135 I136	W94-F132 HydrophobicContact CB-CD2 4.26Å; W94-F132 HydrophobicContact CB-CE2 3.58Å; W94-F132 HydrophobicContact CB-CZ 4.32Å; L95-F132 HydrophobicContact CD2-CD2 3.84Å; L95-F132 HydrophobicContact CD2-CE2 3.69Å; L95-F132 HydrophobicContact CD2-CZ 4.44Å; L95-F132 HydrophobicContact CG-CD2 4.42Å; L95-F132 HydrophobicContact CG-CE2 3.94Å; F128-F132 WeakPolarHBondContact O-CB 3.31Å; F128-F132 PolarHBondContact O-N 3.3Å; V129-F132 PolarHBondContact O-N 3.36Å; F132-F134 VanDerWaalsContact C-N 3.35Å; F132-F134 PolarHBondContact O-N 3.28Å; F132-S135 WeakPolarHBondContact O-CB 3.18Å; F132-S135 PolarHBondContact O-N 2.69Å; F132-I136 HydrophobicContact CD1-CD1 3.89Å; F132-I136 HydrophobicContact CE1-CD1 3.37Å; F132-I136 HydrophobicContact CE1-CG1 4.41Å; F132-I136 HydrophobicContact CE2-CD1 4.18Å; F132-I136 HydrophobicContact CE2-CG1 4.43Å; F132-I136 HydrophobicContact CG-CD1 4.5Å; F132-I136 HydrophobicContact CZ-CD1 3.55Å; F132-I136 HydrophobicContact CZ-CG1 4.25Å; F132-I136 WeakPolarHBondContact O-CG1 3.48Å; F132-I136 PolarHBondContact O-N 2.81Å
133	L	94.5	Very high	92	Very high	66 Å²	66	49.4 Å²	49.4	35%	0.346	28%	0.28	S	S	.	.	H	α-helix	trans	-61	-43.7	174	-72	172.9	0	0	0	111.5	V129 S135 I136 E137	V129-L133 HydrophobicContact CG1-CD1 4.34Å; V129-L133 VanDerWaalsContact O-CG 3.31Å; V129-L133 WeakPolarHBondContact O-CG 3.47Å; V129-L133 PolarHBondContact O-N 2.93Å; L133-S135 VanDerWaalsContact C-N 3.34Å; L133-S135 PolarHBondContact O-N 3.44Å; L133-I136 PolarHBondContact O-N 2.94Å; L133-E137 VanDerWaalsContact O-CG 3.27Å; L133-E137 WeakPolarHBondContact O-CG 3.16Å; L133-E137 PolarHBondContact O-N 2.83Å
134	F	94.6	Very high	92.1	Very high	7 Å²	7	55.2 Å²	55.2	3%	0.031	30%	0.298	C	S	.	.	H	α-helix	trans	-58.7	-45.8	174	178.8	-111.4	0	0	0	111.7	F101 V122 V125 T130 A131 F132 I136 E137 T138 R147 V149 V160	F101-F134 HydrophobicContact CB-CD1 4.49Å; F101-F134 HydrophobicContact CD1-CD1 4.23Å; F101-F134 AromaticContact CD1-CE1 3.89Å; F101-F134 HydrophobicContact CD1-CE1 3.89Å; F101-F134 AromaticContact CD2-CD1 3.83Å; F101-F134 HydrophobicContact CD2-CD1 3.83Å; F101-F134 HydrophobicContact CD2-CE1 4.08Å; F101-F134 HydrophobicContact CE1-CD1 4.45Å; F101-F134 AromaticContact CE1-CE1 3.77Å; F101-F134 HydrophobicContact CE1-CE1 3.77Å; F101-F134 HydrophobicContact CE2-CD1 4.07Å; F101-F134 AromaticContact CE2-CE1 3.96Å; F101-F134 HydrophobicContact CE2-CE1 3.96Å; F101-F134 AromaticContact CG-CD1 3.93Å; F101-F134 HydrophobicContact CG-CD1 3.93Å; F101-F134 HydrophobicContact CG-CE1 4.06Å; F101-F134 HydrophobicContact CZ-CD1 4.38Å; F101-F134 AromaticContact CZ-CE1 3.81Å; F101-F134 HydrophobicContact CZ-CE1 3.81Å; V122-F134 HydrophobicContact CG1-CD1 4Å; V122-F134 HydrophobicContact CG1-CD2 3.86Å; V122-F134 HydrophobicContact CG1-CE1 3.87Å; V122-F134 HydrophobicContact CG1-CE2 3.71Å; V122-F134 HydrophobicContact CG1-CG 3.99Å; V122-F134 HydrophobicContact CG1-CZ 3.72Å; V122-F134 HydrophobicContact CG2-CD1 4.49Å; V122-F134 HydrophobicContact CG2-CE1 3.93Å; V122-F134 HydrophobicContact CG2-CZ 4.19Å; V125-F134 HydrophobicContact CG2-CB 4.39Å; T130-F134 WeakPolarHBondContact O-CB 3.22Å; T130-F134 PolarHBondContact O-N 3.35Å; A131-F134 PolarHBondContact O-N 2.99Å; F132-F134 VanDerWaalsContact C-N 3.35Å; F132-F134 PolarHBondContact O-N 3.28Å; F134-I136 VanDerWaalsContact C-N 3.32Å; F134-I136 PolarHBondContact O-N 3.34Å; F134-E137 WeakPolarHBondContact O-CB 3.36Å; F134-E137 PolarHBondContact O-N 3.11Å; F134-E137 VanDerWaalsContact O-N 3.15Å; F134-T138 PolarHBondContact O-N 3.23Å; F134-T138 PolarHBondContact O-OG1 3.24Å; F134-T138 VanDerWaalsContact O-OG1 3.04Å; F134-R147 HydrophobicContact CB-CB 4.47Å; F134-R147 HydrophobicContact CD2-CB 3.68Å; F134-R147 HydrophobicContact CE2-CB 4.42Å; F134-R147 HydrophobicContact CG-CB 4.46Å; F134-V149 HydrophobicContact CZ-CB 4.4Å; F134-V160 HydrophobicContact CE1-CG2 4.38Å; F134-V160 HydrophobicContact CZ-CG2 4.26Å
135	S	95.9	Very high	92.1	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-58.6	-41.8	176.3	175.6	0	0	0	0	112.7	W94 F97 G98 A131 F132 L133 Q139 Q163	W94-S135 PolarHBondContact O-OG 2.81Å; W94-S135 VanDerWaalsContact O-OG 3.11Å; F97-S135 WeakPolarHBondContact CB-OG 3.27Å; G98-S135 PolarHBondContact N-OG 2.87Å; A131-S135 PolarHBondContact O-N 2.97Å; F132-S135 WeakPolarHBondContact O-CB 3.18Å; F132-S135 PolarHBondContact O-N 2.69Å; L133-S135 VanDerWaalsContact C-N 3.34Å; L133-S135 PolarHBondContact O-N 3.44Å; S135-Q139 WeakPolarHBondContact O-CB 3.32Å; S135-Q139 PolarHBondContact O-N 3.39Å; S135-Q163 PolarHBondContact O-NE2 2.88Å; S135-Q163 PolarHBondContact OG-NE2 3.48Å
136	I	95.8	Very high	92.2	Very high	34 Å²	34	54.3 Å²	54.3	17%	0.174	32%	0.317	C	S	.	.	H	α-helix	trans	-62.2	-50.5	173.9	-67.7	167.4	0	0	0	110.2	W94 F132 L133 F134 T138 Q139 T140	W94-I136 HydrophobicContact CB-CG1 4.05Å; W94-I136 HydrophobicContact CD2-CG1 3.82Å; W94-I136 HydrophobicContact CE3-CD1 4.28Å; W94-I136 HydrophobicContact CE3-CG1 4.04Å; W94-I136 HydrophobicContact CG-CG1 3.84Å; F132-I136 HydrophobicContact CD1-CD1 3.89Å; F132-I136 HydrophobicContact CE1-CD1 3.37Å; F132-I136 HydrophobicContact CE1-CG1 4.41Å; F132-I136 HydrophobicContact CE2-CD1 4.18Å; F132-I136 HydrophobicContact CE2-CG1 4.43Å; F132-I136 HydrophobicContact CG-CD1 4.5Å; F132-I136 HydrophobicContact CZ-CD1 3.55Å; F132-I136 HydrophobicContact CZ-CG1 4.25Å; F132-I136 WeakPolarHBondContact O-CG1 3.48Å; F132-I136 PolarHBondContact O-N 2.81Å; L133-I136 PolarHBondContact O-N 2.94Å; F134-I136 VanDerWaalsContact C-N 3.32Å; F134-I136 PolarHBondContact O-N 3.34Å; I136-T138 VanDerWaalsContact C-N 3.28Å; I136-T138 PolarHBondContact O-N 2.98Å; I136-Q139 PolarHBondContact O-N 2.83Å; I136-T140 HydrophobicContact CG2-CG2 4.16Å; I136-T140 WeakPolarHBondContact O-CB 3.5Å; I136-T140 PolarHBondContact O-N 2.83Å; I136-T140 PolarHBondContact O-OG1 3.04Å
137	E	94.9	Very high	92.5	Very high	5 Å²	5	52.5 Å²	52.5	2%	0.023	30%	0.303	C	S	.	.	H	α-helix	trans	-56.5	-41.5	-178.5	-72.1	170.7	-142	0	0	112.1	L133 F134 T141 I142 G143 Y144 R147	L133-E137 VanDerWaalsContact O-CG 3.27Å; L133-E137 WeakPolarHBondContact O-CG 3.16Å; L133-E137 PolarHBondContact O-N 2.83Å; F134-E137 WeakPolarHBondContact O-CB 3.36Å; F134-E137 PolarHBondContact O-N 3.11Å; F134-E137 VanDerWaalsContact O-N 3.15Å; E137-T141 PolarHBondContact O-N 2.69Å; E137-I142 PolarHBondContact O-N 3.22Å; E137-I142 VanDerWaalsContact O-N 3.13Å; E137-G143 PolarHBondContact O-N 3.45Å; E137-Y144 VanDerWaalsContact CD-CD2 3.47Å; E137-Y144 HydrophobicContact CG-CD2 3.61Å; E137-Y144 HydrophobicContact CG-CE2 4Å; E137-R147 IonicContact OE1-CZ 3.02Å; E137-R147 IonicContact OE1-NH1 2.62Å; E137-R147 PolarHBondContact OE1-NH1 3.36Å
138	T	94.3	Very high	92.6	Very high	25 Å²	25	52 Å²	52	15%	0.153	30%	0.302	C	S	.	.	H	α-helix	trans	-70.8	-50.3	178.3	-55.4	0	0	0	0	111.9	F134 I136 T141 V160 Q163	F134-T138 PolarHBondContact O-N 3.23Å; F134-T138 PolarHBondContact O-OG1 3.24Å; F134-T138 VanDerWaalsContact O-OG1 3.04Å; I136-T138 VanDerWaalsContact C-N 3.28Å; I136-T138 PolarHBondContact O-N 2.98Å; T138-T141 PolarHBondContact O-N 3.42Å; T138-V160 HydrophobicContact CG2-CG1 3.91Å; T138-V160 HydrophobicContact CG2-CG2 4.4Å; T138-Q163 VanDerWaalsContact CG2-OE1 3.27Å
139	Q	95.5	Very high	92.7	Very high	10 Å²	10	51 Å²	51	5%	0.047	30%	0.302	C	S	.	.	H	α-helix	trans	-72.7	-36.7	-174.5	-165	172.2	-40.8	0	0	113.2	S93 S135 I136 T141 Q163	S93-Q139 PolarHBondContact OG-NE2 3.33Å; S93-Q139 PolarHBondContact OG-OE1 2.97Å; S135-Q139 WeakPolarHBondContact O-CB 3.32Å; S135-Q139 PolarHBondContact O-N 3.39Å; I136-Q139 PolarHBondContact O-N 2.83Å; Q139-T141 VanDerWaalsContact C-N 3.26Å; Q139-Q163 HydrophobicContact CB-CG 4.13Å; Q139-Q163 HydrophobicContact CG-CG 4.33Å
140	T	94.4	Very high	92.5	Very high	48 Å²	48	47.9 Å²	47.9	29%	0.294	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-1.9	177.8	61.7	0	0	0	0	112.7	W94 I136 I142	W94-T140 HydrophobicContact CZ2-CG2 3.83Å; I136-T140 HydrophobicContact CG2-CG2 4.16Å; I136-T140 WeakPolarHBondContact O-CB 3.5Å; I136-T140 PolarHBondContact O-N 2.83Å; I136-T140 PolarHBondContact O-OG1 3.04Å; T140-I142 PolarHBondContact O-N 3.24Å; T140-I142 VanDerWaalsContact OG1-CD1 3.25Å; T140-I142 WeakPolarHBondContact OG1-CD1 3.48Å; T140-I142 VanDerWaalsContact OG1-CG1 3.29Å; T140-I142 WeakPolarHBondContact OG1-CG1 3.45Å
141	T	94.6	Very high	92.3	Very high	128 Å²	128	55.1 Å²	55.1	79%	0.785	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.5	23.8	-179.3	69.3	0	0	0	0	114.3	E137 T138 Q139	E137-T141 PolarHBondContact O-N 2.69Å; T138-T141 PolarHBondContact O-N 3.42Å; Q139-T141 VanDerWaalsContact C-N 3.26Å
142	I	95.6	Very high	92.1	Very high	84 Å²	84	60.1 Å²	60.1	43%	0.431	34%	0.339	S	S	.	.			trans	-67.7	-45.6	174.3	-65.6	168.9	0	0	0	110.3	E137 T140 Y144	E137-I142 PolarHBondContact O-N 3.22Å; E137-I142 VanDerWaalsContact O-N 3.13Å; T140-I142 PolarHBondContact O-N 3.24Å; T140-I142 VanDerWaalsContact OG1-CD1 3.25Å; T140-I142 WeakPolarHBondContact OG1-CD1 3.48Å; T140-I142 VanDerWaalsContact OG1-CG1 3.29Å; T140-I142 WeakPolarHBondContact OG1-CG1 3.45Å; I142-Y144 HydrophobicContact CG2-CD1 3.75Å; I142-Y144 HydrophobicContact CG2-CD2 4.19Å; I142-Y144 HydrophobicContact CG2-CE1 3.37Å; I142-Y144 HydrophobicContact CG2-CE2 3.85Å; I142-Y144 HydrophobicContact CG2-CG 4.13Å; I142-Y144 VanDerWaalsContact CG2-CZ 3.42Å
143	G	89.2	Confident	91.8	Very high	52 Å²	52	58.3 Å²	58.3	54%	0.536	33%	0.332	S	S	.	.			trans	49	63.7	173.5	0	0	0	0	0	115.1	E137 G145	E137-G143 PolarHBondContact O-N 3.45Å; G143-G145 PolarHBondContact O-N 2.92Å
144	Y	89.6	Confident	91.7	Very high	167 Å²	167	60 Å²	60	66%	0.655	35%	0.347	S	S	*	.			trans	-59	-21	-179.4	-65.2	-58	0	0	0	113.7	E137 I142 A146	E137-Y144 VanDerWaalsContact CD-CD2 3.47Å; E137-Y144 HydrophobicContact CG-CD2 3.61Å; E137-Y144 HydrophobicContact CG-CE2 4Å; I142-Y144 HydrophobicContact CG2-CD1 3.75Å; I142-Y144 HydrophobicContact CG2-CD2 4.19Å; I142-Y144 HydrophobicContact CG2-CE1 3.37Å; I142-Y144 HydrophobicContact CG2-CE2 3.85Å; I142-Y144 HydrophobicContact CG2-CG 4.13Å; I142-Y144 VanDerWaalsContact CG2-CZ 3.42Å; Y144-A146 VanDerWaalsContact C-N 3.28Å; Y144-A146 PolarHBondContact O-N 2.99Å
145	G	85.8	Confident	91.5	Very high	47 Å²	47	62.4 Å²	62.4	49%	0.485	37%	0.368	S	S	.	.	S	Bend	trans	82.6	-2.7	174.2	0	0	0	0	0	115	G143 R147 C148	G143-G145 PolarHBondContact O-N 2.92Å; G145-R147 VanDerWaalsContact C-N 3.34Å; G145-C148 PolarHBondContact O-SG 3.39Å
146	A	86.9	Confident	91.3	Very high	62 Å²	62	62.4 Å²	62.4	51%	0.512	37%	0.368	S	S	.	.	S	Bend	trans	-75	-26.3	171.2	0	0	0	0	0	112.5	Y144	Y144-A146 VanDerWaalsContact C-N 3.28Å; Y144-A146 PolarHBondContact O-N 2.99Å
147	R	90	Very high	91.2	Very high	56 Å²	56	63.7 Å²	63.7	21%	0.211	38%	0.377	C	S	.	.	S	Bend	trans	-118.9	114.2	175.9	-62.3	173.7	-171.7	89.8	9.7	107.7	T123 Q124 F134 E137 G145	T123-R147 WeakPolarHBondContact O-CA 3.43Å; Q124-R147 HydrophobicContact CB-CG 4.17Å; F134-R147 HydrophobicContact CB-CB 4.47Å; F134-R147 HydrophobicContact CD2-CB 3.68Å; F134-R147 HydrophobicContact CE2-CB 4.42Å; F134-R147 HydrophobicContact CG-CB 4.46Å; E137-R147 IonicContact OE1-CZ 3.02Å; E137-R147 IonicContact OE1-NH1 2.62Å; E137-R147 PolarHBondContact OE1-NH1 3.36Å; G145-R147 VanDerWaalsContact C-N 3.34Å
148	C	90.3	Very high	91.2	Very high	58 Å²	58	70 Å²	70	39%	0.392	41%	0.405	S	S	.	.			trans	-132	142.3	-175.4	-68.5	0	0	0	0	110.1	V122 T123 G145	V122-C148 WeakPolarHBondContact CA-O 3.17Å; T123-C148 PolarHBondContact N-O 2.88Å; T123-C148 PolarHBondContact OG1-N 3.05Å; T123-C148 PolarHBondContact OG1-O 3.14Å; G145-C148 PolarHBondContact O-SG 3.39Å
149	V	92.6	Very high	91.2	Very high	55 Å²	55	70.5 Å²	70.5	33%	0.333	41%	0.406	S	S	.	.	B	Isolated β-bridge	trans	-73.1	139.5	172	64.9	0	0	0	0	109.9	F134 A156 V157 V160	F134-V149 HydrophobicContact CZ-CB 4.4Å; V149-A156 HydrophobicContact CG2-CB 3.98Å; V149-V157 HydrophobicContact CG2-CG2 4.13Å; V149-V160 HydrophobicContact CB-CG2 4.35Å; V149-V160 HydrophobicContact CG1-CG2 4.43Å; V149-V160 HydrophobicContact CG2-CG2 4.4Å
150	T	89.4	Confident	91.2	Very high	29 Å²	29	71.2 Å²	71.2	18%	0.178	41%	0.411	C	S	.	.			trans	-103	168	175.3	65.8	0	0	0	0	110.7	V119 P120 C121 T123 E152	V119-T150 HydrophobicContact CG1-CG2 4.09Å; P120-T150 WeakPolarHBondContact O-CB 3.26Å; P120-T150 WeakPolarHBondContact O-CG2 3.29Å; P120-T150 PolarHBondContact O-OG1 2.99Å; C121-T150 WeakPolarHBondContact CA-OG1 3.3Å; C121-T150 PolarHBondContact O-N 2.99Å; C121-T150 PolarHBondContact O-OG1 3.25Å; C121-T150 VanDerWaalsContact O-OG1 3.13Å; T123-T150 HydrophobicContact CG2-CG2 4.15Å; T150-E152 VanDerWaalsContact C-N 3.31Å
151	E	88	Confident	91.3	Very high	177 Å²	177	72.7 Å²	72.7	83%	0.827	42%	0.42	S	S	*	.	S	Bend	trans	-80.8	-8.3	-179.8	60.4	-168.3	175.8	0	0	114.3	C153	E151-C153 VanDerWaalsContact C-N 3.33Å; E151-C153 PolarHBondContact O-N 3.26Å
152	E	86.7	Confident	91.3	Very high	104 Å²	104	70.7 Å²	70.7	49%	0.486	40%	0.4	S	S	.	.	S	Bend	trans	-63.7	-35.6	-176.5	-64.9	-62.8	155.6	0	0	113.4	V119 T150 P154	V119-E152 HydrophobicContact CB-CG 3.7Å; V119-E152 HydrophobicContact CG1-CG 3.46Å; V119-E152 VanDerWaalsContact CG1-CG 3.46Å; T150-E152 VanDerWaalsContact C-N 3.31Å; E152-P154 VanDerWaalsContact O-CD 3.29Å; E152-P154 WeakPolarHBondContact O-CD 3.35Å
153	C	89.1	Confident	91.4	Very high	10 Å²	10	66.7 Å²	66.7	7%	0.068	38%	0.38	C	S	.	.			trans	-115.1	96.4	-171.3	-55.9	0	0	0	0	111.1	C121 E151 A155 A156 V157	C121-C153 WeakPolarHBondContact CA-SG 3.38Å; C121-C153 HydrophobicContact CB-CB 3.59Å; C121-C153 WeakPolarHBondContact CB-SG 3.47Å; C121-C153 WeakPolarHBondContact SG-CB 2.91Å; C121-C153 CovalentContact SG-SG 2.03Å; C121-C153 PolarHBondContact SG-SG 2.83Å; E151-C153 VanDerWaalsContact C-N 3.33Å; E151-C153 PolarHBondContact O-N 3.26Å; C153-A155 PolarHBondContact O-N 3.36Å; C153-A155 VanDerWaalsContact O-N 3.12Å; C153-A156 HydrophobicContact CB-CB 3.98Å; C153-A156 WeakPolarHBondContact O-CB 3.24Å; C153-A156 PolarHBondContact O-N 3.28Å; C153-V157 PolarHBondContact O-N 2.92Å
154	P	91.8	Very high	91.7	Very high	102 Å²	102	66.7 Å²	66.7	66%	0.662	37%	0.371	S	S	*	.	H	α-helix	trans	-56.7	-31.9	177.8	-26.5	33.8	0	0	0	113.4	E152 V157 F158	E152-P154 VanDerWaalsContact O-CD 3.29Å; E152-P154 WeakPolarHBondContact O-CD 3.35Å; P154-V157 PolarHBondContact O-N 3.34Å; P154-F158 WeakPolarHBondContact O-CB 3.5Å; P154-F158 PolarHBondContact O-N 2.91Å
155	A	91.6	Very high	92	Very high	57 Å²	57	63.3 Å²	63.3	47%	0.471	36%	0.364	S	S	.	.	H	α-helix	trans	-63.2	-40.3	175.8	0	0	0	0	0	112.4	C153 F158 M159	C153-A155 PolarHBondContact O-N 3.36Å; C153-A155 VanDerWaalsContact O-N 3.12Å; A155-F158 PolarHBondContact O-N 3.1Å; A155-M159 WeakPolarHBondContact O-CB 3.28Å; A155-M159 VanDerWaalsContact O-CG 3.26Å; A155-M159 WeakPolarHBondContact O-CG 3.45Å; A155-M159 PolarHBondContact O-N 2.89Å
156	A	91.5	Very high	92.5	Very high	0 Å²	0	64 Å²	64	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-67.8	-42.6	177.3	0	0	0	0	0	111	I104 C121 V149 C153 M159 V160	I104-A156 HydrophobicContact CG2-CB 4.36Å; C121-A156 HydrophobicContact CB-CB 4.24Å; V149-A156 HydrophobicContact CG2-CB 3.98Å; C153-A156 HydrophobicContact CB-CB 3.98Å; C153-A156 WeakPolarHBondContact O-CB 3.24Å; C153-A156 PolarHBondContact O-N 3.28Å; A156-M159 PolarHBondContact O-N 3.42Å; A156-V160 WeakPolarHBondContact O-CG2 3.29Å; A156-V160 PolarHBondContact O-N 3.32Å
157	V	93.7	Very high	92.9	Very high	62 Å²	62	61.1 Å²	61.1	38%	0.376	33%	0.332	S	S	.	.	H	α-helix	trans	-60.2	-47.6	175.2	178.7	0	0	0	0	110.9	V149 C153 P154 M159 V160 V161	V149-V157 HydrophobicContact CG2-CG2 4.13Å; C153-V157 PolarHBondContact O-N 2.92Å; P154-V157 PolarHBondContact O-N 3.34Å; V157-M159 VanDerWaalsContact C-N 3.34Å; V157-M159 PolarHBondContact O-N 2.96Å; V157-V160 PolarHBondContact O-N 2.87Å; V157-V161 WeakPolarHBondContact O-CG2 3.25Å; V157-V161 PolarHBondContact O-N 3.23Å
158	F	94.8	Very high	93.2	Very high	136 Å²	136	62.6 Å²	62.6	60%	0.596	35%	0.35	S	S	*	.	H	α-helix	trans	-59.6	-43.4	175.9	176.4	-96.4	0	0	0	112.1	P154 A155 V160 V161 F162	P154-F158 WeakPolarHBondContact O-CB 3.5Å; P154-F158 PolarHBondContact O-N 2.91Å; A155-F158 PolarHBondContact O-N 3.1Å; F158-V160 VanDerWaalsContact C-N 3.35Å; F158-V160 PolarHBondContact O-N 2.93Å; F158-V161 PolarHBondContact O-N 3.36Å; F158-F162 HydrophobicContact CE1-CB 4.43Å; F158-F162 WeakPolarHBondContact O-CB 3.25Å; F158-F162 PolarHBondContact O-N 3.25Å
159	M	94.7	Very high	93.5	Very high	36 Å²	36	63.5 Å²	63.5	18%	0.177	35%	0.35	C	S	.	.	H	α-helix	trans	-63.5	-38	177.8	-75.3	-58.1	-62.4	0	0	112.6	F97 A100 F101 I104 A155 A156 V157 F162 Q163	F97-M159 HydrophobicContact CD1-CE 3.7Å; F97-M159 HydrophobicContact CE1-CE 3.78Å; A100-M159 HydrophobicContact CB-CE 3.63Å; F101-M159 HydrophobicContact CE1-CB 3.83Å; F101-M159 HydrophobicContact CZ-CB 4.01Å; I104-M159 HydrophobicContact CD1-CB 4.38Å; I104-M159 HydrophobicContact CD1-CG 3.71Å; A155-M159 WeakPolarHBondContact O-CB 3.28Å; A155-M159 VanDerWaalsContact O-CG 3.26Å; A155-M159 WeakPolarHBondContact O-CG 3.45Å; A155-M159 PolarHBondContact O-N 2.89Å; A156-M159 PolarHBondContact O-N 3.42Å; V157-M159 VanDerWaalsContact C-N 3.34Å; V157-M159 PolarHBondContact O-N 2.96Å; M159-F162 PolarHBondContact O-N 3.21Å; M159-Q163 WeakPolarHBondContact O-CB 3.31Å; M159-Q163 PolarHBondContact O-N 2.84Å
160	V	95.4	Very high	93.6	Very high	26 Å²	26	61.9 Å²	61.9	16%	0.158	34%	0.339	C	S	.	.	H	α-helix	trans	-63.2	-44.3	173.9	168.9	0	0	0	0	111.1	F101 F134 T138 V149 A156 V157 F158 Q163 S164	F101-V160 HydrophobicContact CE1-CG2 3.91Å; F101-V160 HydrophobicContact CZ-CG2 3.77Å; F134-V160 HydrophobicContact CE1-CG2 4.38Å; F134-V160 HydrophobicContact CZ-CG2 4.26Å; T138-V160 HydrophobicContact CG2-CG1 3.91Å; T138-V160 HydrophobicContact CG2-CG2 4.4Å; V149-V160 HydrophobicContact CB-CG2 4.35Å; V149-V160 HydrophobicContact CG1-CG2 4.43Å; V149-V160 HydrophobicContact CG2-CG2 4.4Å; A156-V160 WeakPolarHBondContact O-CG2 3.29Å; A156-V160 PolarHBondContact O-N 3.32Å; V157-V160 PolarHBondContact O-N 2.87Å; F158-V160 VanDerWaalsContact C-N 3.35Å; F158-V160 PolarHBondContact O-N 2.93Å; V160-Q163 PolarHBondContact O-N 3.44Å; V160-S164 WeakPolarHBondContact O-CB 3.43Å; V160-S164 PolarHBondContact O-N 2.76Å; V160-S164 PolarHBondContact O-OG 3.33Å
161	V	95.8	Very high	93.8	Very high	79 Å²	79	63.3 Å²	63.3	48%	0.479	35%	0.346	S	S	.	.	H	α-helix	trans	-62.3	-49	176.6	173.2	0	0	0	0	110.6	V157 F158 Q163 S164 I165	V157-V161 WeakPolarHBondContact O-CG2 3.25Å; V157-V161 PolarHBondContact O-N 3.23Å; F158-V161 PolarHBondContact O-N 3.36Å; V161-Q163 PolarHBondContact O-N 3.23Å; V161-S164 PolarHBondContact O-N 2.78Å; V161-I165 HydrophobicContact CG1-CD1 4.06Å; V161-I165 WeakPolarHBondContact O-CG1 3.5Å; V161-I165 PolarHBondContact O-N 3Å
162	F	95.8	Very high	94.2	Very high	86 Å²	86	57.9 Å²	57.9	38%	0.377	33%	0.331	S	S	.	.	H	α-helix	trans	-62.5	-42.1	179.3	-179.9	-112.9	0	0	0	112	F97 F158 M159 S164 I165 M166	F97-F162 AromaticContact CE1-CD1 3.68Å; F97-F162 HydrophobicContact CE1-CD1 3.68Å; F97-F162 HydrophobicContact CE1-CE1 4.07Å; F97-F162 AromaticContact CZ-CD1 3.81Å; F97-F162 HydrophobicContact CZ-CD1 3.81Å; F97-F162 AromaticContact CZ-CE1 3.85Å; F97-F162 HydrophobicContact CZ-CE1 3.85Å; F158-F162 HydrophobicContact CE1-CB 4.43Å; F158-F162 WeakPolarHBondContact O-CB 3.25Å; F158-F162 PolarHBondContact O-N 3.25Å; M159-F162 PolarHBondContact O-N 3.21Å; F162-S164 VanDerWaalsContact C-N 3.34Å; F162-S164 PolarHBondContact O-N 3.38Å; F162-I165 PolarHBondContact O-N 3.02Å; F162-M166 HydrophobicContact CE2-CE 4.16Å; F162-M166 HydrophobicContact CZ-CE 3.78Å; F162-M166 WeakPolarHBondContact O-CB 3.43Å; F162-M166 PolarHBondContact O-N 2.98Å
163	Q	96.6	Very high	94.4	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-62	-41.3	175.3	-173.2	-179.1	18.9	0	0	112	F97 S135 T138 Q139 M159 V160 V161 M166 G167	F97-Q163 HydrophobicContact CB-CG 4.29Å; F97-Q163 HydrophobicContact CD1-CB 3.68Å; F97-Q163 HydrophobicContact CD1-CG 3.77Å; F97-Q163 HydrophobicContact CD2-CB 4.42Å; F97-Q163 HydrophobicContact CD2-CG 3.76Å; F97-Q163 HydrophobicContact CE1-CB 3.54Å; F97-Q163 HydrophobicContact CE1-CG 3.96Å; F97-Q163 HydrophobicContact CE2-CB 4.34Å; F97-Q163 HydrophobicContact CE2-CG 3.97Å; F97-Q163 HydrophobicContact CG-CB 4.14Å; F97-Q163 HydrophobicContact CG-CG 3.68Å; F97-Q163 HydrophobicContact CZ-CB 3.92Å; F97-Q163 HydrophobicContact CZ-CG 4.08Å; S135-Q163 PolarHBondContact O-NE2 2.88Å; S135-Q163 PolarHBondContact OG-NE2 3.48Å; T138-Q163 VanDerWaalsContact CG2-OE1 3.27Å; Q139-Q163 HydrophobicContact CB-CG 4.13Å; Q139-Q163 HydrophobicContact CG-CG 4.33Å; M159-Q163 WeakPolarHBondContact O-CB 3.31Å; M159-Q163 PolarHBondContact O-N 2.84Å; V160-Q163 PolarHBondContact O-N 3.44Å; V161-Q163 PolarHBondContact O-N 3.23Å; Q163-M166 PolarHBondContact O-N 2.98Å; Q163-G167 PolarHBondContact O-N 2.9Å
164	S	95.6	Very high	94.6	Very high	51 Å²	51	61.4 Å²	61.4	36%	0.357	35%	0.345	S	S	.	.	H	α-helix	trans	-63.3	-44.4	178.5	-58	0	0	0	0	111.2	V160 V161 F162 G167 C168	V160-S164 WeakPolarHBondContact O-CB 3.43Å; V160-S164 PolarHBondContact O-N 2.76Å; V160-S164 PolarHBondContact O-OG 3.33Å; V161-S164 PolarHBondContact O-N 2.78Å; F162-S164 VanDerWaalsContact C-N 3.34Å; F162-S164 PolarHBondContact O-N 3.38Å; S164-G167 PolarHBondContact O-N 2.82Å; S164-C168 PolarHBondContact O-N 2.76Å; S164-C168 VanDerWaalsContact O-N 3.11Å; S164-C168 PolarHBondContact O-SG 3.39Å; S164-C168 VanDerWaalsContact O-SG 3.35Å
165	I	96.6	Very high	94.8	Very high	96 Å²	96	61.2 Å²	61.2	49%	0.492	34%	0.338	S	S	.	.	H	α-helix	trans	-62.7	-47	176.4	-65.8	167.9	0	0	0	110.6	V161 F162 G167 C168 I169	V161-I165 HydrophobicContact CG1-CD1 4.06Å; V161-I165 WeakPolarHBondContact O-CG1 3.5Å; V161-I165 PolarHBondContact O-N 3Å; F162-I165 PolarHBondContact O-N 3.02Å; I165-G167 PolarHBondContact O-N 2.82Å; I165-C168 PolarHBondContact O-N 2.69Å; I165-I169 HydrophobicContact CG2-CD1 3.96Å; I165-I169 WeakPolarHBondContact O-CG1 3.31Å; I165-I169 PolarHBondContact O-N 2.96Å; I165-I169 VanDerWaalsContact O-N 3.1Å
166	M	95.5	Very high	94.8	Very high	61 Å²	61	60.2 Å²	60.2	30%	0.3	33%	0.332	S	S	.	.	H	α-helix	trans	-64.2	-39.4	179.8	-170	59.8	64.9	0	0	112.3	F97 F162 Q163 I169 I170	F97-M166 HydrophobicContact CE2-CB 4.3Å; F97-M166 HydrophobicContact CE2-CG 4.26Å; F97-M166 HydrophobicContact CZ-CB 4.16Å; F97-M166 HydrophobicContact CZ-CG 4.42Å; F162-M166 HydrophobicContact CE2-CE 4.16Å; F162-M166 HydrophobicContact CZ-CE 3.78Å; F162-M166 WeakPolarHBondContact O-CB 3.43Å; F162-M166 PolarHBondContact O-N 2.98Å; Q163-M166 PolarHBondContact O-N 2.98Å; M166-I169 PolarHBondContact O-N 3.1Å; M166-I170 HydrophobicContact CG-CD1 4.12Å; M166-I170 WeakPolarHBondContact O-CG1 3.35Å; M166-I170 PolarHBondContact O-N 3.35Å
167	G	95.8	Very high	94.9	Very high	2 Å²	2	60.4 Å²	60.4	2%	0.021	33%	0.334	C	S	.	.	H	α-helix	trans	-57.6	-51.3	174.6	0	0	0	0	0	111.8	Q163 S164 I165 I169 I170 D171	Q163-G167 PolarHBondContact O-N 2.9Å; S164-G167 PolarHBondContact O-N 2.82Å; I165-G167 PolarHBondContact O-N 2.82Å; G167-I169 VanDerWaalsContact C-N 3.28Å; G167-I169 PolarHBondContact O-N 3.24Å; G167-I170 PolarHBondContact O-N 3.42Å; G167-D171 PolarHBondContact O-N 2.8Å
168	C	96.3	Very high	94.8	Very high	88 Å²	88	59.3 Å²	59.3	60%	0.595	33%	0.326	S	S	*	.	H	α-helix	trans	-58.4	-38.3	176.7	-69.7	0	0	0	0	112.9	S164 I165 A172	S164-C168 PolarHBondContact O-N 2.76Å; S164-C168 VanDerWaalsContact O-N 3.11Å; S164-C168 PolarHBondContact O-SG 3.39Å; S164-C168 VanDerWaalsContact O-SG 3.35Å; I165-C168 PolarHBondContact O-N 2.69Å; C168-A172 WeakPolarHBondContact O-CB 3.03Å; C168-A172 PolarHBondContact O-N 3.02Å
169	I	95.8	Very high	94.7	Very high	76 Å²	76	58.9 Å²	58.9	39%	0.39	33%	0.327	S	S	.	.	H	α-helix	trans	-64.6	-48.6	176.8	-69.2	167.3	0	0	0	110.4	I165 M166 G167 D171 A172 F173	I165-I169 HydrophobicContact CG2-CD1 3.96Å; I165-I169 WeakPolarHBondContact O-CG1 3.31Å; I165-I169 PolarHBondContact O-N 2.96Å; I165-I169 VanDerWaalsContact O-N 3.1Å; M166-I169 PolarHBondContact O-N 3.1Å; G167-I169 VanDerWaalsContact C-N 3.28Å; G167-I169 PolarHBondContact O-N 3.24Å; I169-D171 VanDerWaalsContact C-N 3.33Å; I169-D171 PolarHBondContact O-N 3.05Å; I169-A172 PolarHBondContact O-N 3.08Å; I169-F173 HydrophobicContact CG2-CD2 3.74Å; I169-F173 HydrophobicContact CG2-CE2 3.7Å; I169-F173 VanDerWaalsContact O-CD2 3.25Å; I169-F173 WeakPolarHBondContact O-CD2 3.29Å; I169-F173 PolarHBondContact O-N 3.08Å
170	I	94.7	Very high	94.4	Very high	21 Å²	21	58.6 Å²	58.6	11%	0.108	33%	0.331	C	S	.	.	H	α-helix	trans	-60.5	-44.1	179.2	-66.4	167.4	0	0	0	110.6	V89 F90 M166 G167 F173 M174	V89-I170 HydrophobicContact CG1-CD1 4.26Å; V89-I170 HydrophobicContact CG1-CG1 4.4Å; V89-I170 HydrophobicContact CG1-CG2 3.98Å; F90-I170 HydrophobicContact CD1-CG2 4.15Å; F90-I170 HydrophobicContact CE1-CG2 3.65Å; F90-I170 HydrophobicContact CE2-CG2 4.33Å; F90-I170 HydrophobicContact CZ-CG2 3.74Å; M166-I170 HydrophobicContact CG-CD1 4.12Å; M166-I170 WeakPolarHBondContact O-CG1 3.35Å; M166-I170 PolarHBondContact O-N 3.35Å; G167-I170 PolarHBondContact O-N 3.42Å; I170-F173 PolarHBondContact O-N 2.65Å; I170-M174 PolarHBondContact O-N 3.22Å
171	D	94.9	Very high	94.2	Very high	60 Å²	60	58.6 Å²	58.6	32%	0.321	33%	0.328	S	S	.	.	H	α-helix	trans	-62.6	-44.4	178	-74.1	-18.7	0	0	0	112	F90 G167 I169 F173 M174 I175	F90-D171 VanDerWaalsContact CE1-OD1 3.31Å; F90-D171 WeakPolarHBondContact CE1-OD1 3.42Å; F90-D171 WeakPolarHBondContact CZ-OD1 3.47Å; G167-D171 PolarHBondContact O-N 2.8Å; I169-D171 VanDerWaalsContact C-N 3.33Å; I169-D171 PolarHBondContact O-N 3.05Å; D171-F173 VanDerWaalsContact C-N 3.35Å; D171-F173 PolarHBondContact O-N 3Å; D171-M174 PolarHBondContact O-N 2.7Å; D171-I175 WeakPolarHBondContact O-CG1 3.02Å; D171-I175 PolarHBondContact O-N 3.14Å
172	A	94.9	Very high	93.9	Very high	63 Å²	63	61.3 Å²	61.3	52%	0.521	34%	0.338	S	S	.	.	H	α-helix	trans	-60.2	-43.5	176.6	0	0	0	0	0	111.8	C168 I169 G176	C168-A172 WeakPolarHBondContact O-CB 3.03Å; C168-A172 PolarHBondContact O-N 3.02Å; I169-A172 PolarHBondContact O-N 3.08Å; A172-G176 PolarHBondContact O-N 3.44Å
173	F	92.5	Very high	93.4	Very high	141 Å²	141	59 Å²	59	62%	0.618	34%	0.335	S	S	*	.	H	α-helix	trans	-63.8	-42	174.9	-87.1	-70.9	0	0	0	112.4	I169 I170 D171 G176 A177	I169-F173 HydrophobicContact CG2-CD2 3.74Å; I169-F173 HydrophobicContact CG2-CE2 3.7Å; I169-F173 VanDerWaalsContact O-CD2 3.25Å; I169-F173 WeakPolarHBondContact O-CD2 3.29Å; I169-F173 PolarHBondContact O-N 3.08Å; I170-F173 PolarHBondContact O-N 2.65Å; D171-F173 VanDerWaalsContact C-N 3.35Å; D171-F173 PolarHBondContact O-N 3Å; F173-G176 PolarHBondContact O-N 3.11Å; F173-A177 VanDerWaalsContact O-CB 3.31Å; F173-A177 WeakPolarHBondContact O-CB 3.37Å; F173-A177 PolarHBondContact O-N 3.43Å
174	M	93.4	Very high	92.7	Very high	47 Å²	47	63.2 Å²	63.2	23%	0.232	35%	0.35	C	S	.	.	H	α-helix	trans	-61.4	-51.2	177.5	179.5	-175.9	60.5	0	0	111.2	F86 F90 I170 D171 G176 A177 I178	F86-M174 HydrophobicContact CD1-CB 3.88Å; F86-M174 HydrophobicContact CD1-CG 4.06Å; F86-M174 HydrophobicContact CD2-CG 4.29Å; F86-M174 HydrophobicContact CE1-CB 3.9Å; F86-M174 HydrophobicContact CE1-CG 4.35Å; F86-M174 HydrophobicContact CG-CB 4.4Å; F86-M174 HydrophobicContact CG-CG 4.05Å; F86-M174 HydrophobicContact CZ-CB 4.41Å; F90-M174 HydrophobicContact CE2-CE 4.22Å; F90-M174 HydrophobicContact CE2-SD 3.63Å; F90-M174 HydrophobicContact CZ-CE 4.09Å; F90-M174 HydrophobicContact CZ-SD 4.08Å; I170-M174 PolarHBondContact O-N 3.22Å; D171-M174 PolarHBondContact O-N 2.7Å; M174-G176 VanDerWaalsContact C-N 3.33Å; M174-G176 PolarHBondContact O-N 2.86Å; M174-A177 PolarHBondContact O-N 2.95Å; M174-I178 HydrophobicContact CG-CD1 3.62Å; M174-I178 HydrophobicContact CG-CG1 4.39Å; M174-I178 WeakPolarHBondContact O-CB 3.23Å; M174-I178 VanDerWaalsContact O-CG1 3.25Å; M174-I178 WeakPolarHBondContact O-CG1 3.29Å; M174-I178 PolarHBondContact O-N 2.78Å; M174-I178 HydrophobicContact SD-CD1 4.28Å
175	I	94.1	Very high	91.8	Very high	98 Å²	98	61.6 Å²	61.6	50%	0.503	34%	0.339	S	S	.	.	H	α-helix	trans	-61.6	-44.8	179.9	-65.5	171.2	0	0	0	110	D171 I178 M179	D171-I175 WeakPolarHBondContact O-CG1 3.02Å; D171-I175 PolarHBondContact O-N 3.14Å; I175-I178 PolarHBondContact O-N 2.77Å; I175-M179 VanDerWaalsContact O-CB 3.26Å; I175-M179 WeakPolarHBondContact O-CB 3.43Å; I175-M179 PolarHBondContact O-N 2.86Å
176	G	93.4	Very high	90.6	Very high	35 Å²	35	65 Å²	65	36%	0.361	35%	0.35	S	S	.	.	H	α-helix	trans	-59.7	-46.6	177.9	0	0	0	0	0	112.9	A172 F173 M174 M179 A180	A172-G176 PolarHBondContact O-N 3.44Å; F173-G176 PolarHBondContact O-N 3.11Å; M174-G176 VanDerWaalsContact C-N 3.33Å; M174-G176 PolarHBondContact O-N 2.86Å; G176-M179 PolarHBondContact O-N 3.41Å; G176-A180 VanDerWaalsContact O-CB 3.27Å; G176-A180 WeakPolarHBondContact O-CB 3.21Å; G176-A180 PolarHBondContact O-N 2.79Å
177	A	92.3	Very high	89.6	Confident	4 Å²	4	68.6 Å²	68.6	3%	0.033	36%	0.364	C	S	.	.	H	α-helix	trans	-67.1	-42	178.5	0	0	0	0	0	112.5	F86 F173 M174 K181	F86-A177 HydrophobicContact CE2-CB 3.97Å; F86-A177 HydrophobicContact CZ-CB 3.6Å; F173-A177 VanDerWaalsContact O-CB 3.31Å; F173-A177 WeakPolarHBondContact O-CB 3.37Å; F173-A177 PolarHBondContact O-N 3.43Å; M174-A177 PolarHBondContact O-N 2.95Å; A177-K181 VanDerWaalsContact O-CB 3.3Å; A177-K181 WeakPolarHBondContact O-CB 3.35Å; A177-K181 PolarHBondContact O-N 3.15Å
178	I	92.6	Very high	88.8	Confident	39 Å²	39	70.6 Å²	70.6	20%	0.2	37%	0.371	C	S	.	.	H	α-helix	trans	-62.9	-47.7	176.5	-69.7	170.4	0	0	0	110.1	W79 M82 F83 M174 I175 K181 M182	W79-I178 HydrophobicContact CZ3-CG2 4.49Å; M82-I178 HydrophobicContact CE-CG1 3.66Å; F83-I178 HydrophobicContact CE1-CD1 4.39Å; M174-I178 HydrophobicContact CG-CD1 3.62Å; M174-I178 HydrophobicContact CG-CG1 4.39Å; M174-I178 WeakPolarHBondContact O-CB 3.23Å; M174-I178 VanDerWaalsContact O-CG1 3.25Å; M174-I178 WeakPolarHBondContact O-CG1 3.29Å; M174-I178 PolarHBondContact O-N 2.78Å; M174-I178 HydrophobicContact SD-CD1 4.28Å; I175-I178 PolarHBondContact O-N 2.77Å; I178-K181 PolarHBondContact O-N 3.42Å; I178-M182 HydrophobicContact CG2-CG 4.31Å; I178-M182 HydrophobicContact CG2-SD 3.87Å; I178-M182 WeakPolarHBondContact O-CB 3.22Å; I178-M182 VanDerWaalsContact O-CG 3.29Å; I178-M182 WeakPolarHBondContact O-CG 3.32Å; I178-M182 PolarHBondContact O-N 3.32Å
179	M	91.4	Very high	88	Confident	127 Å²	127	67.7 Å²	67.7	63%	0.626	35%	0.353	S	S	*	.	H	α-helix	trans	-61.5	-47.2	179.1	-173.8	-173.7	-69.3	0	0	111.2	I175 G176 K181 M182 A183	I175-M179 VanDerWaalsContact O-CB 3.26Å; I175-M179 WeakPolarHBondContact O-CB 3.43Å; I175-M179 PolarHBondContact O-N 2.86Å; G176-M179 PolarHBondContact O-N 3.41Å; M179-K181 VanDerWaalsContact C-N 3.3Å; M179-K181 PolarHBondContact O-N 3.38Å; M179-M182 PolarHBondContact O-N 2.89Å; M179-A183 WeakPolarHBondContact O-CB 3.36Å; M179-A183 PolarHBondContact O-N 3.07Å
180	A	90.2	Very high	87.4	Confident	31 Å²	31	70.2 Å²	70.2	26%	0.256	36%	0.363	S	S	.	.	H	α-helix	trans	-59.1	-41.7	176.3	0	0	0	0	0	111.7	F71 V75 G176 A183 R184	F71-A180 HydrophobicContact CZ-CB 3.96Å; V75-A180 HydrophobicContact CG1-CB 4.48Å; V75-A180 HydrophobicContact CG2-CB 4.25Å; G176-A180 VanDerWaalsContact O-CB 3.27Å; G176-A180 WeakPolarHBondContact O-CB 3.21Å; G176-A180 PolarHBondContact O-N 2.79Å; A180-A183 PolarHBondContact O-N 3.16Å; A180-R184 WeakPolarHBondContact O-CG 3.35Å; A180-R184 PolarHBondContact O-N 3.41Å
181	K	90.8	Very high	87	Confident	25 Å²	25	71 Å²	71	11%	0.109	37%	0.369	C	S	.	.	H	α-helix	trans	-67.9	-39.2	177.4	-169.2	172.6	-174.6	62.7	0	112.8	V75 I77 W79 M82 A177 I178 M179 A183 R184	V75-K181 HydrophobicContact CG1-CB 3.92Å; V75-K181 HydrophobicContact CG1-CG 4.33Å; V75-K181 PolarHBondContact O-NZ 3.42Å; I77-K181 VanDerWaalsContact O-CE 3.3Å; I77-K181 WeakPolarHBondContact O-CE 3.37Å; I77-K181 PolarHBondContact O-NZ 3.04Å; W79-K181 HydrophobicContact CD2-CD 3.95Å; W79-K181 HydrophobicContact CE3-CD 4.07Å; W79-K181 HydrophobicContact CH2-CB 4.2Å; W79-K181 HydrophobicContact CH2-CD 3.97Å; W79-K181 HydrophobicContact CH2-CG 4.04Å; W79-K181 HydrophobicContact CZ2-CB 4.3Å; W79-K181 HydrophobicContact CZ2-CD 3.84Å; W79-K181 HydrophobicContact CZ2-CG 3.73Å; W79-K181 HydrophobicContact CZ3-CD 4.11Å; M82-K181 HydrophobicContact CE-CD 3.93Å; M82-K181 HydrophobicContact SD-CB 4.37Å; M82-K181 HydrophobicContact SD-CD 3.33Å; M82-K181 WeakPolarHBondContact SD-CD 3.38Å; M82-K181 HydrophobicContact SD-CG 4.49Å; A177-K181 VanDerWaalsContact O-CB 3.3Å; A177-K181 WeakPolarHBondContact O-CB 3.35Å; A177-K181 PolarHBondContact O-N 3.15Å; I178-K181 PolarHBondContact O-N 3.42Å; M179-K181 VanDerWaalsContact C-N 3.3Å; M179-K181 PolarHBondContact O-N 3.38Å; K181-A183 VanDerWaalsContact C-N 3.33Å; K181-R184 PolarHBondContact O-N 3.35Å
182	M	88	Confident	86.9	Confident	137 Å²	137	68.8 Å²	68.8	68%	0.675	36%	0.357	S	S	*	.	H	α-helix	trans	-66.1	-36.8	176.5	-74.4	-179.7	58.8	0	0	112	W79 I178 M179 R184	W79-M182 HydrophobicContact CH2-CG 3.72Å; W79-M182 HydrophobicContact CZ2-CG 4.16Å; I178-M182 HydrophobicContact CG2-CG 4.31Å; I178-M182 HydrophobicContact CG2-SD 3.87Å; I178-M182 WeakPolarHBondContact O-CB 3.22Å; I178-M182 VanDerWaalsContact O-CG 3.29Å; I178-M182 WeakPolarHBondContact O-CG 3.32Å; I178-M182 PolarHBondContact O-N 3.32Å; M179-M182 PolarHBondContact O-N 2.89Å; M182-R184 PolarHBondContact O-N 2.58Å
183	A	86.1	Confident	86.8	Confident	38 Å²	38	68 Å²	68	31%	0.314	34%	0.344	S	S	.	.	H	α-helix	trans	-67.9	-21.9	178.8	0	0	0	0	0	113	M179 A180 K181 M306	M179-A183 WeakPolarHBondContact O-CB 3.36Å; M179-A183 PolarHBondContact O-N 3.07Å; A180-A183 PolarHBondContact O-N 3.16Å; K181-A183 VanDerWaalsContact C-N 3.33Å; A183-M306 HydrophobicContact CB-SD 4.02Å
184	R	81.8	Confident	87	Confident	87 Å²	87	62.2 Å²	62.2	33%	0.328	32%	0.319	S	S	.	.			trans	-61.2	125.6	-175.4	-73.3	-162.8	177.5	-155.4	20.8	112.4	V75 D76 A180 K181 M182 K186	V75-R184 HydrophobicContact CG1-CG 4.43Å; D76-R184 IonicContact OD1-CZ 3.82Å; D76-R184 IonicContact OD1-NH1 2.72Å; D76-R184 PolarHBondContact OD1-NH1 3.05Å; D76-R184 IonicContact OD1-NH2 3.89Å; D76-R184 IonicContact OD2-CZ 3.66Å; D76-R184 IonicContact OD2-NH1 3.32Å; D76-R184 PolarHBondContact OD2-NH1 3.16Å; D76-R184 IonicContact OD2-NH2 3.2Å; D76-R184 PolarHBondContact OD2-NH2 2.98Å; A180-R184 WeakPolarHBondContact O-CG 3.35Å; A180-R184 PolarHBondContact O-N 3.41Å; K181-R184 PolarHBondContact O-N 3.35Å; M182-R184 PolarHBondContact O-N 2.58Å; R184-K186 PolarHBondContact O-N 2.68Å
185	P	76.9	Confident	87.2	Confident	17 Å²	17	60.1 Å²	60.1	11%	0.11	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	19.1	-174.8	33.1	-37.2	0	0	0	114.4	K187 R188 V301 M306 T307	P185-K187 PolarHBondContact O-N 2.86Å; P185-R188 HydrophobicContact CB-CB 4.36Å; P185-R188 HydrophobicContact CB-CG 4.28Å; P185-R188 WeakPolarHBondContact O-CA 3.35Å; P185-R188 VanDerWaalsContact O-CB 3.28Å; P185-R188 WeakPolarHBondContact O-CB 3.41Å; P185-R188 PolarHBondContact O-N 3.13Å; P185-V301 HydrophobicContact CB-CG2 3.68Å; P185-M306 HydrophobicContact CG-CB 3.98Å; P185-T307 VanDerWaalsContact CG-O 3.3Å; P185-T307 WeakPolarHBondContact CG-O 3.25Å
186	K	71.8	Confident	87.3	Confident	168 Å²	168	60.5 Å²	60.5	73%	0.73	31%	0.308	S	S	*	.	H	α-helix	trans	-56.5	-32.3	-175.1	-171.9	170.8	-176.4	168.4	0	113.3	R184 R188	R184-K186 PolarHBondContact O-N 2.68Å; K186-R188 VanDerWaalsContact C-N 3.32Å
187	K	74.6	Confident	87.4	Confident	137 Å²	137	61 Å²	61	60%	0.596	30%	0.302	S	S	*	.	H	α-helix	trans	-75.7	-15.9	176.1	-70.3	-55.3	-164.5	175.9	0	114.3	P185 E190	P185-K187 PolarHBondContact O-N 2.86Å; K187-E190 VanDerWaalsContact CD-OE2 3.31Å; K187-E190 WeakPolarHBondContact CD-OE2 3.24Å; K187-E190 IonicContact NZ-OE1 3.59Å; K187-E190 PolarHBondContact NZ-OE1 3.08Å; K187-E190 IonicContact NZ-OE2 3.72Å; K187-E190 PolarHBondContact NZ-OE2 3.07Å
188	R	79.1	Confident	87.7	Confident	44 Å²	44	60.8 Å²	60.8	17%	0.166	30%	0.301	C	S	.	.	H	α-helix	trans	-76.3	-33.3	176.2	-65.9	-60.3	-163.4	125.9	2.4	112.6	P185 K186 E190 T191 R217 S219 V301	P185-R188 HydrophobicContact CB-CB 4.36Å; P185-R188 HydrophobicContact CB-CG 4.28Å; P185-R188 WeakPolarHBondContact O-CA 3.35Å; P185-R188 VanDerWaalsContact O-CB 3.28Å; P185-R188 WeakPolarHBondContact O-CB 3.41Å; P185-R188 PolarHBondContact O-N 3.13Å; K186-R188 VanDerWaalsContact C-N 3.32Å; R188-E190 PolarHBondContact O-N 2.84Å; R188-T191 PolarHBondContact O-N 3.45Å; R188-T191 PolarHBondContact O-OG1 3.48Å; R188-R217 VanDerWaalsContact NH1-CD 3.32Å; R188-S219 PolarHBondContact NH1-OG 2.89Å; R188-V301 HydrophobicContact CB-CG2 3.95Å; R188-V301 HydrophobicContact CG-CG1 4.08Å; R188-V301 HydrophobicContact CG-CG2 3.81Å
189	A	79.3	Confident	87.9	Confident	27 Å²	27	59 Å²	59	22%	0.223	29%	0.291	C	S	.	.	H	α-helix	trans	-58.7	-31.5	172.5	0	0	0	0	0	112.5	T191 L192 A310	A189-T191 PolarHBondContact O-N 3.45Å; A189-L192 PolarHBondContact O-N 3.29Å; A189-A310 HydrophobicContact CB-CB 4.21Å
190	E	81.9	Confident	88.2	Confident	128 Å²	128	53.1 Å²	53.1	60%	0.598	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-17.9	175.4	-64.1	174.7	-172.6	0	0	113.1	K187 R188	K187-E190 VanDerWaalsContact CD-OE2 3.31Å; K187-E190 WeakPolarHBondContact CD-OE2 3.24Å; K187-E190 IonicContact NZ-OE1 3.59Å; K187-E190 PolarHBondContact NZ-OE1 3.08Å; K187-E190 IonicContact NZ-OE2 3.72Å; K187-E190 PolarHBondContact NZ-OE2 3.07Å; R188-E190 PolarHBondContact O-N 2.84Å
191	T	86.8	Confident	88.5	Confident	38 Å²	38	51.7 Å²	51.7	23%	0.233	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-5.6	178	61.4	0	0	0	0	113.6	R188 A189 L216	R188-T191 PolarHBondContact O-N 3.45Å; R188-T191 PolarHBondContact O-OG1 3.48Å; A189-T191 PolarHBondContact O-N 3.45Å; T191-L216 WeakPolarHBondContact O-CB 3Å; T191-L216 WeakPolarHBondContact O-CG 3.38Å; T191-L216 PolarHBondContact O-N 3.36Å; T191-L216 VanDerWaalsContact O-N 3.08Å
192	L	92.6	Very high	88.7	Confident	13 Å²	13	53 Å²	53	7%	0.068	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	128.7	171.1	-69.2	172.7	0	0	0	108.6	A189 N215 I221 L262 L297 A310	A189-L192 PolarHBondContact O-N 3.29Å; L192-N215 HydrophobicContact CD2-CB 4.28Å; L192-I221 HydrophobicContact CD2-CG1 4.08Å; L192-L262 HydrophobicContact CD2-CD2 4.01Å; L192-L297 HydrophobicContact CB-CD2 4.36Å; L192-L297 HydrophobicContact CD1-CD2 3.84Å; L192-L297 HydrophobicContact CD1-CG 4.32Å; L192-L297 HydrophobicContact CD2-CD2 3.98Å; L192-L297 HydrophobicContact CG-CD2 4.27Å; L192-A310 HydrophobicContact CB-CB 3.92Å; L192-A310 HydrophobicContact CD1-CB 3.74Å; L192-A310 HydrophobicContact CG-CB 4.47Å
193	L	94.1	Very high	89	Confident	47 Å²	47	51.3 Å²	51.3	25%	0.246	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	135.5	-173.8	-171.3	67	0	0	0	110.4	V213 A214 L216 F343	L193-V213 CarbonylContact O-C 3.58Å; L193-V213 WeakPolarHBondContact O-CA 3.45Å; L193-A214 PolarHBondContact N-O 3.43Å; L193-A214 PolarHBondContact O-N 3.41Å; L193-L216 HydrophobicContact CB-CD1 4.27Å; L193-L216 HydrophobicContact CB-CD2 4.4Å; L193-L216 HydrophobicContact CB-CG 4.21Å; L193-L216 HydrophobicContact CD2-CD2 4.13Å; L193-F343 HydrophobicContact CB-CE1 4.43Å; L193-F343 HydrophobicContact CD2-CD1 3.61Å; L193-F343 HydrophobicContact CD2-CE1 3.57Å; L193-F343 HydrophobicContact CD2-CG 4.3Å; L193-F343 HydrophobicContact CD2-CZ 4.24Å; L193-F343 HydrophobicContact CG-CD1 4.2Å; L193-F343 HydrophobicContact CG-CE1 3.65Å; L193-F343 HydrophobicContact CG-CZ 4.2Å
194	F	96.7	Very high	89.3	Confident	20 Å²	20	56.7 Å²	56.7	9%	0.088	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	153.2	171.6	-63.4	-86.4	0	0	0	110.5	R212 V213 I295 L297 A310 T312 H344	F194-R212 CarbonylContact C-O 3.6Å; F194-R212 VanDerWaalsContact CA-O 3.31Å; F194-R212 WeakPolarHBondContact CA-O 3.5Å; F194-V213 HydrophobicContact CD1-CG1 3.63Å; F194-V213 HydrophobicContact CE1-CG1 3.64Å; F194-I295 HydrophobicContact CD1-CG2 4.27Å; F194-I295 HydrophobicContact CE1-CG2 3.77Å; F194-L297 HydrophobicContact CE1-CB 4.1Å; F194-L297 HydrophobicContact CZ-CB 3.75Å; F194-L297 HydrophobicContact CZ-CD2 4.49Å; F194-A310 HydrophobicContact CE2-CB 3.85Å; F194-A310 HydrophobicContact CZ-CB 4.1Å; F194-T312 HydrophobicContact CB-CG2 3.7Å; F194-T312 HydrophobicContact CD1-CG2 3.54Å; F194-T312 HydrophobicContact CD2-CG2 3.78Å; F194-T312 HydrophobicContact CE1-CG2 4.04Å; F194-T312 HydrophobicContact CE2-CG2 4.23Å; F194-T312 HydrophobicContact CG-CG2 3.39Å; F194-T312 HydrophobicContact CZ-CG2 4.35Å; F194-H344 PolarHBondContact O-CE1 3.5Å
195	S	97	Very high	89.7	Confident	2 Å²	2	54.8 Å²	54.8	1%	0.014	28%	0.275	C	S	.	.			trans	-59.6	151.3	169.1	48.9	0	0	0	0	111	N197 R212 Y314	S195-N197 VanDerWaalsContact C-N 3.33Å; S195-N197 VanDerWaalsContact CB-O 3.24Å; S195-N197 WeakPolarHBondContact CB-O 3.27Å; S195-N197 PolarHBondContact OG-O 3.39Å; S195-R212 PolarHBondContact N-O 3.04Å; S195-R212 PolarHBondContact OG-N 2.96Å; S195-Y314 WeakPolarHBondContact O-CE1 3.32Å; S195-Y314 PolarHBondContact O-OH 3.01Å; S195-Y314 PolarHBondContact OG-OH 3.37Å
196	H	95.4	Very high	90.5	Very high	106 Å²	106	58.7 Å²	58.7	49%	0.491	29%	0.29	S	S	.	.	S	Bend	trans	-71.1	-37.8	177	-77.4	-55.4	0	0	0	111.1	K48 Y314 H344	K48-H196 PolarHBondContact NZ-O 3.07Å; H196-Y314 WeakPolarHBondContact O-CE1 3.21Å; H196-H344 AromaticContact CD2-CD2 3.87Å; H196-H344 AromaticContact CD2-CE1 3.58Å; H196-H344 AromaticContact CD2-CG 3.4Å; H196-H344 VanDerWaalsContact CD2-CG 3.4Å; H196-H344 AromaticContact CD2-ND1 3.21Å; H196-H344 PolarHBondContact CD2-ND1 3.43Å; H196-H344 AromaticContact CD2-NE2 3.99Å; H196-H344 AromaticContact CG-ND1 3.73Å; H196-H344 PolarHBondContact N-ND1 3.26Å; H196-H344 AromaticContact NE2-CE1 3.63Å; H196-H344 AromaticContact NE2-ND1 3.77Å; H196-H344 AromaticContact NE2-NE2 3.82Å
197	N	97.1	Very high	91.7	Very high	46 Å²	46	51.1 Å²	51.1	25%	0.246	26%	0.257	C	S	.	.	S	Bend	trans	-113.3	149.8	178.8	-61.2	94.1	0	0	0	110.2	S195 Y314 E318 L320 F325	S195-N197 VanDerWaalsContact C-N 3.33Å; S195-N197 VanDerWaalsContact CB-O 3.24Å; S195-N197 WeakPolarHBondContact CB-O 3.27Å; S195-N197 PolarHBondContact OG-O 3.39Å; N197-Y314 VanDerWaalsContact C-CE1 3.48Å; N197-E318 VanDerWaalsContact CA-O 3.27Å; N197-E318 WeakPolarHBondContact CA-O 3.49Å; N197-E318 VanDerWaalsContact CB-O 3.31Å; N197-E318 WeakPolarHBondContact CB-O 3.37Å; N197-E318 PolarHBondContact ND2-O 2.93Å; N197-L320 HydrophobicContact CB-CD1 3.83Å; N197-L320 HydrophobicContact CB-CG 4.04Å; N197-F325 WeakPolarHBondContact O-CZ 3.49Å
198	A	97.6	Very high	92.7	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	157.9	159.1	0	0	0	0	0	107.8	L209 M210 F211 Y314 E318 V319 L320	A198-L209 HydrophobicContact CB-CD1 3.95Å; A198-M210 CarbonylContact C-O 3.53Å; A198-M210 WeakPolarHBondContact CA-O 3.41Å; A198-F211 HydrophobicContact CB-CB 4.35Å; A198-Y314 HydrophobicContact CB-CD1 3.92Å; A198-Y314 HydrophobicContact CB-CD2 4.11Å; A198-Y314 HydrophobicContact CB-CE1 4.21Å; A198-Y314 HydrophobicContact CB-CE2 4.36Å; A198-Y314 HydrophobicContact CB-CG 3.88Å; A198-E318 PolarHBondContact N-O 3.35Å; A198-V319 HydrophobicContact CB-CG2 4.32Å; A198-V319 CarbonylContact O-C 3.57Å; A198-V319 WeakPolarHBondContact O-CA 3.48Å; A198-L320 PolarHBondContact O-N 3.04Å
199	V	97.6	Very high	93.6	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	145.1	-179.2	-55	0	0	0	0	110.4	L209 M210 L320 H323 F325 T346	V199-L209 CarbonylContact O-C 3.55Å; V199-M210 HydrophobicContact CG2-CB 3.88Å; V199-M210 PolarHBondContact N-O 2.65Å; V199-M210 PolarHBondContact O-N 3.39Å; V199-L320 CarbonylContact C-O 3.55Å; V199-L320 VanDerWaalsContact CA-O 3.29Å; V199-L320 WeakPolarHBondContact CA-O 3.16Å; V199-L320 HydrophobicContact CG1-CB 4.28Å; V199-H323 HydrophobicContact CB-CB 4.05Å; V199-H323 WeakPolarHBondContact CB-O 3.33Å; V199-H323 HydrophobicContact CG1-CB 3.78Å; V199-H323 WeakPolarHBondContact CG2-O 3.4Å; V199-F325 HydrophobicContact CG1-CE1 4.3Å; V199-F325 HydrophobicContact CG1-CE2 4.29Å; V199-F325 HydrophobicContact CG1-CZ 4.05Å; V199-F325 HydrophobicContact CG2-CD2 3.88Å; V199-F325 HydrophobicContact CG2-CE2 3.59Å; V199-F325 HydrophobicContact CG2-CZ 4.16Å; V199-T346 HydrophobicContact CG1-CG2 3.71Å
200	I	97.3	Very high	94.5	Very high	4 Å²	4	41.9 Å²	41.9	2%	0.021	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	122.5	171.7	-65.2	173.1	0	0	0	107.8	L207 C208 L209 I272 L286 V319 L320 W321 G322	I200-L207 HydrophobicContact CG2-CD1 3.75Å; I200-L207 HydrophobicContact CG2-CD2 4.17Å; I200-L207 HydrophobicContact CG2-CG 3.86Å; I200-C208 WeakPolarHBondContact CA-O 3.3Å; I200-L209 HydrophobicContact CD1-CD1 4.28Å; I200-L209 HydrophobicContact CG1-CB 4.38Å; I200-L209 HydrophobicContact CG1-CD1 3.67Å; I200-I272 HydrophobicContact CG2-CD1 4.3Å; I200-L286 HydrophobicContact CD1-CD2 4.29Å; I200-V319 HydrophobicContact CD1-CG1 3.66Å; I200-V319 HydrophobicContact CG1-CG1 3.74Å; I200-L320 PolarHBondContact N-O 2.9Å; I200-W321 HydrophobicContact CB-CD2 4.41Å; I200-W321 HydrophobicContact CB-CE3 4.23Å; I200-W321 HydrophobicContact CD1-CE3 3.8Å; I200-W321 HydrophobicContact CD1-CZ3 3.92Å; I200-W321 HydrophobicContact CG2-CD2 4.19Å; I200-W321 HydrophobicContact CG2-CE3 4.06Å; I200-W321 HydrophobicContact CG2-CH2 4.31Å; I200-W321 HydrophobicContact CG2-CZ2 4.42Å; I200-W321 HydrophobicContact CG2-CZ3 4.13Å; I200-G322 WeakPolarHBondContact O-CA 3.29Å; I200-G322 PolarHBondContact O-N 3.36Å
201	A	96.6	Very high	95.2	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.008	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	163.1	178.8	0	0	0	0	0	111.8	C208 M210 H323 R324	A201-C208 PolarHBondContact N-O 2.85Å; A201-C208 VanDerWaalsContact N-O 3.1Å; A201-C208 PolarHBondContact O-N 3.14Å; A201-M210 HydrophobicContact CB-CE 4.37Å; A201-H323 WeakPolarHBondContact CB-O 3.34Å; A201-R324 HydrophobicContact CB-CG 3.78Å
202	M	95.3	Very high	95.7	Very high	54 Å²	54	34.7 Å²	34.7	27%	0.266	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	132	172.1	-67.9	-62	-69.6	0	0	110.8	G205 K206 L207 T352 P353 M360	M202-G205 VanDerWaalsContact CE-C 3.45Å; M202-G205 WeakPolarHBondContact CE-O 3.45Å; M202-K206 CarbonylContact C-O 3.59Å; M202-K206 WeakPolarHBondContact CA-O 3.4Å; M202-L207 HydrophobicContact CG-CD1 4.47Å; M202-L207 HydrophobicContact SD-CB 4.08Å; M202-L207 HydrophobicContact SD-CD1 3.85Å; M202-T352 HydrophobicContact CG-CG2 4.33Å; M202-P353 HydrophobicContact CG-CG 4.36Å; M202-P353 HydrophobicContact SD-CG 4.4Å; M202-M360 HydrophobicContact CE-CE 3.69Å; M202-M360 HydrophobicContact SD-CE 3.7Å; M202-M360 HydrophobicContact SD-SD 4.33Å
203	R	94	Very high	95.8	Very high	101 Å²	101	34.1 Å²	34.1	38%	0.381	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	126.5	171.3	-168	170.3	-168.1	162.9	0.7	109.1	G205 K206 M210	R203-G205 PolarHBondContact O-N 2.87Å; R203-G205 VanDerWaalsContact O-N 3.08Å; R203-K206 PolarHBondContact N-O 3.04Å; R203-K206 PolarHBondContact O-N 3.48Å; R203-K206 VanDerWaalsContact O-O 3.14Å; R203-M210 HydrophobicContact CB-CE 3.67Å; R203-M210 HydrophobicContact CG-CE 4.37Å
204	D	92.8	Very high	95.9	Very high	151 Å²	151	31.9 Å²	31.9	81%	0.807	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	50	38.7	178.4	-51	-37.6	0	0	0	113.6	K206	D204-K206 VanDerWaalsContact C-N 3.34Å; D204-K206 PolarHBondContact O-N 2.84Å
205	G	90.3	Very high	95.7	Very high	46 Å²	46	31.2 Å²	31.2	47%	0.474	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.2	1.5	177.6	0	0	0	0	0	116	M202 R203	M202-G205 VanDerWaalsContact CE-C 3.45Å; M202-G205 WeakPolarHBondContact CE-O 3.45Å; R203-G205 PolarHBondContact O-N 2.87Å; R203-G205 VanDerWaalsContact O-N 3.08Å
206	K	93.5	Very high	95.4	Very high	100 Å²	100	35.5 Å²	35.5	44%	0.435	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	149.4	-178.7	-66.4	168.5	163.7	-154.7	0	111.2	M202 R203 D204 E271	M202-K206 CarbonylContact C-O 3.59Å; M202-K206 WeakPolarHBondContact CA-O 3.4Å; R203-K206 PolarHBondContact N-O 3.04Å; R203-K206 PolarHBondContact O-N 3.48Å; R203-K206 VanDerWaalsContact O-O 3.14Å; D204-K206 VanDerWaalsContact C-N 3.34Å; D204-K206 PolarHBondContact O-N 2.84Å; K206-E271 HydrophobicContact CB-CG 4.42Å; K206-E271 VanDerWaalsContact CD-CD 3.49Å; K206-E271 HydrophobicContact CD-CG 4.16Å; K206-E271 WeakPolarHBondContact CD-OE1 3.34Å; K206-E271 WeakPolarHBondContact CE-OE1 3.2Å; K206-E271 IonicContact NZ-OE1 3.48Å; K206-E271 PolarHBondContact NZ-OE1 3.44Å; K206-E271 IonicContact NZ-OE2 3.75Å; K206-E271 PolarHBondContact NZ-OE2 2.94Å
207	L	95.6	Very high	95.1	Very high	8 Å²	8	36.7 Å²	36.7	4%	0.042	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	127.8	174.5	-167.7	70	0	0	0	108.3	I200 M202 I272 W321 T352 A357	I200-L207 HydrophobicContact CG2-CD1 3.75Å; I200-L207 HydrophobicContact CG2-CD2 4.17Å; I200-L207 HydrophobicContact CG2-CG 3.86Å; M202-L207 HydrophobicContact CG-CD1 4.47Å; M202-L207 HydrophobicContact SD-CB 4.08Å; M202-L207 HydrophobicContact SD-CD1 3.85Å; L207-I272 HydrophobicContact CD2-CD1 4.16Å; L207-I272 HydrophobicContact CG-CD1 4.18Å; L207-I272 WeakPolarHBondContact O-CB 3.32Å; L207-I272 PolarHBondContact O-N 3.34Å; L207-W321 HydrophobicContact CD1-CZ2 4.48Å; L207-W321 HydrophobicContact CD2-CH2 3.84Å; L207-W321 HydrophobicContact CD2-CZ2 4Å; L207-T352 HydrophobicContact CD1-CG2 4.31Å; L207-A357 HydrophobicContact CD2-CB 4.24Å
208	C	96.8	Very high	94.6	Very high	7 Å²	7	44.1 Å²	44.1	5%	0.047	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	140.3	-175.6	-52.6	0	0	0	0	111.7	I200 A201 M210 I269 H270	I200-C208 WeakPolarHBondContact CA-O 3.3Å; A201-C208 PolarHBondContact N-O 2.85Å; A201-C208 VanDerWaalsContact N-O 3.1Å; A201-C208 PolarHBondContact O-N 3.14Å; C208-M210 HydrophobicContact CB-CE 3.77Å; C208-M210 HydrophobicContact CB-CG 4.38Å; C208-I269 HydrophobicContact CB-CG2 3.57Å; C208-H270 CarbonylContact C-O 3.51Å; C208-H270 VanDerWaalsContact CA-O 3.25Å; C208-H270 WeakPolarHBondContact CA-O 3.31Å; C208-H270 WeakPolarHBondContact CB-O 3.3Å
209	L	97.4	Very high	94.3	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	133.2	164.2	176.8	74.2	0	0	0	109	A198 V199 I200 M249 H270 L278 I293 V319	A198-L209 HydrophobicContact CB-CD1 3.95Å; V199-L209 CarbonylContact O-C 3.55Å; I200-L209 HydrophobicContact CD1-CD1 4.28Å; I200-L209 HydrophobicContact CG1-CB 4.38Å; I200-L209 HydrophobicContact CG1-CD1 3.67Å; L209-M249 HydrophobicContact CD2-CE 3.72Å; L209-H270 HydrophobicContact CB-CB 4.26Å; L209-H270 PolarHBondContact N-O 3.44Å; L209-H270 PolarHBondContact O-N 3.45Å; L209-L278 HydrophobicContact CB-CD1 4.39Å; L209-L278 HydrophobicContact CD2-CD1 3.96Å; L209-I293 HydrophobicContact CD2-CD1 3.62Å; L209-V319 HydrophobicContact CD1-CG1 3.86Å
210	M	97.4	Very high	93.9	Very high	8 Å²	8	48.4 Å²	48.4	4%	0.039	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	141.2	-176.2	-56.3	179.3	-150.1	0	0	111.6	A198 V199 A201 R203 C208 T267 V268 I269 F325	A198-M210 CarbonylContact C-O 3.53Å; A198-M210 WeakPolarHBondContact CA-O 3.41Å; V199-M210 HydrophobicContact CG2-CB 3.88Å; V199-M210 PolarHBondContact N-O 2.65Å; V199-M210 PolarHBondContact O-N 3.39Å; A201-M210 HydrophobicContact CB-CE 4.37Å; R203-M210 HydrophobicContact CB-CE 3.67Å; R203-M210 HydrophobicContact CG-CE 4.37Å; C208-M210 HydrophobicContact CB-CE 3.77Å; C208-M210 HydrophobicContact CB-CG 4.38Å; M210-T267 HydrophobicContact CB-CG2 3.78Å; M210-T267 HydrophobicContact CG-CG2 4.34Å; M210-T267 HydrophobicContact SD-CG2 4.3Å; M210-V268 VanDerWaalsContact CA-O 3.28Å; M210-V268 WeakPolarHBondContact CA-O 3.37Å; M210-I269 HydrophobicContact CG-CG1 4.42Å; M210-I269 HydrophobicContact CG-CG2 4.42Å; M210-F325 HydrophobicContact CB-CE2 4.23Å
211	F	97.3	Very high	93.8	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	157.3	170.3	57.8	-90.2	0	0	0	109.9	A198 V213 V226 T267 V268 I295 Y314	A198-F211 HydrophobicContact CB-CB 4.35Å; F211-V213 HydrophobicContact CD2-CG1 4.13Å; F211-V213 HydrophobicContact CE2-CG1 4.04Å; F211-V226 HydrophobicContact CE2-CG1 3.95Å; F211-V226 HydrophobicContact CZ-CG1 3.72Å; F211-T267 CarbonylContact O-C 3.55Å; F211-T267 WeakPolarHBondContact O-CA 3.28Å; F211-V268 HydrophobicContact CD2-CB 4.08Å; F211-V268 HydrophobicContact CD2-CG2 4.36Å; F211-V268 HydrophobicContact CE1-CB 4.06Å; F211-V268 HydrophobicContact CE1-CG1 3.98Å; F211-V268 HydrophobicContact CE2-CB 3.55Å; F211-V268 HydrophobicContact CE2-CG1 3.98Å; F211-V268 HydrophobicContact CE2-CG2 3.75Å; F211-V268 HydrophobicContact CZ-CB 3.55Å; F211-V268 HydrophobicContact CZ-CG1 3.48Å; F211-V268 VanDerWaalsContact CZ-CG1 3.48Å; F211-V268 HydrophobicContact CZ-CG2 4.15Å; F211-V268 PolarHBondContact N-O 2.96Å; F211-V268 PolarHBondContact O-N 3.08Å; F211-I295 HydrophobicContact CD1-CD1 4.03Å; F211-I295 HydrophobicContact CD1-CG1 4.22Å; F211-I295 HydrophobicContact CD2-CG1 4.38Å; F211-I295 HydrophobicContact CD2-CG2 4.08Å; F211-I295 HydrophobicContact CE1-CD1 3.48Å; F211-I295 VanDerWaalsContact CE1-CD1 3.48Å; F211-I295 HydrophobicContact CE1-CG1 4.01Å; F211-I295 HydrophobicContact CE1-CG2 4.47Å; F211-I295 HydrophobicContact CE2-CB 4.41Å; F211-I295 HydrophobicContact CE2-CD1 4.36Å; F211-I295 HydrophobicContact CE2-CG1 4.18Å; F211-I295 HydrophobicContact CE2-CG2 3.38Å; F211-I295 HydrophobicContact CG-CG1 4.4Å; F211-I295 HydrophobicContact CZ-CB 4.45Å; F211-I295 HydrophobicContact CZ-CD1 3.66Å; F211-I295 HydrophobicContact CZ-CG1 3.98Å; F211-I295 HydrophobicContact CZ-CG2 3.61Å; F211-Y314 HydrophobicContact CB-CE2 4.03Å; F211-Y314 HydrophobicContact CG-CE2 4.32Å
212	R	96.7	Very high	93.6	Very high	15 Å²	15	51.9 Å²	51.9	6%	0.057	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	144.8	179.1	-76	-179.2	164.6	173.1	-4.2	112.4	F194 S195 L266 T267 F325 E326 V328 F343	F194-R212 CarbonylContact C-O 3.6Å; F194-R212 VanDerWaalsContact CA-O 3.31Å; F194-R212 WeakPolarHBondContact CA-O 3.5Å; S195-R212 PolarHBondContact N-O 3.04Å; S195-R212 PolarHBondContact OG-N 2.96Å; R212-L266 WeakPolarHBondContact CA-O 3.48Å; R212-T267 HydrophobicContact CG-CG2 4.46Å; R212-T267 PolarHBondContact NE-OG1 2.93Å; R212-F325 HydrophobicContact CG-CD1 4.27Å; R212-F325 HydrophobicContact CG-CD2 3.95Å; R212-F325 HydrophobicContact CG-CE1 4.37Å; R212-F325 HydrophobicContact CG-CE2 4.03Å; R212-F325 HydrophobicContact CG-CG 4.08Å; R212-F325 HydrophobicContact CG-CZ 4.26Å; R212-F325 VanDerWaalsContact NH2-CB 3.32Å; R212-E326 PolarHBondContact NH1-O 3.35Å; R212-E326 PolarHBondContact NH2-O 2.97Å; R212-V328 VanDerWaalsContact NH1-CG1 3.3Å; R212-F343 HydrophobicContact CB-CE2 3.73Å; R212-F343 HydrophobicContact CB-CZ 3.71Å; R212-F343 PolarHBondContact NH1-O 3.48Å
213	V	96.3	Very high	93.5	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	142.7	170.5	-64.3	0	0	0	0	109.1	L193 F194 F211 L260 L262 P265 L266 V268 L297	L193-V213 CarbonylContact O-C 3.58Å; L193-V213 WeakPolarHBondContact O-CA 3.45Å; F194-V213 HydrophobicContact CD1-CG1 3.63Å; F194-V213 HydrophobicContact CE1-CG1 3.64Å; F211-V213 HydrophobicContact CD2-CG1 4.13Å; F211-V213 HydrophobicContact CE2-CG1 4.04Å; V213-L260 HydrophobicContact CG2-CD1 3.76Å; V213-L262 HydrophobicContact CB-CD1 4.49Å; V213-L262 HydrophobicContact CG2-CD1 3.83Å; V213-P265 WeakPolarHBondContact O-CA 3.45Å; V213-L266 HydrophobicContact CG2-CB 4.32Å; V213-L266 PolarHBondContact N-O 2.82Å; V213-L266 PolarHBondContact O-N 3.08Å; V213-V268 HydrophobicContact CG1-CG2 4.37Å; V213-V268 HydrophobicContact CG2-CG2 3.89Å; V213-L297 HydrophobicContact CB-CD2 4.5Å
214	A	94.6	Very high	93.5	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	152.8	175.6	0	0	0	0	0	112.1	L193 P265 Y340 F343	L193-A214 PolarHBondContact N-O 3.43Å; L193-A214 PolarHBondContact O-N 3.41Å; A214-P265 HydrophobicContact CB-CB 4.06Å; A214-P265 HydrophobicContact CB-CG 3.89Å; A214-Y340 HydrophobicContact CB-CE1 3.84Å; A214-F343 HydrophobicContact CB-CD2 4.2Å; A214-F343 HydrophobicContact CB-CE2 3.48Å; A214-F343 VanDerWaalsContact CB-CE2 3.48Å; A214-F343 HydrophobicContact CB-CZ 3.94Å
215	N	93.4	Very high	93.6	Very high	7 Å²	7	47 Å²	47	4%	0.037	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	118.1	169.8	-179.7	12.3	0	0	0	109.2	L192 R217 S219 L262 Y340	L192-N215 HydrophobicContact CD2-CB 4.28Å; N215-R217 VanDerWaalsContact CG-O 3.31Å; N215-R217 PolarHBondContact ND2-O 3.23Å; N215-R217 VanDerWaalsContact ND2-O 3.13Å; N215-R217 PolarHBondContact O-N 2.86Å; N215-R217 PolarHBondContact OD1-N 3.03Å; N215-R217 VanDerWaalsContact OD1-N 3.08Å; N215-R217 PolarHBondContact OD1-O 3.01Å; N215-S219 PolarHBondContact ND2-O 3.48Å; N215-L262 HydrophobicContact CB-CD2 4.06Å; N215-L262 HydrophobicContact CB-CG 4.1Å; N215-Y340 PolarHBondContact O-OH 3.47Å; N215-Y340 VanDerWaalsContact O-OH 3.1Å
216	L	90.3	Very high	94	Very high	91 Å²	91	44.9 Å²	44.9	48%	0.476	21%	0.209	S	C	.	.			trans	-78.4	-8.8	-179.8	-63.1	176.3	0	0	0	113.2	T191 L193 Y340	T191-L216 WeakPolarHBondContact O-CB 3Å; T191-L216 WeakPolarHBondContact O-CG 3.38Å; T191-L216 PolarHBondContact O-N 3.36Å; T191-L216 VanDerWaalsContact O-N 3.08Å; L193-L216 HydrophobicContact CB-CD1 4.27Å; L193-L216 HydrophobicContact CB-CD2 4.4Å; L193-L216 HydrophobicContact CB-CG 4.21Å; L193-L216 HydrophobicContact CD2-CD2 4.13Å; L216-Y340 HydrophobicContact CD2-CD1 3.99Å; L216-Y340 HydrophobicContact CD2-CE1 3.67Å
217	R	89.6	Confident	94.1	Very high	132 Å²	132	45.1 Å²	45.1	50%	0.498	21%	0.207	S	C	.	.	S	Bend	trans	-110.6	153.1	-177.5	-156	172.4	-171.9	-100.3	5.4	111.2	R188 N215 S219	R188-R217 VanDerWaalsContact NH1-CD 3.32Å; N215-R217 VanDerWaalsContact CG-O 3.31Å; N215-R217 PolarHBondContact ND2-O 3.23Å; N215-R217 VanDerWaalsContact ND2-O 3.13Å; N215-R217 PolarHBondContact O-N 2.86Å; N215-R217 PolarHBondContact OD1-N 3.03Å; N215-R217 VanDerWaalsContact OD1-N 3.08Å; N215-R217 PolarHBondContact OD1-O 3.01Å; R217-S219 VanDerWaalsContact C-N 3.35Å; R217-S219 WeakPolarHBondContact CD-OG 3.3Å; R217-S219 PolarHBondContact NH1-OG 2.99Å
218	K	85.9	Confident	94.1	Very high	202 Å²	202	44.7 Å²	44.7	88%	0.878	21%	0.205	S	C	*	.	S	Bend	trans	-68.7	-29.4	175.4	-64.9	-170.4	177.8	-173.2	0	114.1
219	S	90.9	Very high	94.1	Very high	15 Å²	15	45.9 Å²	45.9	11%	0.105	21%	0.209	C	C	.	.	S	Bend	trans	-68.3	137.5	175.9	55.8	0	0	0	0	110.1	R188 N215 R217 E302	R188-S219 PolarHBondContact NH1-OG 2.89Å; N215-S219 PolarHBondContact ND2-O 3.48Å; R217-S219 VanDerWaalsContact C-N 3.35Å; R217-S219 WeakPolarHBondContact CD-OG 3.3Å; R217-S219 PolarHBondContact NH1-OG 2.99Å; S219-E302 WeakPolarHBondContact CA-OE2 3.36Å; S219-E302 VanDerWaalsContact CB-OE2 3.3Å; S219-E302 WeakPolarHBondContact CB-OE2 3.26Å
220	H	90.9	Very high	94.1	Very high	74 Å²	74	45.9 Å²	45.9	34%	0.343	21%	0.209	S	C	.	.			trans	-75.9	155.8	-174.3	-61.8	-67.9	0	0	0	112.3	E302	H220-E302 IonicContact CD2-OE1 2.73Å; H220-E302 PolarHBondContact N-OE2 2.97Å; H220-E302 WeakPolarHBondContact O-CB 3.38Å; H220-E302 PolarHBondContact O-N 3.18Å
221	I	93.5	Very high	93.9	Very high	11 Å²	11	45.7 Å²	45.7	6%	0.056	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	113.4	160.9	-56.1	-58	0	0	0	106	L192 A224 L300	L192-I221 HydrophobicContact CD2-CG1 4.08Å; I221-A224 HydrophobicContact CB-CB 4.3Å; I221-A224 HydrophobicContact CG2-CB 3.89Å; I221-L300 CarbonylContact C-O 3.5Å; I221-L300 WeakPolarHBondContact CA-O 3.45Å
222	V	92.9	Very high	93.7	Very high	67 Å²	67	48.8 Å²	48.8	41%	0.406	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	143.7	-178	179.7	0	0	0	0	108.4	A224 L300 E302	V222-A224 PolarHBondContact O-N 3Å; V222-A224 VanDerWaalsContact O-N 3.16Å; V222-L300 HydrophobicContact CB-CB 4.12Å; V222-L300 PolarHBondContact N-O 2.93Å; V222-L300 PolarHBondContact O-N 3.31Å; V222-E302 HydrophobicContact CG2-CB 4.43Å
223	E	92.6	Very high	93.5	Very high	150 Å²	150	50.8 Å²	50.8	70%	0.701	24%	0.237	S	C	*	.	E	Extended strand (participates in β ladder)	trans	51.3	38.9	-178.3	-66.8	179.5	174.8	0	0	113.5	H225 L300	E223-H225 PolarHBondContact O-N 2.89Å; E223-H225 PolarHBondContact O-ND1 3.41Å; E223-L300 HydrophobicContact CB-CD1 4.36Å; E223-L300 WeakPolarHBondContact OE2-CD1 3.19Å
224	A	95.1	Very high	93.2	Very high	1 Å²	1	55.6 Å²	55.6	1%	0.008	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	129.1	177.5	0	0	0	0	0	109.9	I221 V222 R259 L260 L297 E298	I221-A224 HydrophobicContact CB-CB 4.3Å; I221-A224 HydrophobicContact CG2-CB 3.89Å; V222-A224 PolarHBondContact O-N 3Å; V222-A224 VanDerWaalsContact O-N 3.16Å; A224-R259 CarbonylContact O-C 3.54Å; A224-R259 WeakPolarHBondContact O-CA 3.31Å; A224-L260 PolarHBondContact O-N 3.49Å; A224-L297 HydrophobicContact CB-CD1 4.4Å; A224-E298 CarbonylContact C-O 3.43Å; A224-E298 VanDerWaalsContact CA-O 3.24Å; A224-E298 WeakPolarHBondContact CA-O 3.42Å
225	H	95.8	Very high	93.1	Very high	52 Å²	52	63.1 Å²	63.1	24%	0.241	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	152.9	175.4	63.6	-81.3	0	0	0	110.8	E223 D258 R259 E298	E223-H225 PolarHBondContact O-N 2.89Å; E223-H225 PolarHBondContact O-ND1 3.41Å; H225-D258 VanDerWaalsContact CA-O 3.27Å; H225-D258 WeakPolarHBondContact CA-O 3.48Å; H225-R259 HydrophobicContact CB-CG 4.49Å; H225-E298 WeakPolarHBondContact CE1-CB 3.22Å; H225-E298 IonicContact CE1-OE2 2.89Å; H225-E298 PolarHBondContact N-O 2.92Å; H225-E298 WeakPolarHBondContact NE2-CB 3.24Å; H225-E298 IonicContact NE2-OE2 2.95Å; H225-E298 PolarHBondContact NE2-OE2 3.27Å; H225-E298 PolarHBondContact O-N 2.8Å
226	V	96.8	Very high	93.2	Very high	2 Å²	2	63.5 Å²	63.5	1%	0.012	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	142.2	-174.4	176.1	0	0	0	0	110.8	F211 V251 D258 L260 V268 I295 I296 L297	F211-V226 HydrophobicContact CE2-CG1 3.95Å; F211-V226 HydrophobicContact CZ-CG1 3.72Å; V226-V251 VanDerWaalsContact O-CG2 3.25Å; V226-V251 WeakPolarHBondContact O-CG2 3.33Å; V226-D258 PolarHBondContact N-O 3.35Å; V226-D258 VanDerWaalsContact N-O 3.11Å; V226-L260 HydrophobicContact CB-CD1 4.45Å; V226-L260 HydrophobicContact CG2-CD1 3.42Å; V226-L260 VanDerWaalsContact CG2-CD1 3.42Å; V226-L260 HydrophobicContact CG2-CG 4.2Å; V226-V268 HydrophobicContact CG1-CG1 4.21Å; V226-V268 HydrophobicContact CG1-CG2 4.49Å; V226-V268 HydrophobicContact CG2-CG2 4.31Å; V226-I295 HydrophobicContact CG1-CG2 4.11Å; V226-I296 CarbonylContact C-O 3.59Å; V226-I296 WeakPolarHBondContact CA-O 3.27Å; V226-L297 HydrophobicContact CG2-CB 4.38Å; V226-L297 HydrophobicContact CG2-CD1 3.53Å
227	R	96.3	Very high	93.4	Very high	105 Å²	105	68.2 Å²	68.2	40%	0.396	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	147.1	173.8	-59.3	174.9	62.5	-169.5	0.5	109.2	I296	R227-I296 HydrophobicContact CB-CB 4.33Å; R227-I296 PolarHBondContact N-O 2.9Å; R227-I296 PolarHBondContact O-N 3.37Å
228	A	96.7	Very high	93.6	Very high	0 Å²	0	69.5 Å²	69.5	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	134.4	-179.2	0	0	0	0	0	109.1	M249 V251 V294 I295	A228-M249 HydrophobicContact CB-CB 4.1Å; A228-M249 HydrophobicContact CB-CE 3.8Å; A228-M249 PolarHBondContact O-N 2.93Å; A228-V251 HydrophobicContact CB-CG1 3.9Å; A228-V294 WeakPolarHBondContact CA-O 3.27Å; A228-I295 HydrophobicContact CB-CD1 3.42Å; A228-I295 VanDerWaalsContact CB-CD1 3.42Å
229	Q	96.4	Very high	94	Very high	31 Å²	31	62.5 Å²	62.5	15%	0.145	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	135	-179.5	-64.7	-177.9	-47	0	0	109.6	I247 I293 V294	Q229-I247 CarbonylContact C-O 3.52Å; Q229-I247 VanDerWaalsContact CA-O 3.31Å; Q229-I247 WeakPolarHBondContact CA-O 3.39Å; Q229-I293 CarbonylContact O-C 3.6Å; Q229-I293 WeakPolarHBondContact O-CA 3.41Å; Q229-V294 PolarHBondContact N-O 3.11Å; Q229-V294 PolarHBondContact O-N 3.13Å
230	M	95.8	Very high	94.2	Very high	0 Å²	0	67.8 Å²	67.8	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	124.5	168.8	-171.3	-172.4	69.5	0	0	109.1	K232 I247 M249 P277 L278 F291	M230-K232 HydrophobicContact CE-CD 3.5Å; M230-K232 VanDerWaalsContact CE-CD 3.5Å; M230-K232 HydrophobicContact CE-CG 3.96Å; M230-K232 HydrophobicContact SD-CD 4.42Å; M230-I247 HydrophobicContact CE-CD1 3.73Å; M230-I247 PolarHBondContact N-O 3.47Å; M230-I247 PolarHBondContact O-N 2.87Å; M230-M249 HydrophobicContact CB-CG 4.26Å; M230-M249 HydrophobicContact CB-SD 4.06Å; M230-P277 HydrophobicContact CB-CG 4.22Å; M230-P277 HydrophobicContact CE-CB 3.37Å; M230-P277 HydrophobicContact CE-CG 4.08Å; M230-P277 HydrophobicContact SD-CB 3.83Å; M230-P277 HydrophobicContact SD-CG 4.13Å; M230-L278 HydrophobicContact SD-CD2 4.3Å; M230-F291 HydrophobicContact CG-CB 4Å; M230-F291 HydrophobicContact CG-CD2 4.08Å; M230-F291 HydrophobicContact CG-CG 4.21Å; M230-F291 HydrophobicContact SD-CB 4.15Å; M230-F291 HydrophobicContact SD-CD2 4.31Å; M230-F291 HydrophobicContact SD-CG 4.1Å
231	V	94.7	Very high	94.4	Very high	5 Å²	5	69.8 Å²	69.8	3%	0.03	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	119.6	179.2	-172.9	0	0	0	0	108.8	F45 L244 D245 Q246 F291 E292 V294	F45-V231 HydrophobicContact CD1-CG2 4.45Å; V231-L244 HydrophobicContact CG1-CB 4.12Å; V231-L244 HydrophobicContact CG1-CD2 3.81Å; V231-L244 HydrophobicContact CG1-CG 4.49Å; V231-D245 VanDerWaalsContact CA-O 3.31Å; V231-D245 WeakPolarHBondContact CA-O 2.94Å; V231-Q246 HydrophobicContact CG2-CG 4.24Å; V231-F291 CarbonylContact O-C 3.56Å; V231-F291 WeakPolarHBondContact O-CA 3.21Å; V231-E292 PolarHBondContact N-O 2.97Å; V231-E292 PolarHBondContact O-N 3.34Å; V231-V294 HydrophobicContact CG2-CG2 3.78Å
232	K	92.5	Very high	94.4	Very high	65 Å²	65	71.3 Å²	71.3	28%	0.283	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	153.7	174.3	68.4	177.4	-179.1	-174.8	0	111.5	M230 D245 F291	M230-K232 HydrophobicContact CE-CD 3.5Å; M230-K232 VanDerWaalsContact CE-CD 3.5Å; M230-K232 HydrophobicContact CE-CG 3.96Å; M230-K232 HydrophobicContact SD-CD 4.42Å; K232-D245 PolarHBondContact N-O 3.48Å; K232-D245 VanDerWaalsContact N-O 3.12Å; K232-D245 WeakPolarHBondContact O-CB 3.28Å; K232-D245 PolarHBondContact O-N 2.91Å; K232-F291 HydrophobicContact CB-CB 3.97Å
233	P	91.8	Very high	94.3	Very high	57 Å²	57	71.9 Å²	71.9	37%	0.37	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	140.3	167.5	27	-33.1	0	0	0	110.4	Y241 I242 P243	P233-Y241 HydrophobicContact CB-CE2 4.19Å; P233-I242 WeakPolarHBondContact CA-O 3.25Å; P233-P243 WeakPolarHBondContact CA-O 3.17Å; P233-P243 WeakPolarHBondContact CB-O 3.44Å
234	R	90.9	Very high	94.3	Very high	100 Å²	100	68.9 Å²	68.9	38%	0.377	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	147.3	178.6	-173.7	172.8	83.8	93	-5.2	111	I242 D245	R234-I242 PolarHBondContact N-O 2.92Å; R234-I242 PolarHBondContact O-N 3.25Å; R234-D245 HydrophobicContact CB-CB 4.01Å; R234-D245 WeakPolarHBondContact CD-OD2 3.29Å; R234-D245 IonicContact CZ-OD2 3.28Å; R234-D245 IonicContact NE-OD2 3.82Å; R234-D245 PolarHBondContact NE-OD2 2.92Å; R234-D245 IonicContact NH2-OD2 2.85Å
235	Y	93.4	Very high	94.2	Very high	158 Å²	158	70.4 Å²	70.4	62%	0.62	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.3	134.9	162.1	-73.9	-92.6	0	0	0	109.1	E240 Y241	Y235-E240 CarbonylContact C-O 3.15Å; Y235-E240 VanDerWaalsContact CA-O 3.29Å; Y235-E240 WeakPolarHBondContact CA-O 3.24Å; Y235-Y241 HydrophobicContact CD1-CD2 4.01Å; Y235-Y241 HydrophobicContact CD1-CG 4.46Å; Y235-Y241 AromaticContact CD2-CD2 3.91Å; Y235-Y241 HydrophobicContact CD2-CD2 3.91Å; Y235-Y241 HydrophobicContact CD2-CE2 4.39Å; Y235-Y241 AromaticContact CE1-CD2 3.55Å; Y235-Y241 HydrophobicContact CE1-CD2 3.55Å; Y235-Y241 AromaticContact CE1-CG 3.87Å; Y235-Y241 HydrophobicContact CE1-CG 3.87Å; Y235-Y241 AromaticContact CE2-CD2 3.41Å; Y235-Y241 HydrophobicContact CE2-CD2 3.41Å; Y235-Y241 VanDerWaalsContact CE2-CD2 3.41Å; Y235-Y241 AromaticContact CE2-CE2 3.72Å; Y235-Y241 HydrophobicContact CE2-CE2 3.72Å; Y235-Y241 HydrophobicContact CE2-CG 4.47Å; Y235-Y241 HydrophobicContact CG-CD2 4.18Å; Y235-Y241 AromaticContact CZ-CD2 3.21Å; Y235-Y241 AromaticContact CZ-CE2 3.82Å; Y235-Y241 AromaticContact CZ-CG 3.87Å
236	T	94.8	Very high	94.1	Very high	15 Å²	15	72.6 Å²	72.6	9%	0.092	35%	0.352	C	S	.	.			trans	-76.8	166.7	172.9	77.9	0	0	0	0	110.8	E238 G239 E240 I242	T236-E238 WeakPolarHBondContact CB-OE2 3.36Å; T236-E238 PolarHBondContact O-N 3.37Å; T236-E238 PolarHBondContact OG1-N 3.5Å; T236-E238 PolarHBondContact OG1-OE2 2.86Å; T236-G239 PolarHBondContact O-N 2.87Å; T236-G239 PolarHBondContact OG1-N 2.93Å; T236-E240 HydrophobicContact CG2-CB 3.96Å; T236-E240 PolarHBondContact N-O 3.23Å; T236-E240 WeakPolarHBondContact OG1-CB 3.44Å; T236-E240 PolarHBondContact OG1-N 2.94Å; T236-E240 VanDerWaalsContact OG1-N 3.12Å; T236-I242 HydrophobicContact CG2-CD1 3.87Å; T236-I242 HydrophobicContact CG2-CG1 4.37Å
237	E	93.4	Very high	94	Very high	191 Å²	191	74.8 Å²	74.8	89%	0.893	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-27.5	178	-61.8	-173.6	175.2	0	0	111.6	G239	E237-G239 PolarHBondContact O-N 3.41Å
238	E	95.5	Very high	94	Very high	159 Å²	159	73.9 Å²	73.9	74%	0.743	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-5	175.3	-52	78.4	-172.6	0	0	113.1	T236	T236-E238 WeakPolarHBondContact CB-OE2 3.36Å; T236-E238 PolarHBondContact O-N 3.37Å; T236-E238 PolarHBondContact OG1-N 3.5Å; T236-E238 PolarHBondContact OG1-OE2 2.86Å
239	G	93.8	Very high	93.9	Very high	54 Å²	54	74 Å²	74	56%	0.557	37%	0.366	S	S	*	.			trans	88.7	11.6	178.4	0	0	0	0	0	115.4	T236 E237	T236-G239 PolarHBondContact O-N 2.87Å; T236-G239 PolarHBondContact OG1-N 2.93Å; E237-G239 PolarHBondContact O-N 3.41Å
240	E	95.7	Very high	93.8	Very high	127 Å²	127	74.7 Å²	74.7	59%	0.593	37%	0.371	S	S	*	.			trans	-73.3	133.4	173.4	-176.8	180	-170.7	0	0	110.6	Y235 T236	Y235-E240 CarbonylContact C-O 3.15Å; Y235-E240 VanDerWaalsContact CA-O 3.29Å; Y235-E240 WeakPolarHBondContact CA-O 3.24Å; T236-E240 HydrophobicContact CG2-CB 3.96Å; T236-E240 PolarHBondContact N-O 3.23Å; T236-E240 WeakPolarHBondContact OG1-CB 3.44Å; T236-E240 PolarHBondContact OG1-N 2.94Å; T236-E240 VanDerWaalsContact OG1-N 3.12Å
241	Y	94.4	Very high	93.8	Very high	115 Å²	115	75.2 Å²	75.2	45%	0.451	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	117.7	175.7	179.3	-118	0	0	0	111.3	P233 Y235 P243	P233-Y241 HydrophobicContact CB-CE2 4.19Å; Y235-Y241 HydrophobicContact CD1-CD2 4.01Å; Y235-Y241 HydrophobicContact CD1-CG 4.46Å; Y235-Y241 AromaticContact CD2-CD2 3.91Å; Y235-Y241 HydrophobicContact CD2-CD2 3.91Å; Y235-Y241 HydrophobicContact CD2-CE2 4.39Å; Y235-Y241 AromaticContact CE1-CD2 3.55Å; Y235-Y241 HydrophobicContact CE1-CD2 3.55Å; Y235-Y241 AromaticContact CE1-CG 3.87Å; Y235-Y241 HydrophobicContact CE1-CG 3.87Å; Y235-Y241 AromaticContact CE2-CD2 3.41Å; Y235-Y241 HydrophobicContact CE2-CD2 3.41Å; Y235-Y241 VanDerWaalsContact CE2-CD2 3.41Å; Y235-Y241 AromaticContact CE2-CE2 3.72Å; Y235-Y241 HydrophobicContact CE2-CE2 3.72Å; Y235-Y241 HydrophobicContact CE2-CG 4.47Å; Y235-Y241 HydrophobicContact CG-CD2 4.18Å; Y235-Y241 AromaticContact CZ-CD2 3.21Å; Y235-Y241 AromaticContact CZ-CE2 3.82Å; Y235-Y241 AromaticContact CZ-CG 3.87Å; Y241-P243 HydrophobicContact CD1-CG 4.2Å; Y241-P243 HydrophobicContact CE1-CB 4.2Å; Y241-P243 HydrophobicContact CE1-CG 3.9Å
242	I	94.2	Very high	93.6	Very high	43 Å²	43	75.5 Å²	75.5	22%	0.221	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	110.3	174.7	-55.1	175	0	0	0	108.1	P233 R234 T236 L244 D245	P233-I242 WeakPolarHBondContact CA-O 3.25Å; R234-I242 PolarHBondContact N-O 2.92Å; R234-I242 PolarHBondContact O-N 3.25Å; T236-I242 HydrophobicContact CG2-CD1 3.87Å; T236-I242 HydrophobicContact CG2-CG1 4.37Å; I242-L244 VanDerWaalsContact C-N 3.35Å; I242-L244 PolarHBondContact O-N 3.47Å; I242-D245 HydrophobicContact CB-CB 4.4Å; I242-D245 HydrophobicContact CG2-CB 3.87Å
243	P	90.4	Very high	93.6	Very high	80 Å²	80	80.5 Å²	80.5	52%	0.519	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	-36.7	-174.9	-25.2	34	0	0	0	114.3	P233 Y241	P233-P243 WeakPolarHBondContact CA-O 3.17Å; P233-P243 WeakPolarHBondContact CB-O 3.44Å; Y241-P243 HydrophobicContact CD1-CG 4.2Å; Y241-P243 HydrophobicContact CE1-CB 4.2Å; Y241-P243 HydrophobicContact CE1-CG 3.9Å
244	L	91	Very high	93.5	Very high	87 Å²	87	83.7 Å²	83.7	46%	0.455	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	85.1	-179.7	-67.2	173.9	0	0	0	108.7	F45 V231 I242	F45-L244 HydrophobicContact CD2-CD1 3.73Å; F45-L244 HydrophobicContact CE2-CD1 3.76Å; V231-L244 HydrophobicContact CG1-CB 4.12Å; V231-L244 HydrophobicContact CG1-CD2 3.81Å; V231-L244 HydrophobicContact CG1-CG 4.49Å; I242-L244 VanDerWaalsContact C-N 3.35Å; I242-L244 PolarHBondContact O-N 3.47Å
245	D	94.3	Very high	93.5	Very high	32 Å²	32	86.4 Å²	86.4	17%	0.171	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	135.1	173.1	-162.9	7.8	0	0	0	109.3	V231 K232 R234 I242	V231-D245 VanDerWaalsContact CA-O 3.31Å; V231-D245 WeakPolarHBondContact CA-O 2.94Å; K232-D245 PolarHBondContact N-O 3.48Å; K232-D245 VanDerWaalsContact N-O 3.12Å; K232-D245 WeakPolarHBondContact O-CB 3.28Å; K232-D245 PolarHBondContact O-N 2.91Å; R234-D245 HydrophobicContact CB-CB 4.01Å; R234-D245 WeakPolarHBondContact CD-OD2 3.29Å; R234-D245 IonicContact CZ-OD2 3.28Å; R234-D245 IonicContact NE-OD2 3.82Å; R234-D245 PolarHBondContact NE-OD2 2.92Å; R234-D245 IonicContact NH2-OD2 2.85Å; I242-D245 HydrophobicContact CB-CB 4.4Å; I242-D245 HydrophobicContact CG2-CB 3.87Å
246	Q	94.4	Very high	93.3	Very high	98 Å²	98	79.6 Å²	79.6	46%	0.458	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	101.6	-177.2	-64.8	179.6	39.2	0	0	108.7	V231	V231-Q246 HydrophobicContact CG2-CG 4.24Å
247	I	94.6	Very high	93.1	Very high	49 Å²	49	82.9 Å²	82.9	25%	0.251	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	123.1	-177	-58.2	165.3	0	0	0	108	Q229 M230 P277	Q229-I247 CarbonylContact C-O 3.52Å; Q229-I247 VanDerWaalsContact CA-O 3.31Å; Q229-I247 WeakPolarHBondContact CA-O 3.39Å; M230-I247 HydrophobicContact CE-CD1 3.73Å; M230-I247 PolarHBondContact N-O 3.47Å; M230-I247 PolarHBondContact O-N 2.87Å; I247-P277 HydrophobicContact CG2-CB 4.18Å; I247-P277 HydrophobicContact CG2-CG 4.17Å
248	D	95.1	Very high	93.1	Very high	86 Å²	86	74.5 Å²	74.5	46%	0.46	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	144.6	178.2	-165.2	72.1	0	0	0	111.2
249	M	95.1	Very high	93.1	Very high	1 Å²	1	75.3 Å²	75.3	1%	0.005	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	118.1	174.6	-60.1	-165.8	-34.4	0	0	109.4	L209 A228 M230 V251 P277 L278 I293	L209-M249 HydrophobicContact CD2-CE 3.72Å; A228-M249 HydrophobicContact CB-CB 4.1Å; A228-M249 HydrophobicContact CB-CE 3.8Å; A228-M249 PolarHBondContact O-N 2.93Å; M230-M249 HydrophobicContact CB-CG 4.26Å; M230-M249 HydrophobicContact CB-SD 4.06Å; M249-V251 PolarHBondContact O-N 3.33Å; M249-V251 VanDerWaalsContact O-N 3.12Å; M249-P277 HydrophobicContact CG-CG 3.82Å; M249-P277 HydrophobicContact SD-CG 4.17Å; M249-L278 HydrophobicContact SD-CD1 4.31Å; M249-I293 HydrophobicContact CE-CD1 4.31Å; M249-I293 HydrophobicContact CE-CG2 3.51Å; M249-I293 HydrophobicContact SD-CD1 4.44Å; M249-I293 HydrophobicContact SD-CG2 4.42Å
250	N	94.9	Very high	93.1	Very high	46 Å²	46	74.1 Å²	74.1	25%	0.246	36%	0.361	C	S	.	.			trans	-67.4	111.8	-174.3	-165.6	-4.8	0	0	0	112	G252 Y253 D254 H270	N250-G252 VanDerWaalsContact C-N 3.3Å; N250-G252 VanDerWaalsContact OD1-CA 3.25Å; N250-G252 WeakPolarHBondContact OD1-CA 3.37Å; N250-G252 PolarHBondContact OD1-N 2.95Å; N250-Y253 PolarHBondContact OD1-N 3.4Å; N250-D254 PolarHBondContact ND2-OD2 2.87Å; N250-H270 PolarHBondContact O-ND1 3.44Å
251	V	95.1	Very high	93	Very high	12 Å²	12	75.9 Å²	75.9	7%	0.073	37%	0.368	C	S	.	.	S	Bend	trans	-97.7	18.8	171.3	-66.9	0	0	0	0	112.2	V226 A228 M249 D258 V268 H270	V226-V251 VanDerWaalsContact O-CG2 3.25Å; V226-V251 WeakPolarHBondContact O-CG2 3.33Å; A228-V251 HydrophobicContact CB-CG1 3.9Å; M249-V251 PolarHBondContact O-N 3.33Å; M249-V251 VanDerWaalsContact O-N 3.12Å; V251-D258 HydrophobicContact CG2-CB 4.16Å; V251-V268 HydrophobicContact CB-CG1 4.02Å; V251-V268 HydrophobicContact CG1-CG1 3.96Å; V251-H270 HydrophobicContact CG1-CB 4.23Å
252	G	91.3	Very high	92.9	Very high	11 Å²	11	70.6 Å²	70.6	11%	0.113	35%	0.347	C	S	.	.	S	Bend	trans	93.6	39.7	178.4	0	0	0	0	0	114.1	N250 D254 K255 G256 T257 D258	N250-G252 VanDerWaalsContact C-N 3.3Å; N250-G252 VanDerWaalsContact OD1-CA 3.25Å; N250-G252 WeakPolarHBondContact OD1-CA 3.37Å; N250-G252 PolarHBondContact OD1-N 2.95Å; G252-D254 VanDerWaalsContact C-N 3.34Å; G252-K255 PolarHBondContact O-N 3.17Å; G252-G256 PolarHBondContact O-N 2.92Å; G252-T257 VanDerWaalsContact CA-OG1 3.31Å; G252-T257 WeakPolarHBondContact CA-OG1 3.3Å; G252-T257 PolarHBondContact O-N 2.92Å; G252-T257 PolarHBondContact O-OG1 3.27Å; G252-D258 PolarHBondContact O-N 2.86Å
253	Y	91.4	Very high	92.7	Very high	170 Å²	170	71.8 Å²	71.8	67%	0.667	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-45.4	173.6	176.9	-100.9	0	0	0	111.4	N250 K255 G256	N250-Y253 PolarHBondContact OD1-N 3.4Å; Y253-K255 VanDerWaalsContact C-N 3.25Å; Y253-K255 PolarHBondContact O-N 3.38Å; Y253-G256 PolarHBondContact O-N 3.42Å
254	D	90.4	Very high	92.8	Very high	123 Å²	123	69.1 Å²	69.1	66%	0.658	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-29.9	-177.7	-48	-59.4	0	0	0	113	N250 G252	N250-D254 PolarHBondContact ND2-OD2 2.87Å; G252-D254 VanDerWaalsContact C-N 3.34Å
255	K	89.9	Confident	93	Very high	157 Å²	157	65.4 Å²	65.4	68%	0.683	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-8.9	177.5	-61.7	172.4	-172.5	166	0	111.8	G252 Y253 T257	G252-K255 PolarHBondContact O-N 3.17Å; Y253-K255 VanDerWaalsContact C-N 3.25Å; Y253-K255 PolarHBondContact O-N 3.38Å; K255-T257 HydrophobicContact CB-CG2 4.09Å; K255-T257 PolarHBondContact O-N 2.73Å
256	G	90.4	Very high	93.1	Very high	15 Å²	15	66.6 Å²	66.6	16%	0.155	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.2	23.1	-174	0	0	0	0	0	114.4	G252 Y253 D258 R259	G252-G256 PolarHBondContact O-N 2.92Å; Y253-G256 PolarHBondContact O-N 3.42Å; G256-D258 VanDerWaalsContact C-N 3.34Å; G256-D258 VanDerWaalsContact C-OD1 3.25Å; G256-D258 VanDerWaalsContact CA-OD1 3.29Å; G256-D258 WeakPolarHBondContact CA-OD1 3.48Å; G256-R259 PolarHBondContact O-NE 2.89Å; G256-R259 PolarHBondContact O-NH2 3.15Å
257	T	90.5	Very high	93.1	Very high	84 Å²	84	63.9 Å²	63.9	52%	0.515	32%	0.318	S	S	.	.			trans	-85.4	-9.3	175.2	57	0	0	0	0	112.7	G252 K255 R259	G252-T257 VanDerWaalsContact CA-OG1 3.31Å; G252-T257 WeakPolarHBondContact CA-OG1 3.3Å; G252-T257 PolarHBondContact O-N 2.92Å; G252-T257 PolarHBondContact O-OG1 3.27Å; K255-T257 HydrophobicContact CB-CG2 4.09Å; K255-T257 PolarHBondContact O-N 2.73Å; T257-R259 PolarHBondContact O-N 2.66Å
258	D	93.1	Very high	93.2	Very high	15 Å²	15	62.1 Å²	62.1	8%	0.08	31%	0.309	C	S	.	.	S	Bend	trans	-62.4	-28.1	168.2	68.7	-50.2	0	0	0	112	H225 V226 V251 G252 G256 L260	H225-D258 VanDerWaalsContact CA-O 3.27Å; H225-D258 WeakPolarHBondContact CA-O 3.48Å; V226-D258 PolarHBondContact N-O 3.35Å; V226-D258 VanDerWaalsContact N-O 3.11Å; V251-D258 HydrophobicContact CG2-CB 4.16Å; G252-D258 PolarHBondContact O-N 2.86Å; G256-D258 VanDerWaalsContact C-N 3.34Å; G256-D258 VanDerWaalsContact C-OD1 3.25Å; G256-D258 VanDerWaalsContact CA-OD1 3.29Å; G256-D258 WeakPolarHBondContact CA-OD1 3.48Å; D258-L260 WeakPolarHBondContact O-CG 3.46Å; D258-L260 PolarHBondContact O-N 2.91Å
259	R	94.7	Very high	93.3	Very high	176 Å²	176	60.9 Å²	60.9	66%	0.664	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.6	114.1	174.6	-59.9	172.2	-60.5	-177.8	2.1	110.1	A224 H225 G256 T257	A224-R259 CarbonylContact O-C 3.54Å; A224-R259 WeakPolarHBondContact O-CA 3.31Å; H225-R259 HydrophobicContact CB-CG 4.49Å; G256-R259 PolarHBondContact O-NE 2.89Å; G256-R259 PolarHBondContact O-NH2 3.15Å; T257-R259 PolarHBondContact O-N 2.66Å
260	L	93.7	Very high	93.4	Very high	29 Å²	29	60.9 Å²	60.9	15%	0.152	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	138	-173.1	-56.2	-174.3	0	0	0	112	V213 A224 V226 D258 L262 L266 V268	V213-L260 HydrophobicContact CG2-CD1 3.76Å; A224-L260 PolarHBondContact O-N 3.49Å; V226-L260 HydrophobicContact CB-CD1 4.45Å; V226-L260 HydrophobicContact CG2-CD1 3.42Å; V226-L260 VanDerWaalsContact CG2-CD1 3.42Å; V226-L260 HydrophobicContact CG2-CG 4.2Å; D258-L260 WeakPolarHBondContact O-CG 3.46Å; D258-L260 PolarHBondContact O-N 2.91Å; L260-L262 PolarHBondContact O-N 3.46Å; L260-L266 HydrophobicContact CB-CD1 4.11Å; L260-L266 HydrophobicContact CD2-CD1 4.38Å; L260-V268 HydrophobicContact CD1-CG2 3.91Å
261	F	93.8	Very high	93.4	Very high	165 Å²	165	61.3 Å²	61.3	72%	0.724	30%	0.303	S	S	*	.			trans	-93.5	85.5	163.3	-176.9	-121.6	0	0	0	110.3	V263	F261-V263 HydrophobicContact CD1-CG2 3.94Å; F261-V263 HydrophobicContact CD2-CG2 4.31Å; F261-V263 HydrophobicContact CE1-CB 4.32Å; F261-V263 HydrophobicContact CE1-CG2 3.37Å; F261-V263 HydrophobicContact CE2-CG2 3.78Å; F261-V263 HydrophobicContact CG-CG2 4.38Å; F261-V263 HydrophobicContact CZ-CG2 3.29Å; F261-V263 PolarHBondContact O-N 3.38Å
262	L	92.6	Very high	93.4	Very high	3 Å²	3	61.1 Å²	61.1	2%	0.016	30%	0.301	C	S	.	.			trans	-84.9	72.3	-167.9	-165.6	66.1	0	0	0	113.5	L192 V213 N215 L260 L266 L297	L192-L262 HydrophobicContact CD2-CD2 4.01Å; V213-L262 HydrophobicContact CB-CD1 4.49Å; V213-L262 HydrophobicContact CG2-CD1 3.83Å; N215-L262 HydrophobicContact CB-CD2 4.06Å; N215-L262 HydrophobicContact CB-CG 4.1Å; L260-L262 PolarHBondContact O-N 3.46Å; L262-L266 HydrophobicContact CD1-CB 4.4Å; L262-L266 HydrophobicContact CD1-CD1 4.27Å; L262-L266 HydrophobicContact CD1-CG 4.27Å; L262-L297 HydrophobicContact CD2-CD2 4.08Å
263	V	90.7	Very high	93.5	Very high	69 Å²	69	62.7 Å²	62.7	42%	0.418	31%	0.307	S	S	.	.	S	Bend	trans	-96.4	-45.5	171.8	179.8	0	0	0	0	111.8	F261	F261-V263 HydrophobicContact CD1-CG2 3.94Å; F261-V263 HydrophobicContact CD2-CG2 4.31Å; F261-V263 HydrophobicContact CE1-CB 4.32Å; F261-V263 HydrophobicContact CE1-CG2 3.37Å; F261-V263 HydrophobicContact CE2-CG2 3.78Å; F261-V263 HydrophobicContact CG-CG2 4.38Å; F261-V263 HydrophobicContact CZ-CG2 3.29Å; F261-V263 PolarHBondContact O-N 3.38Å
264	A	92	Very high	93.6	Very high	23 Å²	23	61.5 Å²	61.5	19%	0.19	31%	0.308	C	S	.	.	S	Bend	trans	-110.1	162.7	173.3	0	0	0	0	0	109.7	L266 I329 I338	A264-L266 PolarHBondContact O-N 3.22Å; A264-I329 HydrophobicContact CB-CD1 3.69Å; A264-I329 HydrophobicContact CB-CG1 4.37Å; A264-I338 HydrophobicContact CB-CD1 3.79Å
265	P	95.1	Very high	93.6	Very high	9 Å²	9	63.8 Å²	63.8	6%	0.058	31%	0.314	C	S	.	.			trans	-52.5	124	171.1	-29.6	36.6	0	0	0	112.1	V213 A214 V328 I338 Y340 F343	V213-P265 WeakPolarHBondContact O-CA 3.45Å; A214-P265 HydrophobicContact CB-CB 4.06Å; A214-P265 HydrophobicContact CB-CG 3.89Å; P265-V328 HydrophobicContact CB-CG2 3.79Å; P265-V328 HydrophobicContact CG-CG2 3.91Å; P265-I338 HydrophobicContact CG-CG2 3.78Å; P265-Y340 HydrophobicContact CG-CE1 3.98Å; P265-F343 HydrophobicContact CB-CD2 3.96Å; P265-F343 HydrophobicContact CB-CE2 3.9Å; P265-F343 HydrophobicContact CG-CD2 4.13Å; P265-F343 HydrophobicContact CG-CE2 4.37Å
266	L	95.4	Very high	93.9	Very high	58 Å²	58	56.7 Å²	56.7	30%	0.304	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	145.1	176.8	-64.9	177.7	0	0	0	109.7	R212 V213 L260 L262 A264	R212-L266 WeakPolarHBondContact CA-O 3.48Å; V213-L266 HydrophobicContact CG2-CB 4.32Å; V213-L266 PolarHBondContact N-O 2.82Å; V213-L266 PolarHBondContact O-N 3.08Å; L260-L266 HydrophobicContact CB-CD1 4.11Å; L260-L266 HydrophobicContact CD2-CD1 4.38Å; L262-L266 HydrophobicContact CD1-CB 4.4Å; L262-L266 HydrophobicContact CD1-CD1 4.27Å; L262-L266 HydrophobicContact CD1-CG 4.27Å; A264-L266 PolarHBondContact O-N 3.22Å
267	T	96.4	Very high	94	Very high	41 Å²	41	57.3 Å²	57.3	25%	0.252	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	111.2	171.4	-54.1	0	0	0	0	107.5	M210 F211 R212 F325	M210-T267 HydrophobicContact CB-CG2 3.78Å; M210-T267 HydrophobicContact CG-CG2 4.34Å; M210-T267 HydrophobicContact SD-CG2 4.3Å; F211-T267 CarbonylContact O-C 3.55Å; F211-T267 WeakPolarHBondContact O-CA 3.28Å; R212-T267 HydrophobicContact CG-CG2 4.46Å; R212-T267 PolarHBondContact NE-OG1 2.93Å; T267-F325 HydrophobicContact CG2-CD2 4.01Å; T267-F325 HydrophobicContact CG2-CE2 4.23Å
268	V	96.6	Very high	94.2	Very high	11 Å²	11	53.6 Å²	53.6	7%	0.067	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	141.5	174.7	-176.2	0	0	0	0	108.1	M210 F211 V213 V226 V251 L260	M210-V268 VanDerWaalsContact CA-O 3.28Å; M210-V268 WeakPolarHBondContact CA-O 3.37Å; F211-V268 HydrophobicContact CD2-CB 4.08Å; F211-V268 HydrophobicContact CD2-CG2 4.36Å; F211-V268 HydrophobicContact CE1-CB 4.06Å; F211-V268 HydrophobicContact CE1-CG1 3.98Å; F211-V268 HydrophobicContact CE2-CB 3.55Å; F211-V268 HydrophobicContact CE2-CG1 3.98Å; F211-V268 HydrophobicContact CE2-CG2 3.75Å; F211-V268 HydrophobicContact CZ-CB 3.55Å; F211-V268 HydrophobicContact CZ-CG1 3.48Å; F211-V268 VanDerWaalsContact CZ-CG1 3.48Å; F211-V268 HydrophobicContact CZ-CG2 4.15Å; F211-V268 PolarHBondContact N-O 2.96Å; F211-V268 PolarHBondContact O-N 3.08Å; V213-V268 HydrophobicContact CG1-CG2 4.37Å; V213-V268 HydrophobicContact CG2-CG2 3.89Å; V226-V268 HydrophobicContact CG1-CG1 4.21Å; V226-V268 HydrophobicContact CG1-CG2 4.49Å; V226-V268 HydrophobicContact CG2-CG2 4.31Å; V251-V268 HydrophobicContact CB-CG1 4.02Å; V251-V268 HydrophobicContact CG1-CG1 3.96Å; L260-V268 HydrophobicContact CD1-CG2 3.91Å
269	I	96.2	Very high	94.3	Very high	60 Å²	60	54.3 Å²	54.3	31%	0.308	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	126.1	-171.8	-50.9	165.3	0	0	0	107.3	C208 M210	C208-I269 HydrophobicContact CB-CG2 3.57Å; M210-I269 HydrophobicContact CG-CG1 4.42Å; M210-I269 HydrophobicContact CG-CG2 4.42Å
270	H	96.7	Very high	94.2	Very high	2 Å²	2	48.1 Å²	48.1	1%	0.009	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	117.7	163.4	170.4	58.4	0	0	0	107.1	C208 L209 N250 V251 S276	C208-H270 CarbonylContact C-O 3.51Å; C208-H270 VanDerWaalsContact CA-O 3.25Å; C208-H270 WeakPolarHBondContact CA-O 3.31Å; C208-H270 WeakPolarHBondContact CB-O 3.3Å; L209-H270 HydrophobicContact CB-CB 4.26Å; L209-H270 PolarHBondContact N-O 3.44Å; L209-H270 PolarHBondContact O-N 3.45Å; N250-H270 PolarHBondContact O-ND1 3.44Å; V251-H270 HydrophobicContact CG1-CB 4.23Å; H270-S276 PolarHBondContact NE2-OG 2.93Å
271	E	95.6	Very high	94.2	Very high	54 Å²	54	48 Å²	48	25%	0.252	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	130.7	173.4	-170.9	-179.8	149.4	0	0	108.7	K206 D273	K206-E271 HydrophobicContact CB-CG 4.42Å; K206-E271 VanDerWaalsContact CD-CD 3.49Å; K206-E271 HydrophobicContact CD-CG 4.16Å; K206-E271 WeakPolarHBondContact CD-OE1 3.34Å; K206-E271 WeakPolarHBondContact CE-OE1 3.2Å; K206-E271 IonicContact NZ-OE1 3.48Å; K206-E271 PolarHBondContact NZ-OE1 3.44Å; K206-E271 IonicContact NZ-OE2 3.75Å; K206-E271 PolarHBondContact NZ-OE2 2.94Å; E271-D273 PolarHBondContact O-N 2.97Å
272	I	95.9	Very high	94.2	Very high	9 Å²	9	40.7 Å²	40.7	5%	0.046	23%	0.225	C	C	.	.			trans	-91.3	87.4	176.5	-55.2	176.4	0	0	0	107.2	I200 L207 L278 A357	I200-I272 HydrophobicContact CG2-CD1 4.3Å; L207-I272 HydrophobicContact CD2-CD1 4.16Å; L207-I272 HydrophobicContact CG-CD1 4.18Å; L207-I272 WeakPolarHBondContact O-CB 3.32Å; L207-I272 PolarHBondContact O-N 3.34Å; I272-L278 HydrophobicContact CD1-CB 4.21Å; I272-L278 HydrophobicContact CD1-CD1 4.41Å; I272-L278 HydrophobicContact CG1-CB 4.33Å; I272-L278 HydrophobicContact CG2-CB 4.01Å; I272-A357 HydrophobicContact CB-CB 4.27Å; I272-A357 HydrophobicContact CG2-CB 3.64Å
273	D	92.6	Very high	94.3	Very high	43 Å²	43	43.6 Å²	43.6	23%	0.23	24%	0.237	C	C	.	.			trans	-101.7	-177.1	175.8	56.1	14.4	0	0	0	111.5	E271 E275 S276 F279	E271-D273 PolarHBondContact O-N 2.97Å; D273-E275 PolarHBondContact O-N 3.18Å; D273-E275 PolarHBondContact OD1-N 3.01Å; D273-S276 VanDerWaalsContact O-CB 3.23Å; D273-S276 WeakPolarHBondContact O-CB 3.47Å; D273-S276 PolarHBondContact O-N 3.02Å; D273-S276 PolarHBondContact OD1-N 3.31Å; D273-F279 VanDerWaalsContact O-CB 3.31Å; D273-F279 WeakPolarHBondContact O-CB 3.16Å; D273-F279 WeakPolarHBondContact O-CD2 3.38Å; D273-F279 WeakPolarHBondContact O-CG 3.27Å
274	E	92.8	Very high	94.4	Very high	146 Å²	146	47.4 Å²	47.4	68%	0.682	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-29.7	-179.3	-63.3	-178.3	-175.8	0	0	113.6	F279	E274-F279 HydrophobicContact CB-CE1 4.44Å; E274-F279 HydrophobicContact CB-CZ 4.35Å; E274-F279 HydrophobicContact CG-CE1 4.13Å; E274-F279 HydrophobicContact CG-CE2 4.07Å; E274-F279 HydrophobicContact CG-CZ 3.7Å
275	E	91.8	Very high	94.4	Very high	170 Å²	170	49.1 Å²	49.1	79%	0.794	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-18.7	178.3	-63.4	-176.5	178	0	0	112.2	D273	D273-E275 PolarHBondContact O-N 3.18Å; D273-E275 PolarHBondContact OD1-N 3.01Å
276	S	94.6	Very high	94.2	Very high	8 Å²	8	49 Å²	49	6%	0.056	26%	0.256	C	S	.	.	S	Bend	trans	-66.8	134.9	-179.7	179.6	0	0	0	0	111.9	H270 D273 L278 F279	H270-S276 PolarHBondContact NE2-OG 2.93Å; D273-S276 VanDerWaalsContact O-CB 3.23Å; D273-S276 WeakPolarHBondContact O-CB 3.47Å; D273-S276 PolarHBondContact O-N 3.02Å; D273-S276 PolarHBondContact OD1-N 3.31Å; S276-L278 PolarHBondContact O-N 2.97Å; S276-L278 PolarHBondContact OG-N 3.31Å; S276-F279 VanDerWaalsContact O-CB 3.24Å; S276-F279 WeakPolarHBondContact O-CB 3.46Å; S276-F279 PolarHBondContact O-N 3.18Å
277	P	93.4	Very high	93.9	Very high	29 Å²	29	52.1 Å²	52.1	19%	0.188	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-12.1	172.6	27.4	-34.4	0	0	0	113.6	M230 I247 M249	M230-P277 HydrophobicContact CB-CG 4.22Å; M230-P277 HydrophobicContact CE-CB 3.37Å; M230-P277 HydrophobicContact CE-CG 4.08Å; M230-P277 HydrophobicContact SD-CB 3.83Å; M230-P277 HydrophobicContact SD-CG 4.13Å; I247-P277 HydrophobicContact CG2-CB 4.18Å; I247-P277 HydrophobicContact CG2-CG 4.17Å; M249-P277 HydrophobicContact CG-CG 3.82Å; M249-P277 HydrophobicContact SD-CG 4.17Å
278	L	94.5	Very high	93.5	Very high	5 Å²	5	57.3 Å²	57.3	3%	0.026	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-1	177.1	-61.2	178	0	0	0	113.3	L209 M230 M249 I272 S276 G280 I281 F291 I293	L209-L278 HydrophobicContact CB-CD1 4.39Å; L209-L278 HydrophobicContact CD2-CD1 3.96Å; M230-L278 HydrophobicContact SD-CD2 4.3Å; M249-L278 HydrophobicContact SD-CD1 4.31Å; I272-L278 HydrophobicContact CD1-CB 4.21Å; I272-L278 HydrophobicContact CD1-CD1 4.41Å; I272-L278 HydrophobicContact CG1-CB 4.33Å; I272-L278 HydrophobicContact CG2-CB 4.01Å; S276-L278 PolarHBondContact O-N 2.97Å; S276-L278 PolarHBondContact OG-N 3.31Å; L278-G280 VanDerWaalsContact C-N 3.31Å; L278-G280 PolarHBondContact O-N 2.84Å; L278-I281 HydrophobicContact CD2-CD1 3.65Å; L278-I281 PolarHBondContact O-N 3.5Å; L278-F291 HydrophobicContact CD2-CE1 4.35Å; L278-F291 HydrophobicContact CD2-CE2 4.24Å; L278-F291 HydrophobicContact CD2-CZ 3.89Å; L278-I293 HydrophobicContact CD1-CD1 4.26Å
279	F	94.8	Very high	93.1	Very high	31 Å²	31	58.6 Å²	58.6	14%	0.136	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-43.4	-172.3	-173.8	-122.9	0	0	0	114.1	D273 E274 S276 A357 K358 E361	D273-F279 VanDerWaalsContact O-CB 3.31Å; D273-F279 WeakPolarHBondContact O-CB 3.16Å; D273-F279 WeakPolarHBondContact O-CD2 3.38Å; D273-F279 WeakPolarHBondContact O-CG 3.27Å; E274-F279 HydrophobicContact CB-CE1 4.44Å; E274-F279 HydrophobicContact CB-CZ 4.35Å; E274-F279 HydrophobicContact CG-CE1 4.13Å; E274-F279 HydrophobicContact CG-CE2 4.07Å; E274-F279 HydrophobicContact CG-CZ 3.7Å; S276-F279 VanDerWaalsContact O-CB 3.24Å; S276-F279 WeakPolarHBondContact O-CB 3.46Å; S276-F279 PolarHBondContact O-N 3.18Å; F279-A357 HydrophobicContact CD2-CB 3.75Å; F279-A357 HydrophobicContact CE2-CB 4.07Å; F279-A357 PolarHBondContact O-N 3.02Å; F279-K358 HydrophobicContact CD1-CB 3.78Å; F279-K358 HydrophobicContact CD1-CD 4.35Å; F279-K358 HydrophobicContact CD1-CG 4.21Å; F279-K358 HydrophobicContact CE1-CB 3.51Å; F279-K358 HydrophobicContact CE1-CD 4.1Å; F279-K358 HydrophobicContact CE1-CG 3.64Å; F279-K358 HydrophobicContact CE2-CB 4.3Å; F279-K358 HydrophobicContact CG-CB 4.28Å; F279-K358 VanDerWaalsContact CZ-CA 3.47Å; F279-K358 HydrophobicContact CZ-CB 3.79Å; F279-K358 HydrophobicContact CZ-CG 4.13Å; F279-K358 PolarHBondContact O-N 3.42Å; F279-E361 VanDerWaalsContact CE2-OE2 3.29Å; F279-E361 WeakPolarHBondContact CE2-OE2 3.35Å; F279-E361 WeakPolarHBondContact CZ-OE2 3.3Å
280	G	92.8	Very high	92.8	Very high	46 Å²	46	59.4 Å²	59.4	47%	0.474	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	6.3	-179.7	0	0	0	0	0	115.5	L278	L278-G280 VanDerWaalsContact C-N 3.31Å; L278-G280 PolarHBondContact O-N 2.84Å
281	I	93.9	Very high	92.6	Very high	25 Å²	25	59.8 Å²	59.8	13%	0.128	31%	0.308	C	S	.	.			trans	-94.1	119.3	-175.3	-70.2	170.4	0	0	0	110.3	L278 D285 L286 F291 W321	L278-I281 HydrophobicContact CD2-CD1 3.65Å; L278-I281 PolarHBondContact O-N 3.5Å; I281-D285 HydrophobicContact CG2-CB 4.2Å; I281-L286 HydrophobicContact CG2-CB 4.1Å; I281-F291 HydrophobicContact CD1-CD1 4.33Å; I281-F291 HydrophobicContact CD1-CE1 3.78Å; I281-F291 HydrophobicContact CD1-CZ 4.47Å; I281-W321 WeakPolarHBondContact O-CH2 3.43Å
282	S	94.9	Very high	92.6	Very high	13 Å²	13	57.8 Å²	57.8	9%	0.091	30%	0.299	C	S	.	.			trans	-88.1	175	171.2	78.6	0	0	0	0	112.4	Q284 D285 L286	S282-Q284 VanDerWaalsContact C-N 3.26Å; S282-Q284 PolarHBondContact O-N 3.24Å; S282-Q284 PolarHBondContact OG-N 2.99Å; S282-D285 VanDerWaalsContact CB-OD2 3.23Å; S282-D285 WeakPolarHBondContact CB-OD2 3.14Å; S282-D285 PolarHBondContact N-OD2 2.91Å; S282-D285 VanDerWaalsContact N-OD2 3.09Å; S282-D285 PolarHBondContact O-N 3.23Å; S282-D285 PolarHBondContact OG-N 3.35Å; S282-D285 PolarHBondContact OG-OD2 3.42Å; S282-L286 PolarHBondContact O-N 3.25Å
283	K	93.4	Very high	92.6	Very high	63 Å²	63	57.5 Å²	57.5	27%	0.274	30%	0.297	S	S	.	.	H	α-helix	trans	-57.4	-40.1	174.1	-179.5	173.9	179.1	170.6	0	112.4	W321 R354	K283-W321 HydrophobicContact CB-CB 4.43Å; K283-W321 HydrophobicContact CB-CD2 3.7Å; K283-W321 HydrophobicContact CB-CE3 4.16Å; K283-W321 HydrophobicContact CB-CG 3.79Å; K283-W321 HydrophobicContact CB-CZ2 4.5Å; K283-W321 HydrophobicContact CD-CB 4.07Å; K283-W321 HydrophobicContact CD-CG 3.92Å; K283-W321 HydrophobicContact CG-CB 3.88Å; K283-W321 HydrophobicContact CG-CD2 4.15Å; K283-W321 HydrophobicContact CG-CG 3.73Å; K283-R354 HydrophobicContact CB-CB 4.24Å; K283-R354 WeakPolarHBondContact CB-O 3.39Å; K283-R354 HydrophobicContact CD-CG 4.15Å; K283-R354 PolarHBondContact N-O 3.05Å
284	Q	92.3	Very high	92.8	Very high	149 Å²	149	55.7 Å²	55.7	70%	0.696	29%	0.288	S	S	*	.	H	α-helix	trans	-72.2	-40.3	-179.2	-69.8	178.7	-9.8	0	0	110.8	S282 L286 E287	S282-Q284 VanDerWaalsContact C-N 3.26Å; S282-Q284 PolarHBondContact O-N 3.24Å; S282-Q284 PolarHBondContact OG-N 2.99Å; Q284-L286 VanDerWaalsContact C-N 3.3Å; Q284-L286 PolarHBondContact O-N 3.35Å; Q284-E287 PolarHBondContact O-N 2.89Å
285	D	92.1	Very high	93	Very high	59 Å²	59	48.8 Å²	48.8	32%	0.316	26%	0.255	S	S	.	.	H	α-helix	trans	-65.3	-36.5	178.6	-56.3	-42.9	0	0	0	111.2	I281 S282 E287 M288 S289	I281-D285 HydrophobicContact CG2-CB 4.2Å; S282-D285 VanDerWaalsContact CB-OD2 3.23Å; S282-D285 WeakPolarHBondContact CB-OD2 3.14Å; S282-D285 PolarHBondContact N-OD2 2.91Å; S282-D285 VanDerWaalsContact N-OD2 3.09Å; S282-D285 PolarHBondContact O-N 3.23Å; S282-D285 PolarHBondContact OG-N 3.35Å; S282-D285 PolarHBondContact OG-OD2 3.42Å; D285-E287 PolarHBondContact O-N 2.98Å; D285-M288 CarbonylContact O-C 3.51Å; D285-M288 PolarHBondContact O-N 3.47Å; D285-S289 WeakPolarHBondContact O-CA 3.29Å; D285-S289 VanDerWaalsContact O-CB 3.23Å; D285-S289 WeakPolarHBondContact O-CB 3.47Å; D285-S289 PolarHBondContact O-N 2.87Å; D285-S289 PolarHBondContact O-OG 3.42Å
286	L	92.3	Very high	93.3	Very high	8 Å²	8	41.4 Å²	41.4	4%	0.042	22%	0.221	C	C	.	.	H	α-helix	trans	-56.4	-36	176.6	-176.5	65.9	0	0	0	112.6	I200 I281 S282 Q284 M288 F291 P316 V319 W321	I200-L286 HydrophobicContact CD1-CD2 4.29Å; I281-L286 HydrophobicContact CG2-CB 4.1Å; S282-L286 PolarHBondContact O-N 3.25Å; Q284-L286 VanDerWaalsContact C-N 3.3Å; Q284-L286 PolarHBondContact O-N 3.35Å; L286-M288 VanDerWaalsContact C-N 3.31Å; L286-F291 HydrophobicContact CD1-CE1 4.09Å; L286-F291 HydrophobicContact CD1-CZ 3.52Å; L286-P316 HydrophobicContact CD1-CB 4.15Å; L286-P316 VanDerWaalsContact O-CB 3.28Å; L286-P316 WeakPolarHBondContact O-CB 3.25Å; L286-V319 HydrophobicContact CD1-CB 4.33Å; L286-V319 HydrophobicContact CD2-CB 4.07Å; L286-V319 HydrophobicContact CD2-CG1 3.96Å; L286-W321 HydrophobicContact CD2-CB 4.48Å; L286-W321 HydrophobicContact CD2-CE3 4.03Å
287	E	88.6	Confident	93.3	Very high	123 Å²	123	41.1 Å²	41.1	58%	0.575	22%	0.219	S	C	*	.	H	α-helix	trans	-75.3	-20.7	179.4	-65.6	-179.6	-168.1	0	0	113.5	R39 Q284 D285	R39-E287 PolarHBondContact NH2-O 2.95Å; Q284-E287 PolarHBondContact O-N 2.89Å; D285-E287 PolarHBondContact O-N 2.98Å
288	M	88.6	Confident	93.4	Very high	150 Å²	150	42 Å²	42	74%	0.739	22%	0.22	S	C	*	.	H	α-helix	trans	-103.5	-18.2	179.4	-61.8	-166	-63.8	0	0	113.3	D285 L286	D285-M288 CarbonylContact O-C 3.51Å; D285-M288 PolarHBondContact O-N 3.47Å; L286-M288 VanDerWaalsContact C-N 3.31Å
289	S	88.2	Confident	93.4	Very high	38 Å²	38	42 Å²	42	27%	0.266	22%	0.222	S	C	.	.			trans	-69.6	150	-175.9	-68.6	0	0	0	0	111.5	D285 F291 P316	D285-S289 WeakPolarHBondContact O-CA 3.29Å; D285-S289 VanDerWaalsContact O-CB 3.23Å; D285-S289 WeakPolarHBondContact O-CB 3.47Å; D285-S289 PolarHBondContact O-N 2.87Å; D285-S289 PolarHBondContact O-OG 3.42Å; S289-F291 VanDerWaalsContact CB-CE1 3.48Å; S289-P316 WeakPolarHBondContact O-CG 3.3Å
290	D	88.6	Confident	93.3	Very high	77 Å²	77	42.1 Å²	42.1	41%	0.412	22%	0.224	S	C	.	.			trans	-122.1	93.1	176.1	-173.3	24.7	0	0	0	109.7	H42	H42-D290 IonicContact CE1-OD1 2.89Å; H42-D290 PolarHBondContact CE1-OD1 3.28Å; H42-D290 VanDerWaalsContact CE1-OD1 3.28Å; H42-D290 IonicContact CE1-OD2 2.93Å; H42-D290 PolarHBondContact CE1-OD2 2.84Å; H42-D290 IonicContact CG-OD1 3.49Å; H42-D290 IonicContact ND1-OD1 3.04Å; H42-D290 PolarHBondContact ND1-OD1 3.03Å; H42-D290 IonicContact ND1-OD2 3.68Å; H42-D290 PolarHBondContact ND1-OD2 3.46Å
291	F	93	Very high	93.2	Very high	10 Å²	10	40.1 Å²	40.1	4%	0.044	20%	0.202	C	C	.	.			trans	-150.4	162	174.2	63	-100.8	0	0	0	109.7	M230 V231 K232 L278 I281 L286 S289 I293 P316	M230-F291 HydrophobicContact CG-CB 4Å; M230-F291 HydrophobicContact CG-CD2 4.08Å; M230-F291 HydrophobicContact CG-CG 4.21Å; M230-F291 HydrophobicContact SD-CB 4.15Å; M230-F291 HydrophobicContact SD-CD2 4.31Å; M230-F291 HydrophobicContact SD-CG 4.1Å; V231-F291 CarbonylContact O-C 3.56Å; V231-F291 WeakPolarHBondContact O-CA 3.21Å; K232-F291 HydrophobicContact CB-CB 3.97Å; L278-F291 HydrophobicContact CD2-CE1 4.35Å; L278-F291 HydrophobicContact CD2-CE2 4.24Å; L278-F291 HydrophobicContact CD2-CZ 3.89Å; I281-F291 HydrophobicContact CD1-CD1 4.33Å; I281-F291 HydrophobicContact CD1-CE1 3.78Å; I281-F291 HydrophobicContact CD1-CZ 4.47Å; L286-F291 HydrophobicContact CD1-CE1 4.09Å; L286-F291 HydrophobicContact CD1-CZ 3.52Å; S289-F291 VanDerWaalsContact CB-CE1 3.48Å; F291-I293 HydrophobicContact CD2-CD1 4.41Å; F291-I293 HydrophobicContact CD2-CG1 3.87Å; F291-I293 HydrophobicContact CE2-CD1 3.77Å; F291-I293 HydrophobicContact CE2-CG1 3.73Å; F291-P316 HydrophobicContact CD1-CG 4.22Å; F291-P316 HydrophobicContact CD2-CG 4.22Å; F291-P316 HydrophobicContact CE1-CB 4.39Å; F291-P316 HydrophobicContact CE1-CG 4.23Å; F291-P316 HydrophobicContact CE2-CG 4.21Å; F291-P316 HydrophobicContact CG-CG 4.22Å; F291-P316 HydrophobicContact CZ-CB 4.25Å; F291-P316 HydrophobicContact CZ-CG 4.23Å; F291-P316 WeakPolarHBondContact O-CD 3.32Å; F291-P316 WeakPolarHBondContact O-CG 3.25Å
292	E	95.6	Very high	93	Very high	12 Å²	12	43.7 Å²	43.7	6%	0.056	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	129	173.4	-180	173.4	170.5	0	0	109.6	R44 F45 V46 V231 V294 S313 L315	R44-E292 WeakPolarHBondContact CA-OE2 3.39Å; R44-E292 WeakPolarHBondContact CG-OE1 3.47Å; F45-E292 WeakPolarHBondContact CB-OE2 3.31Å; F45-E292 PolarHBondContact N-OE2 2.91Å; V46-E292 PolarHBondContact N-OE1 3.23Å; V231-E292 PolarHBondContact N-O 2.97Å; V231-E292 PolarHBondContact O-N 3.34Å; E292-V294 HydrophobicContact CG-CG2 4.31Å; E292-S313 WeakPolarHBondContact OE1-CB 3.39Å; E292-S313 PolarHBondContact OE1-OG 3.08Å; E292-L315 HydrophobicContact CB-CD2 4.24Å; E292-L315 HydrophobicContact CG-CD2 4.13Å
293	I	96.4	Very high	92.7	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.01	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	110.8	175	-59.2	177.6	0	0	0	108.2	L209 Q229 M249 L278 F291 I295 S313 Y314	L209-I293 HydrophobicContact CD2-CD1 3.62Å; Q229-I293 CarbonylContact O-C 3.6Å; Q229-I293 WeakPolarHBondContact O-CA 3.41Å; M249-I293 HydrophobicContact CE-CD1 4.31Å; M249-I293 HydrophobicContact CE-CG2 3.51Å; M249-I293 HydrophobicContact SD-CD1 4.44Å; M249-I293 HydrophobicContact SD-CG2 4.42Å; L278-I293 HydrophobicContact CD1-CD1 4.26Å; F291-I293 HydrophobicContact CD2-CD1 4.41Å; F291-I293 HydrophobicContact CD2-CG1 3.87Å; F291-I293 HydrophobicContact CE2-CD1 3.77Å; F291-I293 HydrophobicContact CE2-CG1 3.73Å; I293-I295 HydrophobicContact CG2-CD1 3.72Å; I293-I295 HydrophobicContact CG2-CG1 4.41Å; I293-S313 CarbonylContact O-C 3.58Å; I293-S313 WeakPolarHBondContact O-CA 3.45Å; I293-Y314 PolarHBondContact N-O 3.19Å; I293-Y314 PolarHBondContact O-N 2.72Å
294	V	97.1	Very high	92.4	Very high	6 Å²	6	47.1 Å²	47.1	4%	0.036	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	125.9	175.4	-178.8	0	0	0	0	109	F45 V46 A228 Q229 V231 E292 I296	F45-V294 HydrophobicContact CD1-CG2 4.3Å; V46-V294 HydrophobicContact CB-CG2 4.44Å; V46-V294 HydrophobicContact CG2-CG1 4.19Å; V46-V294 HydrophobicContact CG2-CG2 4.21Å; A228-V294 WeakPolarHBondContact CA-O 3.27Å; Q229-V294 PolarHBondContact N-O 3.11Å; Q229-V294 PolarHBondContact O-N 3.13Å; V231-V294 HydrophobicContact CG2-CG2 3.78Å; E292-V294 HydrophobicContact CG-CG2 4.31Å; V294-I296 HydrophobicContact CG1-CG1 4.21Å
295	I	97.2	Very high	92.4	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	135.3	175.3	-57.8	-51.3	0	0	0	109.1	F194 F211 V226 A228 I293 R311 T312 Y314	F194-I295 HydrophobicContact CD1-CG2 4.27Å; F194-I295 HydrophobicContact CE1-CG2 3.77Å; F211-I295 HydrophobicContact CD1-CD1 4.03Å; F211-I295 HydrophobicContact CD1-CG1 4.22Å; F211-I295 HydrophobicContact CD2-CG1 4.38Å; F211-I295 HydrophobicContact CD2-CG2 4.08Å; F211-I295 HydrophobicContact CE1-CD1 3.48Å; F211-I295 VanDerWaalsContact CE1-CD1 3.48Å; F211-I295 HydrophobicContact CE1-CG1 4.01Å; F211-I295 HydrophobicContact CE1-CG2 4.47Å; F211-I295 HydrophobicContact CE2-CB 4.41Å; F211-I295 HydrophobicContact CE2-CD1 4.36Å; F211-I295 HydrophobicContact CE2-CG1 4.18Å; F211-I295 HydrophobicContact CE2-CG2 3.38Å; F211-I295 HydrophobicContact CG-CG1 4.4Å; F211-I295 HydrophobicContact CZ-CB 4.45Å; F211-I295 HydrophobicContact CZ-CD1 3.66Å; F211-I295 HydrophobicContact CZ-CG1 3.98Å; F211-I295 HydrophobicContact CZ-CG2 3.61Å; V226-I295 HydrophobicContact CG1-CG2 4.11Å; A228-I295 HydrophobicContact CB-CD1 3.42Å; A228-I295 VanDerWaalsContact CB-CD1 3.42Å; I293-I295 HydrophobicContact CG2-CD1 3.72Å; I293-I295 HydrophobicContact CG2-CG1 4.41Å; I295-R311 VanDerWaalsContact O-CA 3.29Å; I295-R311 WeakPolarHBondContact O-CA 3.44Å; I295-T312 HydrophobicContact CB-CG2 3.89Å; I295-T312 HydrophobicContact CG1-CG2 4.47Å; I295-T312 PolarHBondContact N-O 3.07Å; I295-T312 PolarHBondContact O-N 3.38Å; I295-Y314 HydrophobicContact CG1-CD2 3.94Å; I295-Y314 HydrophobicContact CG1-CE2 3.62Å
296	I	96.5	Very high	92.3	Very high	15 Å²	15	44.2 Å²	44.2	8%	0.077	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	125.9	-179.6	-51.2	-179.4	0	0	0	107.8	V226 R227 V294 E298 Q309 R311	V226-I296 CarbonylContact C-O 3.59Å; V226-I296 WeakPolarHBondContact CA-O 3.27Å; R227-I296 HydrophobicContact CB-CB 4.33Å; R227-I296 PolarHBondContact N-O 2.9Å; R227-I296 PolarHBondContact O-N 3.37Å; V294-I296 HydrophobicContact CG1-CG1 4.21Å; I296-E298 HydrophobicContact CG2-CG 4.02Å; I296-Q309 HydrophobicContact CG2-CG 3.5Å; I296-R311 HydrophobicContact CG1-CG 4.22Å; I296-R311 HydrophobicContact CG2-CG 4.24Å
297	L	95.8	Very high	92.3	Very high	3 Å²	3	49.1 Å²	49.1	2%	0.016	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	119.8	171.1	171.9	64.1	0	0	0	107.8	L192 F194 V213 A224 V226 L262 Q309 A310	L192-L297 HydrophobicContact CB-CD2 4.36Å; L192-L297 HydrophobicContact CD1-CD2 3.84Å; L192-L297 HydrophobicContact CD1-CG 4.32Å; L192-L297 HydrophobicContact CD2-CD2 3.98Å; L192-L297 HydrophobicContact CG-CD2 4.27Å; F194-L297 HydrophobicContact CE1-CB 4.1Å; F194-L297 HydrophobicContact CZ-CB 3.75Å; F194-L297 HydrophobicContact CZ-CD2 4.49Å; V213-L297 HydrophobicContact CB-CD2 4.5Å; A224-L297 HydrophobicContact CB-CD1 4.4Å; V226-L297 HydrophobicContact CG2-CB 4.38Å; V226-L297 HydrophobicContact CG2-CD1 3.53Å; L262-L297 HydrophobicContact CD2-CD2 4.08Å; L297-Q309 CarbonylContact O-C 3.55Å; L297-Q309 WeakPolarHBondContact O-CA 3.5Å; L297-A310 PolarHBondContact N-O 2.95Å; L297-A310 PolarHBondContact O-N 3.46Å
298	E	94.6	Very high	92.5	Very high	46 Å²	46	43.8 Å²	43.8	22%	0.215	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	152.6	178.4	-75.6	176.3	-158.6	0	0	110	A224 H225 I296 T308 Q309	A224-E298 CarbonylContact C-O 3.43Å; A224-E298 VanDerWaalsContact CA-O 3.24Å; A224-E298 WeakPolarHBondContact CA-O 3.42Å; H225-E298 WeakPolarHBondContact CE1-CB 3.22Å; H225-E298 IonicContact CE1-OE2 2.89Å; H225-E298 PolarHBondContact N-O 2.92Å; H225-E298 WeakPolarHBondContact NE2-CB 3.24Å; H225-E298 IonicContact NE2-OE2 2.95Å; H225-E298 PolarHBondContact NE2-OE2 3.27Å; H225-E298 PolarHBondContact O-N 2.8Å; I296-E298 HydrophobicContact CG2-CG 4.02Å; E298-T308 WeakPolarHBondContact CA-O 3.41Å; E298-Q309 HydrophobicContact CG-CB 4.07Å; E298-Q309 HydrophobicContact CG-CG 3.69Å; E298-Q309 PolarHBondContact OE1-NE2 3.11Å
299	G	94.1	Very high	92.7	Very high	5 Å²	5	40 Å²	40	5%	0.052	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	171.9	177.6	173.9	0	0	0	0	0	112.1	T307 T308	G299-T307 CarbonylContact O-C 3.54Å; G299-T307 WeakPolarHBondContact O-CA 3.4Å; G299-T308 PolarHBondContact N-O 3.38Å; G299-T308 VanDerWaalsContact N-O 3.14Å; G299-T308 PolarHBondContact O-N 3.1Å
300	L	93.1	Very high	93	Very high	35 Å²	35	38.4 Å²	38.4	18%	0.183	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	135.5	-176.8	-61.1	169.7	0	0	0	110.9	I221 V222 E223 E302 M306 T307	I221-L300 CarbonylContact C-O 3.5Å; I221-L300 WeakPolarHBondContact CA-O 3.45Å; V222-L300 HydrophobicContact CB-CB 4.12Å; V222-L300 PolarHBondContact N-O 2.93Å; V222-L300 PolarHBondContact O-N 3.31Å; E223-L300 HydrophobicContact CB-CD1 4.36Å; E223-L300 WeakPolarHBondContact OE2-CD1 3.19Å; L300-E302 PolarHBondContact O-N 3.27Å; L300-M306 WeakPolarHBondContact CA-O 3.35Å; L300-T307 HydrophobicContact CD2-CG2 3.41Å; L300-T307 VanDerWaalsContact CD2-CG2 3.41Å
301	V	91.9	Very high	93.3	Very high	3 Å²	3	38.3 Å²	38.3	2%	0.018	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	119.6	173	178.7	0	0	0	0	109.4	P185 R188 A303 T304 A305 M306 T308	P185-V301 HydrophobicContact CB-CG2 3.68Å; R188-V301 HydrophobicContact CB-CG2 3.95Å; R188-V301 HydrophobicContact CG-CG1 4.08Å; R188-V301 HydrophobicContact CG-CG2 3.81Å; V301-A303 VanDerWaalsContact C-N 3.28Å; V301-A303 PolarHBondContact O-N 2.83Å; V301-A303 VanDerWaalsContact O-N 3.08Å; V301-T304 PolarHBondContact O-N 3.44Å; V301-T304 VanDerWaalsContact O-N 3.08Å; V301-A305 WeakPolarHBondContact O-CA 3.31Å; V301-A305 PolarHBondContact O-N 3.47Å; V301-M306 PolarHBondContact N-O 3.3Å; V301-T308 HydrophobicContact CG2-CG2 3.74Å
302	E	88.9	Confident	93.4	Very high	100 Å²	100	38 Å²	38	47%	0.467	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-46.5	-43	-174.8	-179.8	179.8	-157.6	0	0	114.9	S219 H220 V222 L300	S219-E302 WeakPolarHBondContact CA-OE2 3.36Å; S219-E302 VanDerWaalsContact CB-OE2 3.3Å; S219-E302 WeakPolarHBondContact CB-OE2 3.26Å; H220-E302 IonicContact CD2-OE1 2.73Å; H220-E302 PolarHBondContact N-OE2 2.97Å; H220-E302 WeakPolarHBondContact O-CB 3.38Å; H220-E302 PolarHBondContact O-N 3.18Å; V222-E302 HydrophobicContact CG2-CB 4.43Å; L300-E302 PolarHBondContact O-N 3.27Å
303	A	88	Confident	93.5	Very high	85 Å²	85	37.4 Å²	37.4	70%	0.702	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-25.8	-175.2	0	0	0	0	0	114.7	V301	V301-A303 VanDerWaalsContact C-N 3.28Å; V301-A303 PolarHBondContact O-N 2.83Å; V301-A303 VanDerWaalsContact O-N 3.08Å
304	T	88.5	Confident	93.5	Very high	64 Å²	64	37.3 Å²	37.3	39%	0.393	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.7	-9.9	-172.7	55.9	0	0	0	0	113.2	V301 M306	V301-T304 PolarHBondContact O-N 3.44Å; V301-T304 VanDerWaalsContact O-N 3.08Å; T304-M306 PolarHBondContact O-N 3.38Å
305	A	90.7	Very high	93.4	Very high	74 Å²	74	38.4 Å²	38.4	61%	0.612	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	49	29.2	-171.1	0	0	0	0	0	113.2	V301	V301-A305 WeakPolarHBondContact O-CA 3.31Å; V301-A305 PolarHBondContact O-N 3.47Å
306	M	91.1	Very high	93.2	Very high	72 Å²	72	39.1 Å²	39.1	36%	0.355	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	140.3	177.5	-68.7	-178.2	74.5	0	0	109.6	A183 P185 L300 V301 T304	A183-M306 HydrophobicContact CB-SD 4.02Å; P185-M306 HydrophobicContact CG-CB 3.98Å; L300-M306 WeakPolarHBondContact CA-O 3.35Å; V301-M306 PolarHBondContact N-O 3.3Å; T304-M306 PolarHBondContact O-N 3.38Å
307	T	92.1	Very high	93.1	Very high	112 Å²	112	42.8 Å²	42.8	69%	0.687	25%	0.253	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.6	135.2	176.3	52.2	0	0	0	0	110.8	P185 G299 L300	P185-T307 VanDerWaalsContact CG-O 3.3Å; P185-T307 WeakPolarHBondContact CG-O 3.25Å; G299-T307 CarbonylContact O-C 3.54Å; G299-T307 WeakPolarHBondContact O-CA 3.4Å; L300-T307 HydrophobicContact CD2-CG2 3.41Å; L300-T307 VanDerWaalsContact CD2-CG2 3.41Å
308	T	92.3	Very high	93.1	Very high	10 Å²	10	44.3 Å²	44.3	6%	0.061	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	141.2	171.6	-174.7	0	0	0	0	108.7	E298 G299 V301	E298-T308 WeakPolarHBondContact CA-O 3.41Å; G299-T308 PolarHBondContact N-O 3.38Å; G299-T308 VanDerWaalsContact N-O 3.14Å; G299-T308 PolarHBondContact O-N 3.1Å; V301-T308 HydrophobicContact CG2-CG2 3.74Å
309	Q	92.8	Very high	93.2	Very high	71 Å²	71	42.5 Å²	42.5	33%	0.332	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	120.9	177.6	-172.1	-173.2	65.6	0	0	108.8	I296 L297 E298 R311	I296-Q309 HydrophobicContact CG2-CG 3.5Å; L297-Q309 CarbonylContact O-C 3.55Å; L297-Q309 WeakPolarHBondContact O-CA 3.5Å; E298-Q309 HydrophobicContact CG-CB 4.07Å; E298-Q309 HydrophobicContact CG-CG 3.69Å; E298-Q309 PolarHBondContact OE1-NE2 3.11Å; Q309-R311 HydrophobicContact CG-CG 4.17Å
310	A	94.3	Very high	93.3	Very high	4 Å²	4	44.4 Å²	44.4	3%	0.033	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	139.9	170.7	0	0	0	0	0	109	A189 L192 F194 L297	A189-A310 HydrophobicContact CB-CB 4.21Å; L192-A310 HydrophobicContact CB-CB 3.92Å; L192-A310 HydrophobicContact CD1-CB 3.74Å; L192-A310 HydrophobicContact CG-CB 4.47Å; F194-A310 HydrophobicContact CE2-CB 3.85Å; F194-A310 HydrophobicContact CZ-CB 4.1Å; L297-A310 PolarHBondContact N-O 2.95Å; L297-A310 PolarHBondContact O-N 3.46Å
311	R	95.5	Very high	93.5	Very high	75 Å²	75	43.6 Å²	43.6	28%	0.283	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	149.5	-175.8	-62.1	176.1	-61.8	-74.7	-14.2	109.9	V46 G50 I295 I296 Q309	V46-R311 HydrophobicContact CG1-CB 4.32Å; G50-R311 WeakPolarHBondContact CA-O 2.93Å; G50-R311 PolarHBondContact N-O 3.09Å; G50-R311 PolarHBondContact O-NE 2.59Å; G50-R311 PolarHBondContact O-NH2 3.03Å; I295-R311 VanDerWaalsContact O-CA 3.29Å; I295-R311 WeakPolarHBondContact O-CA 3.44Å; I296-R311 HydrophobicContact CG1-CG 4.22Å; I296-R311 HydrophobicContact CG2-CG 4.24Å; Q309-R311 HydrophobicContact CG-CG 4.17Å
312	T	96.3	Very high	93.6	Very high	3 Å²	3	43.8 Å²	43.8	2%	0.018	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	171.4	168.2	-169.7	0	0	0	0	109	K48 F194 I295 Y314	K48-T312 PolarHBondContact O-OG1 3.25Å; F194-T312 HydrophobicContact CB-CG2 3.7Å; F194-T312 HydrophobicContact CD1-CG2 3.54Å; F194-T312 HydrophobicContact CD2-CG2 3.78Å; F194-T312 HydrophobicContact CE1-CG2 4.04Å; F194-T312 HydrophobicContact CE2-CG2 4.23Å; F194-T312 HydrophobicContact CG-CG2 3.39Å; F194-T312 HydrophobicContact CZ-CG2 4.35Å; I295-T312 HydrophobicContact CB-CG2 3.89Å; I295-T312 HydrophobicContact CG1-CG2 4.47Å; I295-T312 PolarHBondContact N-O 3.07Å; I295-T312 PolarHBondContact O-N 3.38Å; T312-Y314 HydrophobicContact CG2-CE2 3.98Å
313	S	96.3	Very high	94	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	156.2	171.2	82.8	0	0	0	0	113.3	R44 V46 K48 E292 I293	R44-S313 PolarHBondContact NH1-O 3.29Å; R44-S313 PolarHBondContact NH1-OG 3.42Å; V46-S313 VanDerWaalsContact O-CB 3.29Å; V46-S313 WeakPolarHBondContact O-CB 3.14Å; V46-S313 PolarHBondContact O-OG 3.07Å; K48-S313 VanDerWaalsContact CD-O 3.29Å; K48-S313 WeakPolarHBondContact CD-O 3.48Å; K48-S313 VanDerWaalsContact CE-O 3.26Å; K48-S313 WeakPolarHBondContact CE-O 3.48Å; K48-S313 PolarHBondContact NZ-O 2.87Å; E292-S313 WeakPolarHBondContact OE1-CB 3.39Å; E292-S313 PolarHBondContact OE1-OG 3.08Å; I293-S313 CarbonylContact O-C 3.58Å; I293-S313 WeakPolarHBondContact O-CA 3.45Å
314	Y	96.6	Very high	94.5	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	118.1	173.3	-56.6	-80.5	0	0	0	109.2	S195 H196 N197 A198 F211 I293 I295 T312 E318	S195-Y314 WeakPolarHBondContact O-CE1 3.32Å; S195-Y314 PolarHBondContact O-OH 3.01Å; S195-Y314 PolarHBondContact OG-OH 3.37Å; H196-Y314 WeakPolarHBondContact O-CE1 3.21Å; N197-Y314 VanDerWaalsContact C-CE1 3.48Å; A198-Y314 HydrophobicContact CB-CD1 3.92Å; A198-Y314 HydrophobicContact CB-CD2 4.11Å; A198-Y314 HydrophobicContact CB-CE1 4.21Å; A198-Y314 HydrophobicContact CB-CE2 4.36Å; A198-Y314 HydrophobicContact CB-CG 3.88Å; F211-Y314 HydrophobicContact CB-CE2 4.03Å; F211-Y314 HydrophobicContact CG-CE2 4.32Å; I293-Y314 PolarHBondContact N-O 3.19Å; I293-Y314 PolarHBondContact O-N 2.72Å; I295-Y314 HydrophobicContact CG1-CD2 3.94Å; I295-Y314 HydrophobicContact CG1-CE2 3.62Å; T312-Y314 HydrophobicContact CG2-CE2 3.98Å; Y314-E318 WeakPolarHBondContact CA-OE2 3.09Å
315	L	94.9	Very high	94.9	Very high	29 Å²	29	40.2 Å²	40.2	15%	0.152	22%	0.217	C	C	.	.			trans	-75	162.6	166.6	-62.2	176.8	0	0	0	109.8	R44 E292 S317 E318 V319	R44-L315 HydrophobicContact CG-CD2 4.34Å; E292-L315 HydrophobicContact CB-CD2 4.24Å; E292-L315 HydrophobicContact CG-CD2 4.13Å; L315-S317 PolarHBondContact O-N 3.46Å; L315-E318 HydrophobicContact CB-CG 4.14Å; L315-E318 PolarHBondContact N-OE2 2.91Å; L315-E318 WeakPolarHBondContact O-CA 3.46Å; L315-E318 WeakPolarHBondContact O-CB 3.33Å; L315-E318 PolarHBondContact O-N 2.6Å; L315-V319 PolarHBondContact O-N 2.91Å
316	P	94.1	Very high	95.1	Very high	16 Å²	16	39.3 Å²	39.3	10%	0.104	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-61.3	-35.7	-177.8	-22.2	37.4	0	0	0	111.1	L286 S289 F291 E318 V319	L286-P316 HydrophobicContact CD1-CB 4.15Å; L286-P316 VanDerWaalsContact O-CB 3.28Å; L286-P316 WeakPolarHBondContact O-CB 3.25Å; S289-P316 WeakPolarHBondContact O-CG 3.3Å; F291-P316 HydrophobicContact CD1-CG 4.22Å; F291-P316 HydrophobicContact CD2-CG 4.22Å; F291-P316 HydrophobicContact CE1-CB 4.39Å; F291-P316 HydrophobicContact CE1-CG 4.23Å; F291-P316 HydrophobicContact CE2-CG 4.21Å; F291-P316 HydrophobicContact CG-CG 4.22Å; F291-P316 HydrophobicContact CZ-CB 4.25Å; F291-P316 HydrophobicContact CZ-CG 4.23Å; F291-P316 WeakPolarHBondContact O-CD 3.32Å; F291-P316 WeakPolarHBondContact O-CG 3.25Å; P316-E318 PolarHBondContact O-N 2.91Å; P316-V319 PolarHBondContact O-N 3.15Å
317	S	93	Very high	95.3	Very high	91 Å²	91	40 Å²	40	64%	0.636	21%	0.21	S	C	*	.	G	3₁₀ helix	trans	-65.9	-14.4	173.2	61.8	0	0	0	0	115	L315	L315-S317 PolarHBondContact O-N 3.46Å
318	E	95.4	Very high	95.4	Very high	36 Å²	36	34.9 Å²	34.9	17%	0.168	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-101.4	-3.8	179.2	-57.9	176.6	142.1	0	0	112.3	R44 K48 N197 A198 Y314 L315 P316	R44-E318 IonicContact CZ-OE1 3.33Å; R44-E318 IonicContact CZ-OE2 3Å; R44-E318 IonicContact NH1-OE1 3.82Å; R44-E318 IonicContact NH1-OE2 2.82Å; R44-E318 PolarHBondContact NH1-OE2 3.18Å; R44-E318 VanDerWaalsContact NH2-CD 3.27Å; R44-E318 IonicContact NH2-OE1 3.73Å; R44-E318 PolarHBondContact NH2-OE1 3.32Å; R44-E318 IonicContact NH2-OE2 3.93Å; R44-E318 PolarHBondContact NH2-OE2 3.42Å; K48-E318 WeakPolarHBondContact CE-OE1 3.42Å; K48-E318 WeakPolarHBondContact CE-OE2 3.43Å; K48-E318 VanDerWaalsContact NZ-CD 3.26Å; K48-E318 IonicContact NZ-OE1 3.77Å; K48-E318 IonicContact NZ-OE2 2.76Å; K48-E318 PolarHBondContact NZ-OE2 2.95Å; N197-E318 VanDerWaalsContact CA-O 3.27Å; N197-E318 WeakPolarHBondContact CA-O 3.49Å; N197-E318 VanDerWaalsContact CB-O 3.31Å; N197-E318 WeakPolarHBondContact CB-O 3.37Å; N197-E318 PolarHBondContact ND2-O 2.93Å; A198-E318 PolarHBondContact N-O 3.35Å; Y314-E318 WeakPolarHBondContact CA-OE2 3.09Å; L315-E318 HydrophobicContact CB-CG 4.14Å; L315-E318 PolarHBondContact N-OE2 2.91Å; L315-E318 WeakPolarHBondContact O-CA 3.46Å; L315-E318 WeakPolarHBondContact O-CB 3.33Å; L315-E318 PolarHBondContact O-N 2.6Å; P316-E318 PolarHBondContact O-N 2.91Å
319	V	96.6	Very high	95.4	Very high	8 Å²	8	37.9 Å²	37.9	5%	0.048	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	117.4	173.3	-176.2	0	0	0	0	108.5	A198 I200 L209 L286 L315 P316	A198-V319 HydrophobicContact CB-CG2 4.32Å; A198-V319 CarbonylContact O-C 3.57Å; A198-V319 WeakPolarHBondContact O-CA 3.48Å; I200-V319 HydrophobicContact CD1-CG1 3.66Å; I200-V319 HydrophobicContact CG1-CG1 3.74Å; L209-V319 HydrophobicContact CD1-CG1 3.86Å; L286-V319 HydrophobicContact CD1-CB 4.33Å; L286-V319 HydrophobicContact CD2-CB 4.07Å; L286-V319 HydrophobicContact CD2-CG1 3.96Å; L315-V319 PolarHBondContact O-N 2.91Å; P316-V319 PolarHBondContact O-N 3.15Å
320	L	96.8	Very high	95.4	Very high	44 Å²	44	38.6 Å²	38.6	23%	0.23	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	113.3	-177.1	-56.5	176.6	0	0	0	110.5	N197 A198 V199 I200 H323	N197-L320 HydrophobicContact CB-CD1 3.83Å; N197-L320 HydrophobicContact CB-CG 4.04Å; A198-L320 PolarHBondContact O-N 3.04Å; V199-L320 CarbonylContact C-O 3.55Å; V199-L320 VanDerWaalsContact CA-O 3.29Å; V199-L320 WeakPolarHBondContact CA-O 3.16Å; V199-L320 HydrophobicContact CG1-CB 4.28Å; I200-L320 PolarHBondContact N-O 2.9Å; L320-H323 HydrophobicContact CB-CB 3.88Å
321	W	96.8	Very high	95.3	Very high	19 Å²	19	45.6 Å²	45.6	7%	0.072	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	130.3	177.8	-167.3	-70.3	0	0	0	112.2	I200 L207 I281 K283 L286 P353 C355	I200-W321 HydrophobicContact CB-CD2 4.41Å; I200-W321 HydrophobicContact CB-CE3 4.23Å; I200-W321 HydrophobicContact CD1-CE3 3.8Å; I200-W321 HydrophobicContact CD1-CZ3 3.92Å; I200-W321 HydrophobicContact CG2-CD2 4.19Å; I200-W321 HydrophobicContact CG2-CE3 4.06Å; I200-W321 HydrophobicContact CG2-CH2 4.31Å; I200-W321 HydrophobicContact CG2-CZ2 4.42Å; I200-W321 HydrophobicContact CG2-CZ3 4.13Å; L207-W321 HydrophobicContact CD1-CZ2 4.48Å; L207-W321 HydrophobicContact CD2-CH2 3.84Å; L207-W321 HydrophobicContact CD2-CZ2 4Å; I281-W321 WeakPolarHBondContact O-CH2 3.43Å; K283-W321 HydrophobicContact CB-CB 4.43Å; K283-W321 HydrophobicContact CB-CD2 3.7Å; K283-W321 HydrophobicContact CB-CE3 4.16Å; K283-W321 HydrophobicContact CB-CG 3.79Å; K283-W321 HydrophobicContact CB-CZ2 4.5Å; K283-W321 HydrophobicContact CD-CB 4.07Å; K283-W321 HydrophobicContact CD-CG 3.92Å; K283-W321 HydrophobicContact CG-CB 3.88Å; K283-W321 HydrophobicContact CG-CD2 4.15Å; K283-W321 HydrophobicContact CG-CG 3.73Å; L286-W321 HydrophobicContact CD2-CB 4.48Å; L286-W321 HydrophobicContact CD2-CE3 4.03Å; W321-P353 PolarHBondContact NE1-O 3Å; W321-C355 WeakPolarHBondContact CZ2-O 3.33Å
322	G	95.8	Very high	95	Very high	7 Å²	7	47 Å²	47	7%	0.072	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.4	28	179.7	0	0	0	0	0	112.9	I200 V349	I200-G322 WeakPolarHBondContact O-CA 3.29Å; I200-G322 PolarHBondContact O-N 3.36Å; G322-V349 PolarHBondContact O-N 3.25Å
323	H	97	Very high	94.6	Very high	33 Å²	33	58.9 Å²	58.9	15%	0.153	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	150.7	175.2	-79.9	-124.6	0	0	0	110.7	V199 A201 L320 T346 F347 E348	V199-H323 HydrophobicContact CB-CB 4.05Å; V199-H323 WeakPolarHBondContact CB-O 3.33Å; V199-H323 HydrophobicContact CG1-CB 3.78Å; V199-H323 WeakPolarHBondContact CG2-O 3.4Å; A201-H323 WeakPolarHBondContact CB-O 3.34Å; L320-H323 HydrophobicContact CB-CB 3.88Å; H323-T346 PolarHBondContact ND1-OG1 3.06Å; H323-F347 CarbonylContact C-O 3.58Å; H323-F347 WeakPolarHBondContact CA-O 3.43Å; H323-E348 VanDerWaalsContact CE1-CG 3.5Å; H323-E348 WeakPolarHBondContact CE1-CG 3.1Å; H323-E348 VanDerWaalsContact NE2-CG 3.31Å; H323-E348 WeakPolarHBondContact NE2-CG 3.46Å; H323-E348 IonicContact NE2-OE1 3.56Å
324	R	96.8	Very high	94.3	Very high	122 Å²	122	64.3 Å²	64.3	46%	0.46	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	152.4	168.1	-74.9	176.7	69.5	-174.1	-0.8	109.7	A201 T346 F347 V349	A201-R324 HydrophobicContact CB-CG 3.78Å; R324-T346 CarbonylContact O-C 3.57Å; R324-T346 WeakPolarHBondContact O-CA 3.26Å; R324-T346 WeakPolarHBondContact O-CB 3.45Å; R324-F347 HydrophobicContact CB-CD1 4.45Å; R324-F347 HydrophobicContact CB-CE1 3.81Å; R324-F347 HydrophobicContact CB-CE2 4.05Å; R324-F347 HydrophobicContact CB-CZ 3.59Å; R324-F347 PolarHBondContact N-O 2.72Å; R324-F347 WeakPolarHBondContact O-CD1 3.31Å; R324-F347 PolarHBondContact O-N 3.05Å; R324-V349 HydrophobicContact CB-CG2 4.02Å; R324-V349 HydrophobicContact CG-CG2 3.74Å
325	F	97.3	Very high	94	Very high	18 Å²	18	71.6 Å²	71.6	8%	0.079	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	140.9	176.5	-67	-74.8	0	0	0	112	N197 V199 M210 R212 T267 T346 F347	N197-F325 WeakPolarHBondContact O-CZ 3.49Å; V199-F325 HydrophobicContact CG1-CE1 4.3Å; V199-F325 HydrophobicContact CG1-CE2 4.29Å; V199-F325 HydrophobicContact CG1-CZ 4.05Å; V199-F325 HydrophobicContact CG2-CD2 3.88Å; V199-F325 HydrophobicContact CG2-CE2 3.59Å; V199-F325 HydrophobicContact CG2-CZ 4.16Å; M210-F325 HydrophobicContact CB-CE2 4.23Å; R212-F325 HydrophobicContact CG-CD1 4.27Å; R212-F325 HydrophobicContact CG-CD2 3.95Å; R212-F325 HydrophobicContact CG-CE1 4.37Å; R212-F325 HydrophobicContact CG-CE2 4.03Å; R212-F325 HydrophobicContact CG-CG 4.08Å; R212-F325 HydrophobicContact CG-CZ 4.26Å; R212-F325 VanDerWaalsContact NH2-CB 3.32Å; T267-F325 HydrophobicContact CG2-CD2 4.01Å; T267-F325 HydrophobicContact CG2-CE2 4.23Å; F325-T346 HydrophobicContact CD1-CG2 3.59Å; F325-T346 HydrophobicContact CE1-CG2 3.8Å; F325-T346 HydrophobicContact CG-CG2 4.37Å; F325-F347 WeakPolarHBondContact O-CE1 3.42Å
326	E	96	Very high	93.8	Very high	55 Å²	55	78.4 Å²	78.4	26%	0.257	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-67.5	137.4	174	-73	-171.4	-139.1	0	0	111.3	R212 V328 Y342 K345 F347	R212-E326 PolarHBondContact NH1-O 3.35Å; R212-E326 PolarHBondContact NH2-O 2.97Å; E326-V328 PolarHBondContact O-N 3.31Å; E326-Y342 WeakPolarHBondContact OE2-CD1 3.37Å; E326-Y342 WeakPolarHBondContact OE2-CE1 3.4Å; E326-K345 HydrophobicContact CB-CB 4.39Å; E326-K345 HydrophobicContact CG-CB 4.2Å; E326-K345 PolarHBondContact N-O 3.25Å; E326-K345 VanDerWaalsContact N-O 3.11Å; E326-K345 WeakPolarHBondContact OE1-CB 3.49Å; E326-F347 HydrophobicContact CG-CD1 3.83Å
327	P	94.3	Very high	93.7	Very high	86 Å²	86	83.8 Å²	83.8	56%	0.558	40%	0.397	S	S	*	.	P	Polyproline II helix	trans	-56	135.6	175.3	-23.2	33.3	0	0	0	112	F330	P327-F330 VanDerWaalsContact O-CZ 3.32Å; P327-F330 WeakPolarHBondContact O-CZ 3.49Å
328	V	94.1	Very high	93.6	Very high	5 Å²	5	82 Å²	82	3%	0.03	38%	0.38	C	S	.	.			trans	-112	-15.8	-179	-65.7	0	0	0	0	113.6	R212 P265 E326 I338 D339 F343	R212-V328 VanDerWaalsContact NH1-CG1 3.3Å; P265-V328 HydrophobicContact CB-CG2 3.79Å; P265-V328 HydrophobicContact CG-CG2 3.91Å; E326-V328 PolarHBondContact O-N 3.31Å; V328-I338 WeakPolarHBondContact O-CA 3.27Å; V328-D339 PolarHBondContact O-N 2.93Å; V328-F343 HydrophobicContact CG1-CB 4.47Å
329	I	92.7	Very high	93.5	Very high	74 Å²	74	82.6 Å²	82.6	38%	0.379	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	122.7	-177.5	-53.7	175.6	0	0	0	107.3	A264 Y336 I338	A264-I329 HydrophobicContact CB-CD1 3.69Å; A264-I329 HydrophobicContact CB-CG1 4.37Å; I329-Y336 HydrophobicContact CG2-CD1 3.89Å; I329-Y336 HydrophobicContact CG2-CG 4.41Å; I329-I338 HydrophobicContact CG1-CG1 4.49Å
330	F	92	Very high	93.3	Very high	86 Å²	86	85.9 Å²	85.9	38%	0.377	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	137.8	176.4	-55.1	-79.3	0	0	0	109.1	P327 R337 D339	P327-F330 VanDerWaalsContact O-CZ 3.32Å; P327-F330 WeakPolarHBondContact O-CZ 3.49Å; F330-R337 PolarHBondContact N-O 3.46Å; F330-R337 PolarHBondContact O-N 3.42Å; F330-D339 HydrophobicContact CD2-CB 4.44Å; F330-D339 HydrophobicContact CE2-CB 4.07Å
331	E	92.4	Very high	93.2	Very high	151 Å²	151	87 Å²	87	71%	0.706	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.9	124.7	175.1	-171.9	176.3	-173.2	0	0	109.6	Y336	E331-Y336 HydrophobicContact CB-CD1 4.41Å; E331-Y336 HydrophobicContact CB-CE1 4.31Å; E331-Y336 HydrophobicContact CG-CE1 4.31Å
332	E	90.8	Very high	93	Very high	104 Å²	104	89.8 Å²	89.8	49%	0.486	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	96.7	178.7	-170.8	164.6	-165	0	0	109.6	S334 Q335 R337	E332-S334 PolarHBondContact O-N 3.27Å; E332-Q335 CarbonylContact C-O 3.56Å; E332-Q335 PolarHBondContact N-O 3.05Å; E332-Q335 PolarHBondContact O-N 2.97Å; E332-Q335 VanDerWaalsContact O-O 3.12Å; E332-R337 IonicContact OE1-NH1 3.88Å; E332-R337 WeakPolarHBondContact OE2-CD 3.25Å; E332-R337 IonicContact OE2-CZ 2.8Å; E332-R337 IonicContact OE2-NE 2.67Å; E332-R337 IonicContact OE2-NH1 3.63Å; E332-R337 PolarHBondContact OE2-NH1 2.76Å
333	R	88	Confident	93	Very high	252 Å²	252	89.5 Å²	89.5	95%	0.951	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	-67.9	179.8	-62.7	-178	-178.6	176.1	0.6	115.9
334	S	89.3	Confident	93	Very high	115 Å²	115	90.6 Å²	90.6	80%	0.804	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.6	3.1	-174.9	-175.2	0	0	0	0	113.1	E332	E332-S334 PolarHBondContact O-N 3.27Å
335	Q	90	Very high	93	Very high	152 Å²	152	89.1 Å²	89.1	71%	0.71	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141	154.3	-179.6	-62.9	-177.6	6.5	0	0	110.6	E332	E332-Q335 CarbonylContact C-O 3.56Å; E332-Q335 PolarHBondContact N-O 3.05Å; E332-Q335 PolarHBondContact O-N 2.97Å; E332-Q335 VanDerWaalsContact O-O 3.12Å
336	Y	91.1	Very high	93	Very high	173 Å²	173	89.9 Å²	89.9	68%	0.678	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.6	126.1	170.7	-65.7	-79.5	0	0	0	109.8	I329 E331	I329-Y336 HydrophobicContact CG2-CD1 3.89Å; I329-Y336 HydrophobicContact CG2-CG 4.41Å; E331-Y336 HydrophobicContact CB-CD1 4.41Å; E331-Y336 HydrophobicContact CB-CE1 4.31Å; E331-Y336 HydrophobicContact CG-CE1 4.31Å
337	R	90.8	Very high	93	Very high	128 Å²	128	91.3 Å²	91.3	48%	0.483	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	132.6	172.2	-167.4	175.3	84.2	-160.8	12.3	109.9	F330 E332	F330-R337 PolarHBondContact N-O 3.46Å; F330-R337 PolarHBondContact O-N 3.42Å; E332-R337 IonicContact OE1-NH1 3.88Å; E332-R337 WeakPolarHBondContact OE2-CD 3.25Å; E332-R337 IonicContact OE2-CZ 2.8Å; E332-R337 IonicContact OE2-NE 2.67Å; E332-R337 IonicContact OE2-NH1 3.63Å; E332-R337 PolarHBondContact OE2-NH1 2.76Å
338	I	92.7	Very high	93.1	Very high	53 Å²	53	94 Å²	94	27%	0.272	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	119.3	177.1	-57.6	167.5	0	0	0	108.3	A264 P265 V328 I329 Y340	A264-I338 HydrophobicContact CB-CD1 3.79Å; P265-I338 HydrophobicContact CG-CG2 3.78Å; V328-I338 WeakPolarHBondContact O-CA 3.27Å; I329-I338 HydrophobicContact CG1-CG1 4.49Å; I338-Y340 HydrophobicContact CB-CE2 4.46Å; I338-Y340 HydrophobicContact CG2-CD2 4.15Å; I338-Y340 HydrophobicContact CG2-CE2 3.81Å
339	D	93.1	Very high	93.1	Very high	49 Å²	49	94.9 Å²	94.9	26%	0.262	44%	0.444	S	S	.	.			trans	-101.9	106.3	175.6	-168.1	-16.7	0	0	0	110.9	V328 F330 A341 Y342	V328-D339 PolarHBondContact O-N 2.93Å; F330-D339 HydrophobicContact CD2-CB 4.44Å; F330-D339 HydrophobicContact CE2-CB 4.07Å; D339-A341 PolarHBondContact O-N 2.82Å; D339-A341 WeakPolarHBondContact OD1-CB 3.37Å; D339-A341 PolarHBondContact OD1-N 3.35Å; D339-Y342 HydrophobicContact CB-CD2 3.96Å; D339-Y342 PolarHBondContact O-N 3.23Å; D339-Y342 WeakPolarHBondContact OD2-CE2 3.16Å
340	Y	92.3	Very high	93.1	Very high	78 Å²	78	97.4 Å²	97.4	31%	0.306	47%	0.465	S	S	.	.	G	3₁₀ helix	trans	-72.8	-12.3	-179.9	-77.8	-82	0	0	0	113.8	A214 N215 L216 P265 I338 Y342 F343	A214-Y340 HydrophobicContact CB-CE1 3.84Å; N215-Y340 PolarHBondContact O-OH 3.47Å; N215-Y340 VanDerWaalsContact O-OH 3.1Å; L216-Y340 HydrophobicContact CD2-CD1 3.99Å; L216-Y340 HydrophobicContact CD2-CE1 3.67Å; P265-Y340 HydrophobicContact CG-CE1 3.98Å; I338-Y340 HydrophobicContact CB-CE2 4.46Å; I338-Y340 HydrophobicContact CG2-CD2 4.15Å; I338-Y340 HydrophobicContact CG2-CE2 3.81Å; Y340-Y342 PolarHBondContact O-N 3.26Å; Y340-F343 HydrophobicContact CD1-CB 4.16Å; Y340-F343 HydrophobicContact CD1-CD2 4.31Å; Y340-F343 HydrophobicContact CD1-CG 4.28Å; Y340-F343 HydrophobicContact CE1-CD2 4.44Å; Y340-F343 VanDerWaalsContact O-CB 3.22Å; Y340-F343 WeakPolarHBondContact O-CB 3.29Å; Y340-F343 PolarHBondContact O-N 3.46Å; Y340-F343 VanDerWaalsContact O-N 3.1Å
341	A	93.1	Very high	93.1	Very high	66 Å²	66	98.3 Å²	98.3	55%	0.545	48%	0.482	S	S	.	.	G	3₁₀ helix	trans	-64.3	-26	174.4	0	0	0	0	0	112.3	D339 K345	D339-A341 PolarHBondContact O-N 2.82Å; D339-A341 WeakPolarHBondContact OD1-CB 3.37Å; D339-A341 PolarHBondContact OD1-N 3.35Å; A341-K345 WeakPolarHBondContact O-CE 3.41Å
342	Y	94.2	Very high	93.1	Very high	79 Å²	79	91.6 Å²	91.6	31%	0.31	45%	0.451	S	S	.	.	G	3₁₀ helix	trans	-94.4	-1.3	177	-62.5	-79.1	0	0	0	113.1	E326 D339 Y340 H344 K345	E326-Y342 WeakPolarHBondContact OE2-CD1 3.37Å; E326-Y342 WeakPolarHBondContact OE2-CE1 3.4Å; D339-Y342 HydrophobicContact CB-CD2 3.96Å; D339-Y342 PolarHBondContact O-N 3.23Å; D339-Y342 WeakPolarHBondContact OD2-CE2 3.16Å; Y340-Y342 PolarHBondContact O-N 3.26Å; Y342-H344 PolarHBondContact O-N 2.96Å; Y342-K345 HydrophobicContact CD1-CD 3.71Å; Y342-K345 HydrophobicContact CE1-CD 4.19Å; Y342-K345 PolarHBondContact O-N 2.86Å
343	F	95.4	Very high	93.2	Very high	0 Å²	0	88.6 Å²	88.6	0%	0	44%	0.441	C	S	.	.	S	Bend	trans	-60.1	-45.2	-173.4	178	-96.3	0	0	0	112.8	L193 R212 A214 P265 V328 Y340	L193-F343 HydrophobicContact CB-CE1 4.43Å; L193-F343 HydrophobicContact CD2-CD1 3.61Å; L193-F343 HydrophobicContact CD2-CE1 3.57Å; L193-F343 HydrophobicContact CD2-CG 4.3Å; L193-F343 HydrophobicContact CD2-CZ 4.24Å; L193-F343 HydrophobicContact CG-CD1 4.2Å; L193-F343 HydrophobicContact CG-CE1 3.65Å; L193-F343 HydrophobicContact CG-CZ 4.2Å; R212-F343 HydrophobicContact CB-CE2 3.73Å; R212-F343 HydrophobicContact CB-CZ 3.71Å; R212-F343 PolarHBondContact NH1-O 3.48Å; A214-F343 HydrophobicContact CB-CD2 4.2Å; A214-F343 HydrophobicContact CB-CE2 3.48Å; A214-F343 VanDerWaalsContact CB-CE2 3.48Å; A214-F343 HydrophobicContact CB-CZ 3.94Å; P265-F343 HydrophobicContact CB-CD2 3.96Å; P265-F343 HydrophobicContact CB-CE2 3.9Å; P265-F343 HydrophobicContact CG-CD2 4.13Å; P265-F343 HydrophobicContact CG-CE2 4.37Å; V328-F343 HydrophobicContact CG1-CB 4.47Å; Y340-F343 HydrophobicContact CD1-CB 4.16Å; Y340-F343 HydrophobicContact CD1-CD2 4.31Å; Y340-F343 HydrophobicContact CD1-CG 4.28Å; Y340-F343 HydrophobicContact CE1-CD2 4.44Å; Y340-F343 VanDerWaalsContact O-CB 3.22Å; Y340-F343 WeakPolarHBondContact O-CB 3.29Å; Y340-F343 PolarHBondContact O-N 3.46Å; Y340-F343 VanDerWaalsContact O-N 3.1Å
344	H	96.5	Very high	93.4	Very high	56 Å²	56	85.3 Å²	85.3	26%	0.259	43%	0.428	S	S	.	.	S	Bend	trans	-89	-10	179.3	-55	-75.7	0	0	0	113.5	F194 H196 Y342	F194-H344 PolarHBondContact O-CE1 3.5Å; H196-H344 AromaticContact CD2-CD2 3.87Å; H196-H344 AromaticContact CD2-CE1 3.58Å; H196-H344 AromaticContact CD2-CG 3.4Å; H196-H344 VanDerWaalsContact CD2-CG 3.4Å; H196-H344 AromaticContact CD2-ND1 3.21Å; H196-H344 PolarHBondContact CD2-ND1 3.43Å; H196-H344 AromaticContact CD2-NE2 3.99Å; H196-H344 AromaticContact CG-ND1 3.73Å; H196-H344 PolarHBondContact N-ND1 3.26Å; H196-H344 AromaticContact NE2-CE1 3.63Å; H196-H344 AromaticContact NE2-ND1 3.77Å; H196-H344 AromaticContact NE2-NE2 3.82Å; Y342-H344 PolarHBondContact O-N 2.96Å
345	K	96.5	Very high	93.5	Very high	92 Å²	92	81 Å²	81	40%	0.4	40%	0.397	S	S	.	.			trans	-76.1	141.8	-174.2	-68.7	-172.5	-176.1	174.3	0	111.3	E326 A341 Y342	E326-K345 HydrophobicContact CB-CB 4.39Å; E326-K345 HydrophobicContact CG-CB 4.2Å; E326-K345 PolarHBondContact N-O 3.25Å; E326-K345 VanDerWaalsContact N-O 3.11Å; E326-K345 WeakPolarHBondContact OE1-CB 3.49Å; A341-K345 WeakPolarHBondContact O-CE 3.41Å; Y342-K345 HydrophobicContact CD1-CD 3.71Å; Y342-K345 HydrophobicContact CE1-CD 4.19Å; Y342-K345 PolarHBondContact O-N 2.86Å
346	T	97.3	Very high	93.7	Very high	34 Å²	34	73.9 Å²	73.9	21%	0.209	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	151.8	178	66.2	0	0	0	0	109.5	V199 H323 R324 F325	V199-T346 HydrophobicContact CG1-CG2 3.71Å; H323-T346 PolarHBondContact ND1-OG1 3.06Å; R324-T346 CarbonylContact O-C 3.57Å; R324-T346 WeakPolarHBondContact O-CA 3.26Å; R324-T346 WeakPolarHBondContact O-CB 3.45Å; F325-T346 HydrophobicContact CD1-CG2 3.59Å; F325-T346 HydrophobicContact CE1-CG2 3.8Å; F325-T346 HydrophobicContact CG-CG2 4.37Å
347	F	96.7	Very high	93.7	Very high	84 Å²	84	65.9 Å²	65.9	37%	0.368	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	148.1	174.7	65	-87.6	0	0	0	110.1	H323 R324 F325 E326 V349	H323-F347 CarbonylContact C-O 3.58Å; H323-F347 WeakPolarHBondContact CA-O 3.43Å; R324-F347 HydrophobicContact CB-CD1 4.45Å; R324-F347 HydrophobicContact CB-CE1 3.81Å; R324-F347 HydrophobicContact CB-CE2 4.05Å; R324-F347 HydrophobicContact CB-CZ 3.59Å; R324-F347 PolarHBondContact N-O 2.72Å; R324-F347 WeakPolarHBondContact O-CD1 3.31Å; R324-F347 PolarHBondContact O-N 3.05Å; F325-F347 WeakPolarHBondContact O-CE1 3.42Å; E326-F347 HydrophobicContact CG-CD1 3.83Å; F347-V349 HydrophobicContact CD2-CG2 4.02Å; F347-V349 HydrophobicContact CE2-CG2 3.7Å
348	E	96	Very high	93.8	Very high	143 Å²	143	64.2 Å²	64.2	67%	0.668	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74	142.3	179.3	-75.1	-178.2	-159.2	0	0	111.7	H323	H323-E348 VanDerWaalsContact CE1-CG 3.5Å; H323-E348 WeakPolarHBondContact CE1-CG 3.1Å; H323-E348 VanDerWaalsContact NE2-CG 3.31Å; H323-E348 WeakPolarHBondContact NE2-CG 3.46Å; H323-E348 IonicContact NE2-OE1 3.56Å
349	V	95.3	Very high	93.7	Very high	23 Å²	23	64.4 Å²	64.4	14%	0.139	33%	0.332	C	S	.	.			trans	-124.8	90.3	178.4	-176.7	0	0	0	0	107.9	G322 R324 F347 S351 T352	G322-V349 PolarHBondContact O-N 3.25Å; R324-V349 HydrophobicContact CB-CG2 4.02Å; R324-V349 HydrophobicContact CG-CG2 3.74Å; F347-V349 HydrophobicContact CD2-CG2 4.02Å; F347-V349 HydrophobicContact CE2-CG2 3.7Å; V349-S351 VanDerWaalsContact CG1-OG 3.29Å; V349-S351 WeakPolarHBondContact CG1-OG 3.5Å; V349-S351 PolarHBondContact O-N 3.26Å; V349-S351 VanDerWaalsContact O-N 3.09Å; V349-T352 WeakPolarHBondContact O-CB 3.4Å; V349-T352 PolarHBondContact O-N 3.26Å; V349-T352 VanDerWaalsContact O-N 3.1Å; V349-T352 PolarHBondContact O-OG1 3.13Å
350	P	91.6	Very high	93.5	Very high	128 Å²	128	63.5 Å²	63.5	83%	0.831	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-21.9	-174.8	-25.6	35.1	0	0	0	114.4	T352	P350-T352 PolarHBondContact O-N 2.78Å
351	S	92	Very high	93.3	Very high	104 Å²	104	62.8 Å²	62.8	73%	0.727	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-7.8	178.5	56.3	0	0	0	0	114.2	V349 P353	V349-S351 VanDerWaalsContact CG1-OG 3.29Å; V349-S351 WeakPolarHBondContact CG1-OG 3.5Å; V349-S351 PolarHBondContact O-N 3.26Å; V349-S351 VanDerWaalsContact O-N 3.09Å; S351-P353 WeakPolarHBondContact O-CD 3.37Å
352	T	92.5	Very high	93.1	Very high	11 Å²	11	64.7 Å²	64.7	7%	0.067	32%	0.324	C	S	.	.	S	Bend	trans	-69.9	125.1	179.8	-49.4	0	0	0	0	110.1	M202 L207 V349 P350	M202-T352 HydrophobicContact CG-CG2 4.33Å; L207-T352 HydrophobicContact CD1-CG2 4.31Å; V349-T352 WeakPolarHBondContact O-CB 3.4Å; V349-T352 PolarHBondContact O-N 3.26Å; V349-T352 VanDerWaalsContact O-N 3.1Å; V349-T352 PolarHBondContact O-OG1 3.13Å; P350-T352 PolarHBondContact O-N 2.78Å
353	P	92.6	Very high	92.5	Very high	40 Å²	40	69.8 Å²	69.8	26%	0.26	34%	0.343	S	S	.	.			trans	-55.9	146	173.9	-24.5	35.3	0	0	0	111.4	M202 W321 S351 M360	M202-P353 HydrophobicContact CG-CG 4.36Å; M202-P353 HydrophobicContact SD-CG 4.4Å; W321-P353 PolarHBondContact NE1-O 3Å; S351-P353 WeakPolarHBondContact O-CD 3.37Å; P353-M360 HydrophobicContact CB-CE 4.42Å; P353-M360 HydrophobicContact CB-CG 4.5Å; P353-M360 HydrophobicContact CB-SD 3.8Å; P353-M360 HydrophobicContact CG-CE 3.87Å; P353-M360 HydrophobicContact CG-SD 3.89Å
354	R	92.1	Very high	91.7	Very high	184 Å²	184	75.9 Å²	75.9	69%	0.694	37%	0.369	S	S	*	.			trans	-96.7	-11.5	178.9	-63.1	-176.3	-179.6	-177.3	0.4	113.6	K283	K283-R354 HydrophobicContact CB-CB 4.24Å; K283-R354 WeakPolarHBondContact CB-O 3.39Å; K283-R354 HydrophobicContact CD-CG 4.15Å; K283-R354 PolarHBondContact N-O 3.05Å
355	C	92.1	Very high	90.3	Very high	23 Å²	23	81 Å²	81	16%	0.155	39%	0.391	C	S	.	.	S	Bend	trans	-78.1	165.6	177	56.3	0	0	0	0	111.2	W321 D359 M360	W321-C355 WeakPolarHBondContact CZ2-O 3.33Å; C355-D359 HydrophobicContact CB-CB 3.84Å; C355-M360 WeakPolarHBondContact SG-CG 3.3Å
356	S	93.5	Very high	88.4	Confident	4 Å²	4	81.4 Å²	81.4	3%	0.028	40%	0.403	C	S	.	.			trans	-68.5	165.4	177.2	68.3	0	0	0	0	111.5	K358 D359 M360	S356-K358 VanDerWaalsContact C-N 3.26Å; S356-K358 PolarHBondContact O-N 3.46Å; S356-D359 PolarHBondContact N-OD2 2.93Å; S356-D359 PolarHBondContact O-N 3.46Å; S356-D359 PolarHBondContact OG-N 3.06Å; S356-D359 VanDerWaalsContact OG-N 3.12Å; S356-D359 PolarHBondContact OG-OD2 2.97Å; S356-M360 WeakPolarHBondContact O-CG 3.45Å; S356-M360 PolarHBondContact O-N 3.12Å
357	A	92	Very high	86.2	Confident	5 Å²	5	85.9 Å²	85.9	4%	0.041	43%	0.431	C	S	.	.	H	α-helix	trans	-62.3	-38.7	173.8	0	0	0	0	0	111	L207 I272 F279 D359 M360 E361	L207-A357 HydrophobicContact CD2-CB 4.24Å; I272-A357 HydrophobicContact CB-CB 4.27Å; I272-A357 HydrophobicContact CG2-CB 3.64Å; F279-A357 HydrophobicContact CD2-CB 3.75Å; F279-A357 HydrophobicContact CE2-CB 4.07Å; F279-A357 PolarHBondContact O-N 3.02Å; A357-D359 PolarHBondContact O-N 2.03Å; A357-M360 WeakPolarHBondContact O-CB 3.49Å; A357-M360 PolarHBondContact O-N 3.24Å; A357-M360 VanDerWaalsContact O-N 3.09Å; A357-E361 PolarHBondContact O-N 2.89Å
358	K	92.4	Very high	83.8	Confident	93 Å²	93	88.4 Å²	88.4	40%	0.404	46%	0.458	S	S	.	.	H	α-helix	trans	-54.9	-51.6	173	-176.2	174.7	174	177.2	0	112.8	F279 S356 M360 E361 E362	F279-K358 HydrophobicContact CD1-CB 3.78Å; F279-K358 HydrophobicContact CD1-CD 4.35Å; F279-K358 HydrophobicContact CD1-CG 4.21Å; F279-K358 HydrophobicContact CE1-CB 3.51Å; F279-K358 HydrophobicContact CE1-CD 4.1Å; F279-K358 HydrophobicContact CE1-CG 3.64Å; F279-K358 HydrophobicContact CE2-CB 4.3Å; F279-K358 HydrophobicContact CG-CB 4.28Å; F279-K358 VanDerWaalsContact CZ-CA 3.47Å; F279-K358 HydrophobicContact CZ-CB 3.79Å; F279-K358 HydrophobicContact CZ-CG 4.13Å; F279-K358 PolarHBondContact O-N 3.42Å; S356-K358 VanDerWaalsContact C-N 3.26Å; S356-K358 PolarHBondContact O-N 3.46Å; K358-M360 PolarHBondContact O-N 2.9Å; K358-E361 PolarHBondContact O-N 2.7Å; K358-E361 VanDerWaalsContact O-N 3.13Å; K358-E362 WeakPolarHBondContact CE-OE1 3.03Å; K358-E362 IonicContact NZ-OE1 3.97Å; K358-E362 WeakPolarHBondContact O-CG 3.48Å; K358-E362 PolarHBondContact O-N 3.4Å
359	D	91.4	Very high	81.4	Confident	57 Å²	57	84.3 Å²	84.3	31%	0.305	46%	0.455	S	S	.	.	H	α-helix	trans	-61.6	-31.7	178.3	-57.9	-43.7	0	0	0	111.9	C355 S356 A357 R363	C355-D359 HydrophobicContact CB-CB 3.84Å; S356-D359 PolarHBondContact N-OD2 2.93Å; S356-D359 PolarHBondContact O-N 3.46Å; S356-D359 PolarHBondContact OG-N 3.06Å; S356-D359 VanDerWaalsContact OG-N 3.12Å; S356-D359 PolarHBondContact OG-OD2 2.97Å; A357-D359 PolarHBondContact O-N 2.03Å; D359-R363 WeakPolarHBondContact O-CB 3.08Å; D359-R363 WeakPolarHBondContact O-CD 3.17Å; D359-R363 WeakPolarHBondContact O-CG 3.48Å; D359-R363 PolarHBondContact O-N 3.13Å; D359-R363 VanDerWaalsContact O-N 3.11Å
360	M	88.7	Confident	78.9	Confident	29 Å²	29	87.8 Å²	87.8	14%	0.143	49%	0.486	C	S	.	.	H	α-helix	trans	-70.4	-37	177.8	-70.1	-178.1	58	0	0	112	M202 P353 C355 S356 A357 K358 K364	M202-M360 HydrophobicContact CE-CE 3.69Å; M202-M360 HydrophobicContact SD-CE 3.7Å; M202-M360 HydrophobicContact SD-SD 4.33Å; P353-M360 HydrophobicContact CB-CE 4.42Å; P353-M360 HydrophobicContact CB-CG 4.5Å; P353-M360 HydrophobicContact CB-SD 3.8Å; P353-M360 HydrophobicContact CG-CE 3.87Å; P353-M360 HydrophobicContact CG-SD 3.89Å; C355-M360 WeakPolarHBondContact SG-CG 3.3Å; S356-M360 WeakPolarHBondContact O-CG 3.45Å; S356-M360 PolarHBondContact O-N 3.12Å; A357-M360 WeakPolarHBondContact O-CB 3.49Å; A357-M360 PolarHBondContact O-N 3.24Å; A357-M360 VanDerWaalsContact O-N 3.09Å; K358-M360 PolarHBondContact O-N 2.9Å; M360-K364 WeakPolarHBondContact O-CG 3.42Å; M360-K364 PolarHBondContact O-N 3.27Å
361	E	87.9	Confident	76.5	Confident	64 Å²	64	88.3 Å²	88.3	30%	0.299	48%	0.482	S	S	.	.	H	α-helix	trans	-73.8	-43.7	176.6	-72.4	-173.4	166.5	0	0	111.9	F279 A357 K358 R363 K364 F365	F279-E361 VanDerWaalsContact CE2-OE2 3.29Å; F279-E361 WeakPolarHBondContact CE2-OE2 3.35Å; F279-E361 WeakPolarHBondContact CZ-OE2 3.3Å; A357-E361 PolarHBondContact O-N 2.89Å; K358-E361 PolarHBondContact O-N 2.7Å; K358-E361 VanDerWaalsContact O-N 3.13Å; E361-R363 PolarHBondContact O-N 3.35Å; E361-K364 WeakPolarHBondContact O-CB 3.45Å; E361-K364 PolarHBondContact O-N 3.02Å; E361-F365 PolarHBondContact O-N 3.41Å
362	E	88.4	Confident	74.1	Confident	105 Å²	105	88.4 Å²	88.4	49%	0.491	48%	0.483	S	S	.	.	H	α-helix	trans	-59.7	-34.3	174.7	-70.9	179.3	-178.9	0	0	112.1	K358 F365	K358-E362 WeakPolarHBondContact CE-OE1 3.03Å; K358-E362 IonicContact NZ-OE1 3.97Å; K358-E362 WeakPolarHBondContact O-CG 3.48Å; K358-E362 PolarHBondContact O-N 3.4Å; E362-F365 CarbonylContact O-C 3.51Å; E362-F365 VanDerWaalsContact O-O 3.07Å
363	R	82.8	Confident	71.4	Confident	187 Å²	187	95.6 Å²	95.6	71%	0.706	51%	0.513	S	S	*	.	H	α-helix	trans	-75.3	-27.9	174.8	-74.1	173.2	-171.7	-165.1	3.2	113.9	D359 E361	D359-R363 WeakPolarHBondContact O-CB 3.08Å; D359-R363 WeakPolarHBondContact O-CD 3.17Å; D359-R363 WeakPolarHBondContact O-CG 3.48Å; D359-R363 PolarHBondContact O-N 3.13Å; D359-R363 VanDerWaalsContact O-N 3.11Å; E361-R363 PolarHBondContact O-N 3.35Å
364	K	77.8	Confident	68.6	Low	128 Å²	128	99.1 Å²	99.1	56%	0.557	54%	0.537	S	S	*	.	H	α-helix	trans	-73.6	-34.6	174.7	-78.7	174.2	-178.2	176.5	0	111.1	M360 E361 P366	M360-K364 WeakPolarHBondContact O-CG 3.42Å; M360-K364 PolarHBondContact O-N 3.27Å; E361-K364 WeakPolarHBondContact O-CB 3.45Å; E361-K364 PolarHBondContact O-N 3.02Å; K364-P366 VanDerWaalsContact C-CD 3.43Å; K364-P366 VanDerWaalsContact O-CD 3.3Å; K364-P366 WeakPolarHBondContact O-CD 3.29Å
365	F	67.4	Low	66	Low	162 Å²	162	98.7 Å²	98.7	71%	0.711	54%	0.537	S	S	*	.	S	Bend	trans	-116.4	72.5	176	-59.4	-78.5	0	0	0	109.8	E361 E362 T367	E361-F365 PolarHBondContact O-N 3.41Å; E362-F365 CarbonylContact O-C 3.51Å; E362-F365 VanDerWaalsContact O-O 3.07Å; F365-T367 PolarHBondContact O-N 2.91Å
366	P	55.7	Low	63.4	Low	101 Å²	101	105 Å²	105	66%	0.656	56%	0.564	S	S	*	*			trans	-56.5	117.9	172.4	24.2	-30.9	0	0	0	107.1	K364 S368	K364-P366 VanDerWaalsContact C-CD 3.43Å; K364-P366 VanDerWaalsContact O-CD 3.3Å; K364-P366 WeakPolarHBondContact O-CD 3.29Å; P366-S368 PolarHBondContact O-N 3.08Å
367	T	51.7	Low	60.7	Low	129 Å²	129	112.6 Å²	112.6	79%	0.791	61%	0.605	S	S	*	*			trans	-54.4	112.5	176.3	-30	0	0	0	0	106.6	F365 G369	F365-T367 PolarHBondContact O-N 2.91Å; T367-G369 PolarHBondContact O-N 3.38Å
368	S	46.5	Very low	58.1	Low	136 Å²	136	121.3 Å²	121.3	95%	0.951	64%	0.644	S	S	*	*	S	Bend	trans	-72.1	51.5	174.9	-175.7	0	0	0	0	110.3	P366	P366-S368 PolarHBondContact O-N 3.08Å
369	G	46.1	Very low	55.8	Low	58 Å²	58	125.4 Å²	125.4	60%	0.598	67%	0.67	S	S	*	*			trans	-154.2	47.7	-164.8	0	0	0	0	0	111.9	T367	T367-G369 PolarHBondContact O-N 3.38Å
370	A	41.5	Very low	53	Low	96 Å²	96	126.5 Å²	126.5	79%	0.793	69%	0.687	S	S	*	*			trans	-117.2	92.4	154	0	0	0	0	0	107	S372	A370-S372 PolarHBondContact O-N 2.94Å
371	N	41.2	Very low	50.2	Low	139 Å²	139	134 Å²	134	74%	0.743	72%	0.719	S	S	*	*			trans	-46.7	110	163.6	-76	-26.7	0	0	0	108.8	F373	N371-F373 HydrophobicContact CB-CD2 4.27Å; N371-F373 PolarHBondContact O-N 2.64Å
372	S	42.7	Very low	47.4	Very low	106 Å²	106	137 Å²	137	74%	0.741	74%	0.736	S	S	*	*			trans	-60.7	93.7	151.6	177.7	0	0	0	0	106.4	A370 C374	A370-S372 PolarHBondContact O-N 2.94Å; S372-C374 VanDerWaalsContact C-N 3.29Å; S372-C374 PolarHBondContact O-N 3.37Å
373	F	34.7	Very low	44.6	Very low	161 Å²	161	136.4 Å²	136.4	71%	0.706	74%	0.743	S	S	*	*			trans	-70.1	84.5	176.9	-134	-99.5	0	0	0	108	N371 Y375	N371-F373 HydrophobicContact CB-CD2 4.27Å; N371-F373 PolarHBondContact O-N 2.64Å; F373-Y375 AromaticContact CD1-CD2 3.72Å; F373-Y375 HydrophobicContact CD1-CD2 3.72Å; F373-Y375 HydrophobicContact CD1-CE2 4.24Å; F373-Y375 AromaticContact CE1-CD2 3.52Å; F373-Y375 HydrophobicContact CE1-CD2 3.52Å; F373-Y375 AromaticContact CE1-CE2 3.56Å; F373-Y375 HydrophobicContact CE1-CE2 3.56Å; F373-Y375 HydrophobicContact CZ-CE2 4.36Å; F373-Y375 PolarHBondContact O-N 2.82Å
374	C	33.7	Very low	42	Very low	114 Å²	114	137.8 Å²	137.8	77%	0.77	75%	0.748	S	S	*	*			trans	-82	103.6	165.1	-69.6	0	0	0	0	107.6	S372	S372-C374 VanDerWaalsContact C-N 3.29Å; S372-C374 PolarHBondContact O-N 3.37Å
375	Y	38.1	Very low	39.7	Very low	175 Å²	175	138.7 Å²	138.7	69%	0.686	76%	0.759	S	S	*	*			trans	-90.1	117.9	166.1	-121.6	-93.4	0	0	0	109.8	F373	F373-Y375 AromaticContact CD1-CD2 3.72Å; F373-Y375 HydrophobicContact CD1-CD2 3.72Å; F373-Y375 HydrophobicContact CD1-CE2 4.24Å; F373-Y375 AromaticContact CE1-CD2 3.52Å; F373-Y375 HydrophobicContact CE1-CD2 3.52Å; F373-Y375 AromaticContact CE1-CE2 3.56Å; F373-Y375 HydrophobicContact CE1-CE2 3.56Å; F373-Y375 HydrophobicContact CZ-CE2 4.36Å; F373-Y375 PolarHBondContact O-N 2.82Å
376	E	36.7	Very low	38	Very low	157 Å²	157	138.9 Å²	138.9	73%	0.734	76%	0.762	S	S	*	*			trans	43.6	123.1	147	-68.3	-173.5	144.8	0	0	121.5
377	N	36.7	Very low	36.8	Very low	163 Å²	163	143.2 Å²	143.2	87%	0.872	77%	0.774	S	S	*	*			trans	-154	85.1	135.8	-119.3	8.4	0	0	0	109.9
378	E	37.4	Very low	35.7	Very low	187 Å²	187	140.7 Å²	140.7	87%	0.874	77%	0.773	S	S	*	*			trans	-136.6	72.9	166.6	-78.4	-80.5	158.9	0	0	108
379	L	44.1	Very low	34.8	Very low	179 Å²	179	142.7 Å²	142.7	94%	0.937	77%	0.773	S	S	*	*			trans	-126.8	84.3	160.3	-103	167.1	0	0	0	107.2
380	A	33.8	Very low	33.9	Very low	81 Å²	81	143.6 Å²	143.6	67%	0.669	78%	0.783	S	S	*	*			trans	-152.6	110.1	163	0	0	0	0	0	112
381	F	28.2	Very low	33.2	Very low	185 Å²	185	147 Å²	147	81%	0.811	79%	0.788	S	S	*	*			trans	93.7	111.4	136.6	-86.4	-115.4	0	0	0	120.9
382	I	30.9	Very low	32.7	Very low	129 Å²	129	145 Å²	145	66%	0.662	79%	0.79	S	S	*	*			trans	78.1	100.6	130.8	-65.7	-172	0	0	0	115.8
383	S	28.3	Very low	32.1	Very low	91 Å²	91	148.9 Å²	148.9	64%	0.636	80%	0.797	S	S	*	*				76.2	127	70.7	80.7	0	0	0	0	115.5
384	R	28.8	Very low	31.8	Very low	217 Å²	217	146.4 Å²	146.4	82%	0.819	80%	0.795	S	S	*	*			trans	71.5	115.2	158.1	-70.4	172.1	72.6	144.5	3	117.1
385	D	29.7	Very low	31.5	Very low	146 Å²	146	148 Å²	148	78%	0.781	79%	0.791	S	S	*	*				-171.2	156.9	94.1	-85.4	-32	0	0	0	111.4
386	E	32.1	Very low	31	Very low	167 Å²	167	147.3 Å²	147.3	78%	0.78	79%	0.792	S	S	*	*			trans	-87.6	168.7	-167.7	-63.6	171.7	136.3	0	0	114
387	E	29.9	Very low	30.4	Very low	191 Å²	191	146.4 Å²	146.4	89%	0.893	79%	0.792	S	S	*	*			trans	78.1	131.8	148.1	-77.6	176.5	-173	0	0	122.7
388	G	27.7	Very low	30.1	Very low	76 Å²	76	147.7 Å²	147.7	78%	0.784	79%	0.79	S	S	*	*			trans	132.6	93.7	135	0	0	0	0	0	119.6
389	D	28.2	Very low	29.5	Very low	178 Å²	178	143.6 Å²	143.6	95%	0.952	78%	0.782	S	S	*	*			trans	34.7	144.3	139.6	-85	-9.4	0	0	0	125
390	G	27.7	Very low	28.7	Very low	78 Å²	78	140.8 Å²	140.8	80%	0.804	78%	0.776	S	S	*	*			trans	155.7	99.7	144.7	0	0	0	0	0	117.5
391	D	26.8	Very low	28.7	Very low	168 Å²	168	142.9 Å²	142.9	90%	0.898	78%	0.782	S	S	*	*			trans	-66.5	155	173.2	-64.8	-53.2	0	0	0	115.7
392	A	30.5	Very low	28.7	Very low	95 Å²	95	138.9 Å²	138.9	79%	0.785	78%	0.778	S	S	*	*				165.5	113.2	127.9	0	0	0	0	0	114.2
393	E	29.6	Very low	28.5	Very low	189 Å²	189	141.2 Å²	141.2	88%	0.883	79%	0.786	S	S	*	*				29.3	142.3	115.7	-84.3	-171	-169.7	0	0	120.1
394	T	27.9	Very low	28.5	Very low	108 Å²	108	145.2 Å²	145.2	66%	0.663	80%	0.799	S	S	*	*			cis	-172.1	168.7	2.8	-38.9	0	0	0	0	108.8
395	E	27.9	Very low	28.5	Very low	148 Å²	148	141 Å²	141	69%	0.692	80%	0.797	S	S	*	*			trans	71.8	149.3	149.8	-71.4	-152.1	141.2	0	0	119.8
396	K	27.7	Very low	29	Very low	161 Å²	161	139.8 Å²	139.8	70%	0.7	80%	0.798	S	S	*	*			cis	-173.9	132.9	-23.1	-119.3	-177.2	-166.5	145.3	0	104.8
397	D	25.6	Very low	28.8	Very low	138 Å²	138	136.3 Å²	136.3	74%	0.738	80%	0.798	S	S	*	*				67.2	150	127.7	-127.3	-5.4	0	0	0	123.9
398	K	28.7	Very low	28.7	Very low	189 Å²	189	133.6 Å²	133.6	82%	0.822	79%	0.789	S	S	*	*			trans	86.3	143.5	163.2	-62.9	174.2	-179.9	176.2	0	118
399	S	25.1	Very low	28.7	Very low	101 Å²	101	139.8 Å²	139.8	71%	0.706	79%	0.789	S	S	*	*			cis	167.9	132.1	-9.4	173.1	0	0	0	0	103.9
400	C	27	Very low	28.6	Very low	120 Å²	120	138.8 Å²	138.8	81%	0.811	78%	0.784	S	S	*	*			trans	-68.9	158.9	158.9	-68.5	0	0	0	0	109.8
401	P	35.4	Very low	28.7	Very low	125 Å²	125	143.6 Å²	143.6	81%	0.812	79%	0.785	S	S	*	*				-144.8	169	123.4	32.7	-14.3	0	0	0	115.2
402	S	26.9	Very low	29.5	Very low	102 Å²	102	140.5 Å²	140.5	71%	0.713	77%	0.774	S	S	*	*			trans	-80.9	165.4	-174.6	42.7	0	0	0	0	116.2
403	E	27.6	Very low	29.4	Very low	178 Å²	178	141 Å²	141	83%	0.832	77%	0.772	S	S	*	*			trans	67	126.1	153.6	-77.8	-176.9	129	0	0	121.3
404	L	28.5	Very low	29.4	Very low	174 Å²	174	137.3 Å²	137.3	91%	0.911	77%	0.767	S	S	*	*				174.4	122.5	122.3	-93.5	145.3	0	0	0	111.8
405	T	29.3	Very low	29.6	Very low	128 Å²	128	142.4 Å²	142.4	79%	0.785	77%	0.774	S	S	*	*			trans	-78.4	162.7	161.8	43.6	0	0	0	0	111.3
406	P	38.7	Very low	29.8	Very low	122 Å²	122	147.1 Å²	147.1	79%	0.792	79%	0.785	S	S	*	*				-155.8	162.1	89.5	37.6	-16.9	0	0	0	118.4
407	A	27.9	Very low	30.1	Very low	94 Å²	94	146.7 Å²	146.7	78%	0.777	79%	0.786	S	S	*	*			trans	65.4	146	149.5	0	0	0	0	0	118.9
408	D	27.8	Very low	30.6	Very low	134 Å²	134	145.9 Å²	145.9	72%	0.717	79%	0.791	S	S	*	*			cis	-166.4	154.8	23.2	-147.3	-8.5	0	0	0	111.4
409	R	27.8	Very low	31	Very low	205 Å²	205	141.5 Å²	141.5	77%	0.774	79%	0.79	S	S	*	*			trans	50.4	110	151.3	-84.4	167.5	169.8	-173.7	-2.5	123.1
410	N	27.3	Very low	31.7	Very low	158 Å²	158	148.5 Å²	148.5	85%	0.845	82%	0.818	S	S	*	*				174	130.5	94.8	-96.6	-13.6	0	0	0	112.9
411	Q	28.1	Very low	31.9	Very low	178 Å²	178	149.9 Å²	149.9	83%	0.832	82%	0.819	S	S	*	*			trans	-136.6	177.7	165.4	-115.2	-169.2	15.4	0	0	105.6
412	P	43.5	Very low	31.8	Very low	103 Å²	103	151.2 Å²	151.2	67%	0.669	82%	0.819	S	S	*	*			cis	-141.9	-177.3	-24.5	34.2	-13.7	0	0	0	113
413	S	28.6	Very low	32	Very low	107 Å²	107	153.9 Å²	153.9	75%	0.748	83%	0.825	S	S	*	*			trans	158.9	116.3	133.5	52.9	0	0	0	0	108.5
414	S	30.8	Very low	32.3	Very low	110 Å²	110	152.5 Å²	152.5	77%	0.769	83%	0.825	S	S	*	*				80.9	121.7	56.2	84.8	0	0	0	0	115.4
415	R	31.1	Very low	32.5	Very low	216 Å²	216	151.2 Å²	151.2	82%	0.815	82%	0.819	S	S	*	*			trans	76.7	118.8	144.9	-109.4	176.6	175.8	172.7	-1.2	120.6
416	R	32.1	Very low	32.7	Very low	246 Å²	246	152.7 Å²	152.7	93%	0.928	82%	0.821	S	S	*	*				-157.1	121.3	120	-122.5	175.4	-179.9	174.5	-0.6	112.6
417	E	35.5	Very low	32.3	Very low	152 Å²	152	154.9 Å²	154.9	71%	0.71	82%	0.823	S	S	*	*			trans	-62.4	151.6	154.5	-68.5	156.9	120.9	0	0	109.9
418	S	35.1	Very low	32.7	Very low	122 Å²	122	159.6 Å²	159.6	85%	0.853	83%	0.827	S	S	*	*				-173	143	118.3	8.6	0	0	0	0	112
419	A	36.9	Very low	33.1	Very low	96 Å²	96	161.8 Å²	161.8	79%	0.793	84%	0.836	S	S	*	*			trans	-68.3	156.2	173.6	0	0	0	0	0	113.5
420	L	40.1	Very low	33.5	Very low	248 Å²	248	157.8 Å²	157.8	100%	1.298	84%	0.842	S	S	*	*			trans	-154.8	0	139.1	-107.4	160.8	0	0	0	108.7

Retrieved 420 of 420 residues in 107.7 ms (Link to these results)

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