X5D7T9_HUMAN Loading...

Tuberous sclerosis 2 isoform L

AlphaFold DB , UniProt , Accession X5D7T9, Species HUMAN (Homo sapiens, Human), Gene TSC2, Length 150 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.3	Very low	48.5	Very low	254 Å²	254	135.5 Å²	135.5	100%	1.251	78%	0.78	S	S	*	*				0	117.6	0	-72.1	-172.3	175.7	0	0	108.3
2	A	40.9	Very low	49.3	Very low	103 Å²	103	135.3 Å²	135.3	85%	0.851	76%	0.764	S	S	*	*			trans	-127	125.8	175.5	0	0	0	0	0	108.9
3	K	46.6	Very low	50	Low	202 Å²	202	133.7 Å²	133.7	88%	0.878	75%	0.746	S	S	*	*			trans	-70.4	138.5	174.8	-80.6	175.3	172.5	175.7	0	110
4	P	46.3	Very low	50.5	Low	126 Å²	126	133.1 Å²	133.1	82%	0.818	73%	0.731	S	S	*	*			trans	-83.7	127.8	163.1	31.1	-28.5	0	0	0	110.5
5	T	45.6	Very low	51.1	Low	141 Å²	141	132.7 Å²	132.7	87%	0.865	72%	0.72	S	S	*	*			trans	-85.1	115.9	167.1	41.5	0	0	0	0	108.9
6	S	46.3	Very low	51.5	Low	125 Å²	125	132.3 Å²	132.3	87%	0.874	71%	0.709	S	S	*	*			trans	-91.2	130.2	177.9	-157.8	0	0	0	0	111.3
7	K	54.5	Low	52	Low	206 Å²	206	132.4 Å²	132.4	90%	0.896	71%	0.708	S	S	*	*			trans	-70.5	115.6	179.5	-82.2	170.3	168.8	172.6	0	111.3
8	D	50.5	Low	52.5	Low	101 Å²	101	133.7 Å²	133.7	54%	0.54	71%	0.714	S	S	.	*			trans	-122.9	13.3	168.3	-155.8	-107.3	0	0	0	113.6	K12	D8-K12 VanDerWaalsContact OD1-CE 3.24Å; D8-K12 WeakPolarHBondContact OD1-CE 3.18Å; D8-K12 IonicContact OD1-NZ 3.52Å; D8-K12 PolarHBondContact OD1-NZ 3.34Å
9	S	54.9	Low	53.2	Low	84 Å²	84	130.7 Å²	130.7	59%	0.587	70%	0.697	S	S	*	*	H	α-helix	trans	-76.4	-28.2	-179.1	-83.1	0	0	0	0	114	L11 K12 E13	S9-L11 PolarHBondContact O-N 3.15Å; S9-K12 PolarHBondContact O-N 3.06Å; S9-E13 PolarHBondContact O-N 3.29Å
10	G	49.3	Very low	53.5	Low	48 Å²	48	126.8 Å²	126.8	50%	0.495	69%	0.689	S	S	.	*	H	α-helix	trans	-65.9	-37.7	-166.8	0	0	0	0	0	114	K14	G10-K14 WeakPolarHBondContact O-CE 3.27Å; G10-K14 WeakPolarHBondContact O-CG 3.3Å
11	L	60.4	Low	54.1	Low	100 Å²	100	126.8 Å²	126.8	52%	0.524	69%	0.688	S	S	.	*	H	α-helix	trans	-72.6	-41	-179.2	-88.3	151.7	0	0	0	112.3	S9 E13 K14 F15	S9-L11 PolarHBondContact O-N 3.15Å; L11-E13 VanDerWaalsContact C-N 3.28Å; L11-E13 PolarHBondContact O-N 3.38Å; L11-K14 PolarHBondContact O-N 3.38Å; L11-F15 HydrophobicContact CD2-CE2 4.24Å; L11-F15 VanDerWaalsContact O-CD2 3.25Å; L11-F15 WeakPolarHBondContact O-CD2 3.41Å; L11-F15 PolarHBondContact O-N 2.83Å
12	K	57.8	Low	54.4	Low	134 Å²	134	117.6 Å²	117.6	58%	0.583	66%	0.659	S	S	*	*	H	α-helix	trans	-67.7	-31.3	-178.1	-57.9	-177.5	-174.6	178.3	0	112	D8 S9 K16	D8-K12 VanDerWaalsContact OD1-CE 3.24Å; D8-K12 WeakPolarHBondContact OD1-CE 3.18Å; D8-K12 IonicContact OD1-NZ 3.52Å; D8-K12 PolarHBondContact OD1-NZ 3.34Å; S9-K12 PolarHBondContact O-N 3.06Å; K12-K16 WeakPolarHBondContact O-CG 3.4Å; K12-K16 PolarHBondContact O-N 2.68Å
13	E	58	Low	55	Low	114 Å²	114	119.4 Å²	119.4	53%	0.533	66%	0.66	S	S	.	*	H	α-helix	trans	-67.1	-47.7	178	-139.1	97.8	-159.1	0	0	112.5	S9 L11 F15 K16 I17	S9-E13 PolarHBondContact O-N 3.29Å; L11-E13 VanDerWaalsContact C-N 3.28Å; L11-E13 PolarHBondContact O-N 3.38Å; E13-F15 VanDerWaalsContact C-N 3.29Å; E13-F15 PolarHBondContact O-N 3.37Å; E13-K16 PolarHBondContact O-N 3.03Å; E13-I17 WeakPolarHBondContact O-CG1 3.33Å; E13-I17 PolarHBondContact O-N 2.81Å
14	K	57.8	Low	54.9	Low	125 Å²	125	115.7 Å²	115.7	54%	0.543	66%	0.656	S	S	.	*	H	α-helix	trans	-65.5	-33.9	-179.4	6.2	179.7	-173.3	-164.1	0	112	G10 L11 I17 L18	G10-K14 WeakPolarHBondContact O-CE 3.27Å; G10-K14 WeakPolarHBondContact O-CG 3.3Å; L11-K14 PolarHBondContact O-N 3.38Å; K14-I17 PolarHBondContact O-N 3Å; K14-L18 PolarHBondContact O-N 2.74Å
15	F	59.7	Low	55.3	Low	128 Å²	128	121.3 Å²	121.3	56%	0.561	66%	0.661	S	S	*	*	H	α-helix	trans	-69.5	-34.4	175.8	-85.2	-75.7	0	0	0	112.9	L11 E13 I17 L18 L19	L11-F15 HydrophobicContact CD2-CE2 4.24Å; L11-F15 VanDerWaalsContact O-CD2 3.25Å; L11-F15 WeakPolarHBondContact O-CD2 3.41Å; L11-F15 PolarHBondContact O-N 2.83Å; E13-F15 VanDerWaalsContact C-N 3.29Å; E13-F15 PolarHBondContact O-N 3.37Å; F15-I17 VanDerWaalsContact C-N 3.29Å; F15-I17 PolarHBondContact O-N 2.66Å; F15-L18 PolarHBondContact O-N 3.02Å; F15-L19 WeakPolarHBondContact O-CB 3.46Å; F15-L19 PolarHBondContact O-N 2.71Å; F15-L19 VanDerWaalsContact O-N 3.08Å
16	K	57.3	Low	55.5	Low	125 Å²	125	120.5 Å²	120.5	54%	0.543	66%	0.658	S	S	.	*	H	α-helix	trans	-65.5	-33.1	174.8	-74.6	177.1	178.9	-178.3	0	113.1	K12 E13 L19 G20 L21	K12-K16 WeakPolarHBondContact O-CG 3.4Å; K12-K16 PolarHBondContact O-N 2.68Å; E13-K16 PolarHBondContact O-N 3.03Å; K16-L19 PolarHBondContact O-N 3.2Å; K16-G20 PolarHBondContact O-N 3.42Å; K16-L21 PolarHBondContact O-N 3.41Å; K16-L21 VanDerWaalsContact O-N 3.09Å
17	I	59	Low	55.2	Low	134 Å²	134	121.3 Å²	121.3	69%	0.687	65%	0.653	S	S	*	*	H	α-helix	trans	-71.3	-39.4	178	-63.9	168.4	0	0	0	110.2	E13 K14 F15 L19 G20	E13-I17 WeakPolarHBondContact O-CG1 3.33Å; E13-I17 PolarHBondContact O-N 2.81Å; K14-I17 PolarHBondContact O-N 3Å; F15-I17 VanDerWaalsContact C-N 3.29Å; F15-I17 PolarHBondContact O-N 2.66Å; I17-L19 VanDerWaalsContact C-N 3.34Å; I17-L19 PolarHBondContact O-N 2.88Å; I17-G20 PolarHBondContact O-N 3.07Å
18	L	61.2	Low	55.2	Low	156 Å²	156	117.2 Å²	117.2	82%	0.817	65%	0.647	S	S	*	*	H	α-helix	trans	-70.9	-27.2	175.9	-136.6	91.9	0	0	0	113.2	K14 F15	K14-L18 PolarHBondContact O-N 2.74Å; F15-L18 PolarHBondContact O-N 3.02Å
19	L	65.6	Low	54.9	Low	77 Å²	77	122.9 Å²	122.9	40%	0.403	66%	0.661	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.9	3.5	178.1	-111.6	156.6	0	0	0	114.3	F15 K16 I17 L21 V67	F15-L19 WeakPolarHBondContact O-CB 3.46Å; F15-L19 PolarHBondContact O-N 2.71Å; F15-L19 VanDerWaalsContact O-N 3.08Å; K16-L19 PolarHBondContact O-N 3.2Å; I17-L19 VanDerWaalsContact C-N 3.34Å; I17-L19 PolarHBondContact O-N 2.88Å; L19-L21 PolarHBondContact O-N 3.46Å; L19-V67 HydrophobicContact CD2-CG2 4.48Å
20	G	60.2	Low	54.7	Low	52 Å²	52	125.4 Å²	125.4	54%	0.536	68%	0.679	S	S	.	*	T	Hydrogen-bonded Turn	trans	66.9	31.5	174.6	0	0	0	0	0	115.2	K16 I17	K16-G20 PolarHBondContact O-N 3.42Å; I17-G20 PolarHBondContact O-N 3.07Å
21	L	66.6	Low	54.4	Low	127 Å²	127	127 Å²	127	67%	0.665	69%	0.687	S	S	*	*			trans	-98.3	50.4	171.7	-90.9	92.1	0	0	0	111.9	K16 L19	K16-L21 PolarHBondContact O-N 3.41Å; K16-L21 VanDerWaalsContact O-N 3.09Å; L19-L21 PolarHBondContact O-N 3.46Å
22	G	43.9	Very low	54.1	Low	62 Å²	62	132.2 Å²	132.2	64%	0.639	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-94.1	126.2	166.6	0	0	0	0	0	110.1	P24	G22-P24 WeakPolarHBondContact O-CD 3.25Å
23	T	52.6	Low	53.5	Low	141 Å²	141	128.2 Å²	128.2	87%	0.865	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-69.7	126.9	179.4	43.2	0	0	0	0	111.7
24	P	45.3	Very low	53.3	Low	123 Å²	123	132.3 Å²	132.3	80%	0.799	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-89.8	132	160.5	14.1	3.4	0	0	0	109.9	G22	G22-P24 WeakPolarHBondContact O-CD 3.25Å
25	R	54.9	Low	53.4	Low	244 Å²	244	132.9 Å²	132.9	92%	0.921	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-56.5	148.9	168.5	-118.4	175.2	-179.2	169.6	0.5	110.6
26	P	49.2	Very low	54.1	Low	125 Å²	125	133 Å²	133	81%	0.812	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-79.5	136.9	-172.1	32.1	-31.2	0	0	0	111.2
27	N	39.4	Very low	55.6	Low	142 Å²	142	131 Å²	131	76%	0.759	73%	0.73	S	S	*	*			trans	-122	121.7	161.6	-156.6	19.7	0	0	0	107.2	R29	N27-R29 PolarHBondContact O-N 3.14Å
28	P	54.7	Low	57.3	Low	119 Å²	119	126.7 Å²	126.7	77%	0.773	71%	0.707	S	S	*	*			trans	-91.9	91	-174.4	33.9	-27.9	0	0	0	108.9
29	R	45.4	Very low	59	Low	221 Å²	221	123.9 Å²	123.9	83%	0.834	69%	0.692	S	S	*	*			trans	-142.2	125.2	160.2	-67.8	-167.4	-177.8	-177.4	0.9	109	N27 A31	N27-R29 PolarHBondContact O-N 3.14Å; R29-A31 PolarHBondContact O-N 3.32Å
30	S	51	Low	60.5	Low	137 Å²	137	120.8 Å²	120.8	96%	0.958	68%	0.675	S	S	*	*			trans	-41.5	118.5	-178.6	-50.1	0	0	0	0	112.3
31	A	42.8	Very low	62.3	Low	82 Å²	82	121.2 Å²	121.2	68%	0.678	67%	0.668	S	S	*	*			trans	-131.4	124.2	156.9	0	0	0	0	0	105	R29 G33	R29-A31 PolarHBondContact O-N 3.32Å; A31-G33 PolarHBondContact O-N 3.1Å
32	E	53	Low	63.7	Low	208 Å²	208	119 Å²	119	97%	0.972	67%	0.668	S	S	*	*			trans	-56.5	85.1	147.3	-77.8	158.4	128.7	0	0	105.3	K34	E32-K34 PolarHBondContact O-N 2.96Å
33	G	45.9	Very low	66.2	Low	50 Å²	50	120.4 Å²	120.4	52%	0.515	66%	0.657	S	S	.	*			trans	-69.9	109.9	-163.4	0	0	0	0	0	107.4	A31 Q35	A31-G33 PolarHBondContact O-N 3.1Å; G33-Q35 PolarHBondContact O-N 3.17Å
34	K	53.8	Low	68.3	Low	201 Å²	201	114.7 Å²	114.7	87%	0.874	62%	0.622	S	S	*	*			trans	-44.7	96.5	159.7	-129.4	170.9	-177.9	177.4	0	106.6	E32 T36	E32-K34 PolarHBondContact O-N 2.96Å; K34-T36 PolarHBondContact O-N 3.23Å
35	Q	59.4	Low	70.8	Confident	136 Å²	136	111.3 Å²	111.3	64%	0.636	60%	0.596	S	S	*	*			trans	-61.1	113.1	173.1	-77.2	-170.9	-16.7	0	0	104.8	G33 E37	G33-Q35 PolarHBondContact O-N 3.17Å; Q35-E37 PolarHBondContact O-N 2.99Å; Q35-E37 VanDerWaalsContact O-N 3.07Å
36	T	74.8	Confident	72.8	Confident	132 Å²	132	105.9 Å²	105.9	81%	0.81	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-58.8	119.1	177.7	-50.6	0	0	0	0	107.7	K34	K34-T36 PolarHBondContact O-N 3.23Å
37	E	89.9	Confident	75.1	Confident	83 Å²	83	103.1 Å²	103.1	39%	0.388	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-64.1	144.8	178.5	-62.6	-178	149.5	0	0	109.8	Q35 K72 E74 R115	Q35-E37 PolarHBondContact O-N 2.99Å; Q35-E37 VanDerWaalsContact O-N 3.07Å; E37-K72 CarbonylContact C-O 3.48Å; E37-K72 VanDerWaalsContact CA-O 3.25Å; E37-K72 WeakPolarHBondContact CA-O 3.44Å; E37-E74 HydrophobicContact CB-CB 4.42Å; E37-E74 WeakPolarHBondContact OE2-CA 2.91Å; E37-R115 IonicContact OE1-CZ 3.15Å; E37-R115 IonicContact OE1-NH1 2.83Å; E37-R115 PolarHBondContact OE1-NH1 3.39Å; E37-R115 IonicContact OE1-NH2 3.13Å; E37-R115 PolarHBondContact OE1-NH2 3.49Å
38	F	94.9	Very high	77.9	Confident	42 Å²	42	96.4 Å²	96.4	18%	0.184	52%	0.516	C	S	.	.	B	Isolated β-bridge	trans	-82.5	126	172	-175.2	-94.4	0	0	0	109.5	I40 I44 I64 V67 K71 K72 F73 E74	F38-I40 HydrophobicContact CD1-CD1 3.79Å; F38-I40 HydrophobicContact CE1-CD1 3.71Å; F38-I44 HydrophobicContact CE1-CD1 4.05Å; F38-I44 HydrophobicContact CZ-CD1 4.07Å; F38-I64 HydrophobicContact CE1-CD1 4.49Å; F38-V67 HydrophobicContact CB-CG1 4.06Å; F38-V67 HydrophobicContact CD1-CG1 3.66Å; F38-V67 HydrophobicContact CD2-CG1 3.64Å; F38-V67 HydrophobicContact CE1-CG1 3.92Å; F38-V67 HydrophobicContact CE2-CG1 3.91Å; F38-V67 HydrophobicContact CE2-CG2 4.46Å; F38-V67 HydrophobicContact CG-CG1 3.5Å; F38-V67 VanDerWaalsContact CG-CG1 3.5Å; F38-V67 HydrophobicContact CZ-CG1 4.04Å; F38-V67 HydrophobicContact CZ-CG2 4.29Å; F38-K71 HydrophobicContact CB-CB 4.02Å; F38-K71 HydrophobicContact CB-CD 4.23Å; F38-K71 HydrophobicContact CD2-CD 4.02Å; F38-K72 PolarHBondContact N-O 3.25Å; F38-F73 HydrophobicContact CB-CD1 4.06Å; F38-F73 HydrophobicContact CB-CE1 4.5Å; F38-F73 HydrophobicContact CD1-CD1 4.1Å; F38-F73 HydrophobicContact CD1-CE1 4Å; F38-F73 WeakPolarHBondContact O-CA 3.34Å; F38-E74 PolarHBondContact O-N 3.37Å
39	I	96.4	Very high	79.8	Confident	98 Å²	98	92 Å²	92	50%	0.503	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-88.9	124.9	-179	-62.1	175.1	0	0	0	108.8	T41 E74	I39-T41 HydrophobicContact CG2-CG2 4.23Å; I39-T41 PolarHBondContact O-N 3.24Å; I39-E74 VanDerWaalsContact CA-OE1 3.3Å; I39-E74 WeakPolarHBondContact CA-OE1 3.17Å; I39-E74 VanDerWaalsContact CG2-OE1 3.27Å; I39-E74 WeakPolarHBondContact CG2-OE1 3.45Å
40	I	96.9	Very high	82.1	Confident	12 Å²	12	88.1 Å²	88.1	6%	0.062	48%	0.481	C	S	.	.			trans	-84.1	94	171.1	-59.6	-60	0	0	0	107.3	F38 I44 L45 I64 F73 E74 A77 L81	F38-I40 HydrophobicContact CD1-CD1 3.79Å; F38-I40 HydrophobicContact CE1-CD1 3.71Å; I40-I44 HydrophobicContact CG2-CB 4.42Å; I40-I44 HydrophobicContact CG2-CG2 4.07Å; I40-L45 HydrophobicContact CG2-CD1 4.46Å; I40-L45 HydrophobicContact CG2-CD2 3.67Å; I40-L45 HydrophobicContact CG2-CG 3.86Å; I40-I64 HydrophobicContact CD1-CD1 4.2Å; I40-F73 HydrophobicContact CD1-CE1 4.42Å; I40-F73 HydrophobicContact CD1-CZ 4.39Å; I40-E74 PolarHBondContact N-OE1 3.43Å; I40-A77 HydrophobicContact CB-CB 4.17Å; I40-A77 HydrophobicContact CG1-CB 3.5Å; I40-L81 HydrophobicContact CD1-CD1 3.93Å; I40-L81 HydrophobicContact CD1-CD2 4.27Å; I40-L81 HydrophobicContact CD1-CG 4.3Å; I40-L81 HydrophobicContact CG1-CD1 4.11Å; I40-L81 HydrophobicContact CG1-CG 4.24Å; I40-L81 HydrophobicContact CG2-CD2 4.03Å; I40-L81 HydrophobicContact CG2-CG 4.26Å
41	T	97	Very high	84.1	Confident	61 Å²	61	89.8 Å²	89.8	37%	0.374	47%	0.474	S	S	.	.			trans	-66.8	158.1	-176.5	67.8	0	0	0	0	112.1	I39 E43 I44 L45	I39-T41 HydrophobicContact CG2-CG2 4.23Å; I39-T41 PolarHBondContact O-N 3.24Å; T41-E43 PolarHBondContact O-N 2.94Å; T41-I44 WeakPolarHBondContact O-CB 3.5Å; T41-I44 PolarHBondContact O-N 2.76Å; T41-I44 VanDerWaalsContact O-N 3.1Å; T41-I44 WeakPolarHBondContact OG1-CG1 3.49Å; T41-I44 PolarHBondContact OG1-N 3.27Å; T41-L45 PolarHBondContact O-N 3.12Å; T41-L45 VanDerWaalsContact O-N 3.14Å
42	A	95.9	Very high	86.6	Confident	81 Å²	81	87.3 Å²	87.3	67%	0.669	45%	0.451	S	S	*	.	H	α-helix	trans	-56.7	-30.2	172.5	0	0	0	0	0	112.6	L45 R46	A42-L45 PolarHBondContact O-N 3.08Å; A42-R46 WeakPolarHBondContact O-CB 3.47Å; A42-R46 PolarHBondContact O-N 3.27Å
43	E	96.4	Very high	88.7	Confident	90 Å²	90	79.5 Å²	79.5	42%	0.421	43%	0.427	S	S	.	.	H	α-helix	trans	-66.9	-44	176.2	-177.7	67.1	171.2	0	0	112	T41 L45 R46 E47	T41-E43 PolarHBondContact O-N 2.94Å; E43-L45 VanDerWaalsContact C-N 3.3Å; E43-L45 PolarHBondContact O-N 3.3Å; E43-R46 WeakPolarHBondContact O-CB 3.46Å; E43-R46 PolarHBondContact O-N 2.84Å; E43-R46 IonicContact OE1-CZ 3.26Å; E43-R46 IonicContact OE1-NE 2.76Å; E43-R46 IonicContact OE1-NH2 2.94Å; E43-R46 PolarHBondContact OE1-NH2 3.28Å; E43-R46 IonicContact OE2-CZ 2.66Å; E43-R46 VanDerWaalsContact OE2-CZ 3.26Å; E43-R46 IonicContact OE2-NE 2.64Å; E43-R46 PolarHBondContact OE2-NE 3.47Å; E43-R46 IonicContact OE2-NH2 3.68Å; E43-R46 PolarHBondContact OE2-NH2 2.84Å; E43-E47 PolarHBondContact O-N 2.64Å
44	I	97.5	Very high	91.2	Very high	22 Å²	22	79.8 Å²	79.8	11%	0.113	42%	0.416	C	S	.	.	H	α-helix	trans	-59.6	-45	174.3	-69.6	169.9	0	0	0	110	F38 I40 T41 R46 E47 L48 M60 I64	F38-I44 HydrophobicContact CE1-CD1 4.05Å; F38-I44 HydrophobicContact CZ-CD1 4.07Å; I40-I44 HydrophobicContact CG2-CB 4.42Å; I40-I44 HydrophobicContact CG2-CG2 4.07Å; T41-I44 WeakPolarHBondContact O-CB 3.5Å; T41-I44 PolarHBondContact O-N 2.76Å; T41-I44 VanDerWaalsContact O-N 3.1Å; T41-I44 WeakPolarHBondContact OG1-CG1 3.49Å; T41-I44 PolarHBondContact OG1-N 3.27Å; I44-R46 VanDerWaalsContact C-N 3.33Å; I44-R46 PolarHBondContact O-N 3.15Å; I44-E47 PolarHBondContact O-N 3.25Å; I44-L48 HydrophobicContact CG2-CD1 4.07Å; I44-L48 WeakPolarHBondContact O-CG 3.31Å; I44-L48 PolarHBondContact O-N 3.15Å; I44-M60 HydrophobicContact CG2-CG 4.5Å; I44-M60 HydrophobicContact CG2-SD 4.15Å; I44-I64 HydrophobicContact CD1-CD1 4.36Å; I44-I64 HydrophobicContact CG2-CD1 3.76Å; I44-I64 HydrophobicContact CG2-CG1 4.28Å
45	L	97.7	Very high	93.3	Very high	51 Å²	51	76.1 Å²	76.1	27%	0.267	41%	0.406	S	S	.	.	H	α-helix	trans	-65.1	-36.6	178.3	-64.6	176.4	0	0	0	112.3	I40 T41 A42 E43 L48 S49 A80 A84	I40-L45 HydrophobicContact CG2-CD1 4.46Å; I40-L45 HydrophobicContact CG2-CD2 3.67Å; I40-L45 HydrophobicContact CG2-CG 3.86Å; T41-L45 PolarHBondContact O-N 3.12Å; T41-L45 VanDerWaalsContact O-N 3.14Å; A42-L45 PolarHBondContact O-N 3.08Å; E43-L45 VanDerWaalsContact C-N 3.3Å; E43-L45 PolarHBondContact O-N 3.3Å; L45-L48 CarbonylContact O-C 3.58Å; L45-L48 PolarHBondContact O-N 3.07Å; L45-S49 PolarHBondContact O-N 3.02Å; L45-A80 HydrophobicContact CD1-CB 4.12Å; L45-A80 HydrophobicContact CD2-CB 4.05Å; L45-A84 HydrophobicContact CD2-CB 4.32Å
46	R	96.7	Very high	95.1	Very high	131 Å²	131	73.1 Å²	73.1	49%	0.494	40%	0.395	S	S	.	.	H	α-helix	trans	-63.7	-43.5	175.4	-171.1	179.7	69.3	84.6	0	111.4	A42 E43 I44 L48 S49 C52	A42-R46 WeakPolarHBondContact O-CB 3.47Å; A42-R46 PolarHBondContact O-N 3.27Å; E43-R46 WeakPolarHBondContact O-CB 3.46Å; E43-R46 PolarHBondContact O-N 2.84Å; E43-R46 IonicContact OE1-CZ 3.26Å; E43-R46 IonicContact OE1-NE 2.76Å; E43-R46 IonicContact OE1-NH2 2.94Å; E43-R46 PolarHBondContact OE1-NH2 3.28Å; E43-R46 IonicContact OE2-CZ 2.66Å; E43-R46 VanDerWaalsContact OE2-CZ 3.26Å; E43-R46 IonicContact OE2-NE 2.64Å; E43-R46 PolarHBondContact OE2-NE 3.47Å; E43-R46 IonicContact OE2-NH2 3.68Å; E43-R46 PolarHBondContact OE2-NH2 2.84Å; I44-R46 VanDerWaalsContact C-N 3.33Å; I44-R46 PolarHBondContact O-N 3.15Å; R46-L48 VanDerWaalsContact C-N 3.28Å; R46-L48 PolarHBondContact O-N 3.22Å; R46-S49 VanDerWaalsContact O-CB 3.28Å; R46-S49 WeakPolarHBondContact O-CB 3.35Å; R46-S49 PolarHBondContact O-N 2.96Å; R46-S49 VanDerWaalsContact O-N 3.13Å; R46-S49 PolarHBondContact O-OG 3.19Å; R46-C52 PolarHBondContact O-SG 3.35Å; R46-C52 VanDerWaalsContact O-SG 3.32Å
47	E	97.2	Very high	96.2	Very high	67 Å²	67	67.2 Å²	67.2	31%	0.313	36%	0.357	S	S	.	.	H	α-helix	trans	-65.9	-29.2	175.6	-73	-167.9	-142.8	0	0	113.2	E43 I44 C52 M60	E43-E47 PolarHBondContact O-N 2.64Å; I44-E47 PolarHBondContact O-N 3.25Å; E47-C52 WeakPolarHBondContact O-CB 3.4Å; E47-M60 HydrophobicContact CB-CE 4.05Å; E47-M60 HydrophobicContact CB-CG 4.29Å; E47-M60 VanDerWaalsContact CD-CE 3.45Å; E47-M60 HydrophobicContact CG-CE 4.34Å; E47-M60 WeakPolarHBondContact OE2-CE 3.23Å
48	L	98.1	Very high	96.7	Very high	1 Å²	1	65.2 Å²	65.2	1%	0.005	35%	0.349	C	S	.	.	H	α-helix	trans	-82.1	-11.5	173.4	-71	172.6	0	0	0	113.7	I44 L45 R46 R57 M60 I61 L81 A84 V85	I44-L48 HydrophobicContact CG2-CD1 4.07Å; I44-L48 WeakPolarHBondContact O-CG 3.31Å; I44-L48 PolarHBondContact O-N 3.15Å; L45-L48 CarbonylContact O-C 3.58Å; L45-L48 PolarHBondContact O-N 3.07Å; R46-L48 VanDerWaalsContact C-N 3.28Å; R46-L48 PolarHBondContact O-N 3.22Å; L48-R57 VanDerWaalsContact O-CZ 3.29Å; L48-R57 PolarHBondContact O-NE 3.49Å; L48-R57 PolarHBondContact O-NH2 3.39Å; L48-R57 VanDerWaalsContact O-NH2 3.09Å; L48-M60 HydrophobicContact CD1-CG 4.37Å; L48-M60 HydrophobicContact CD2-CB 3.83Å; L48-M60 HydrophobicContact CD2-CG 3.57Å; L48-M60 HydrophobicContact CG-CB 4.37Å; L48-M60 HydrophobicContact CG-CG 3.66Å; L48-I61 HydrophobicContact CD2-CG1 3.65Å; L48-L81 HydrophobicContact CD1-CD2 3.48Å; L48-L81 VanDerWaalsContact CD1-CD2 3.48Å; L48-A84 HydrophobicContact CB-CB 3.99Å; L48-V85 HydrophobicContact CB-CG1 4.43Å; L48-V85 HydrophobicContact CD1-CG1 4.4Å; L48-V85 HydrophobicContact CD2-CG1 3.99Å
49	S	94.8	Very high	96.8	Very high	27 Å²	27	70.8 Å²	70.8	19%	0.189	37%	0.369	C	S	.	.	S	Bend	trans	-69	160	-175.3	81.4	0	0	0	0	112.5	L45 R46 E51 C52 R57	L45-S49 PolarHBondContact O-N 3.02Å; R46-S49 VanDerWaalsContact O-CB 3.28Å; R46-S49 WeakPolarHBondContact O-CB 3.35Å; R46-S49 PolarHBondContact O-N 2.96Å; R46-S49 VanDerWaalsContact O-N 3.13Å; R46-S49 PolarHBondContact O-OG 3.19Å; S49-E51 PolarHBondContact O-N 3.23Å; S49-E51 PolarHBondContact OG-N 3.48Å; S49-C52 WeakPolarHBondContact O-CB 3.47Å; S49-C52 PolarHBondContact O-N 3.47Å; S49-C52 VanDerWaalsContact O-N 3.07Å; S49-R57 WeakPolarHBondContact O-CD 3.35Å; S49-R57 PolarHBondContact O-NE 2.79Å
50	M	93.6	Very high	96.9	Very high	139 Å²	139	66.8 Å²	66.8	69%	0.685	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-13.9	175.9	57.1	170.9	40.3	0	0	114.6	C52	M50-C52 PolarHBondContact O-N 2.89Å
51	E	93	Very high	97	Very high	172 Å²	172	66.2 Å²	66.2	80%	0.804	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-19.4	173.9	-56.9	179.4	173.8	0	0	111.6	S49	S49-E51 PolarHBondContact O-N 3.23Å; S49-E51 PolarHBondContact OG-N 3.48Å
52	C	96.1	Very high	97.1	Very high	29 Å²	29	65.1 Å²	65.1	20%	0.196	35%	0.346	C	S	.	.	S	Bend	trans	-88.8	145.5	175.8	-75.3	0	0	0	0	111.8	R46 E47 S49 M50 R57	R46-C52 PolarHBondContact O-SG 3.35Å; R46-C52 VanDerWaalsContact O-SG 3.32Å; E47-C52 WeakPolarHBondContact O-CB 3.4Å; S49-C52 WeakPolarHBondContact O-CB 3.47Å; S49-C52 PolarHBondContact O-N 3.47Å; S49-C52 VanDerWaalsContact O-N 3.07Å; M50-C52 PolarHBondContact O-N 2.89Å; C52-R57 HydrophobicContact CB-CG 4.12Å; C52-R57 WeakPolarHBondContact O-CD 3.3Å
53	G	96.9	Very high	97.2	Very high	45 Å²	45	65 Å²	65	46%	0.464	33%	0.331	S	S	.	.			trans	-59.4	145.2	176.3	0	0	0	0	0	112.5	N55 N56 R57	G53-N55 VanDerWaalsContact C-N 3.27Å; G53-N55 PolarHBondContact O-N 3.46Å; G53-N55 VanDerWaalsContact O-N 3.15Å; G53-N56 WeakPolarHBondContact O-CB 3.46Å; G53-N56 PolarHBondContact O-N 2.93Å; G53-R57 PolarHBondContact O-N 3.09Å
54	L	97.9	Very high	97.3	Very high	56 Å²	56	60.9 Å²	60.9	29%	0.293	31%	0.312	S	S	.	.	H	α-helix	trans	-50.7	-44.2	-174.5	-173.3	63.8	0	0	0	113.5	N56 R57 I58 L88 P94 A97	L54-N56 VanDerWaalsContact C-N 3.28Å; L54-N56 PolarHBondContact O-N 2.8Å; L54-R57 PolarHBondContact O-N 2.75Å; L54-I58 HydrophobicContact CD1-CD1 4.39Å; L54-I58 HydrophobicContact CD2-CD1 4.48Å; L54-I58 HydrophobicContact CG-CD1 3.93Å; L54-I58 HydrophobicContact CG-CG1 4.49Å; L54-I58 WeakPolarHBondContact O-CG1 3.49Å; L54-I58 PolarHBondContact O-N 2.77Å; L54-L88 HydrophobicContact CD1-CD2 3.53Å; L54-P94 HydrophobicContact CD2-CB 4.38Å; L54-P94 HydrophobicContact CD2-CG 3.72Å; L54-A97 HydrophobicContact CD1-CB 3.78Å; L54-A97 HydrophobicContact CD2-CB 4.38Å; L54-A97 HydrophobicContact CG-CB 4.42Å
55	N	97.7	Very high	97.3	Very high	124 Å²	124	60.2 Å²	60.2	66%	0.663	31%	0.31	S	S	*	.	H	α-helix	trans	-62.4	-34	179.6	-69.5	-19.3	0	0	0	113.1	G53 R59	G53-N55 VanDerWaalsContact C-N 3.27Å; G53-N55 PolarHBondContact O-N 3.46Å; G53-N55 VanDerWaalsContact O-N 3.15Å; N55-R59 WeakPolarHBondContact O-CB 3.42Å; N55-R59 PolarHBondContact O-N 3.36Å; N55-R59 VanDerWaalsContact O-N 3.1Å
56	N	97.8	Very high	97.3	Very high	73 Å²	73	63.1 Å²	63.1	39%	0.39	32%	0.322	S	S	.	.	H	α-helix	trans	-70.1	-44.2	176.1	-68.4	-13.6	0	0	0	110.2	G53 L54 I58 R59 M60	G53-N56 WeakPolarHBondContact O-CB 3.46Å; G53-N56 PolarHBondContact O-N 2.93Å; L54-N56 VanDerWaalsContact C-N 3.28Å; L54-N56 PolarHBondContact O-N 2.8Å; N56-I58 PolarHBondContact O-N 3.48Å; N56-R59 PolarHBondContact O-N 3.19Å; N56-M60 WeakPolarHBondContact O-CB 3.22Å; N56-M60 PolarHBondContact O-N 2.78Å
57	R	98.5	Very high	97.3	Very high	7 Å²	7	57.3 Å²	57.3	3%	0.026	30%	0.301	C	S	.	.	H	α-helix	trans	-59.5	-48.1	177.3	-58.6	178.7	72	-165.7	-1.1	111.2	L48 S49 C52 G53 L54 R59 M60 I61 A84 D87 L88	L48-R57 VanDerWaalsContact O-CZ 3.29Å; L48-R57 PolarHBondContact O-NE 3.49Å; L48-R57 PolarHBondContact O-NH2 3.39Å; L48-R57 VanDerWaalsContact O-NH2 3.09Å; S49-R57 WeakPolarHBondContact O-CD 3.35Å; S49-R57 PolarHBondContact O-NE 2.79Å; C52-R57 HydrophobicContact CB-CG 4.12Å; C52-R57 WeakPolarHBondContact O-CD 3.3Å; G53-R57 PolarHBondContact O-N 3.09Å; L54-R57 PolarHBondContact O-N 2.75Å; R57-R59 VanDerWaalsContact C-N 3.34Å; R57-R59 PolarHBondContact O-N 2.77Å; R57-M60 PolarHBondContact O-N 3.13Å; R57-I61 VanDerWaalsContact O-CG1 3.26Å; R57-I61 WeakPolarHBondContact O-CG1 3.37Å; R57-I61 PolarHBondContact O-N 3.43Å; R57-A84 PolarHBondContact NH2-O 3.49Å; R57-D87 IonicContact CZ-OD1 3.93Å; R57-D87 IonicContact CZ-OD2 3.53Å; R57-D87 IonicContact NH1-OD1 2.71Å; R57-D87 PolarHBondContact NH1-OD1 3.15Å; R57-D87 IonicContact NH1-OD2 3.36Å; R57-D87 PolarHBondContact NH1-OD2 3.2Å; R57-D87 IonicContact NH2-OD1 3.67Å; R57-D87 PolarHBondContact NH2-OD1 3.36Å; R57-D87 IonicContact NH2-OD2 2.83Å; R57-L88 HydrophobicContact CB-CD1 4.3Å; R57-L88 VanDerWaalsContact NH1-CD2 3.26Å
58	I	98.7	Very high	97.3	Very high	41 Å²	41	54.1 Å²	54.1	21%	0.21	29%	0.286	C	S	.	.	H	α-helix	trans	-58.7	-44.9	176.8	-69.3	171	0	0	0	111.2	L54 N56 I61 G62 E96 A97 A100	L54-I58 HydrophobicContact CD1-CD1 4.39Å; L54-I58 HydrophobicContact CD2-CD1 4.48Å; L54-I58 HydrophobicContact CG-CD1 3.93Å; L54-I58 HydrophobicContact CG-CG1 4.49Å; L54-I58 WeakPolarHBondContact O-CG1 3.49Å; L54-I58 PolarHBondContact O-N 2.77Å; N56-I58 PolarHBondContact O-N 3.48Å; I58-I61 PolarHBondContact O-N 3.28Å; I58-G62 PolarHBondContact O-N 3.07Å; I58-E96 HydrophobicContact CD1-CB 4.2Å; I58-A97 HydrophobicContact CD1-CB 4.08Å; I58-A97 HydrophobicContact CG1-CB 4.38Å; I58-A100 HydrophobicContact CG1-CB 4.35Å; I58-A100 HydrophobicContact CG2-CB 4.15Å
59	R	98.4	Very high	97.1	Very high	160 Å²	160	59 Å²	59	60%	0.604	31%	0.307	S	S	*	.	H	α-helix	trans	-61.9	-47.2	177.8	-176.1	-169.9	-61.7	151.7	2.3	111.7	N55 N56 R57 I61 G62 Q63	N55-R59 WeakPolarHBondContact O-CB 3.42Å; N55-R59 PolarHBondContact O-N 3.36Å; N55-R59 VanDerWaalsContact O-N 3.1Å; N56-R59 PolarHBondContact O-N 3.19Å; R57-R59 VanDerWaalsContact C-N 3.34Å; R57-R59 PolarHBondContact O-N 2.77Å; R59-I61 VanDerWaalsContact C-N 3.34Å; R59-G62 PolarHBondContact O-N 3.33Å; R59-Q63 PolarHBondContact O-N 3.43Å; R59-Q63 VanDerWaalsContact O-N 3.12Å
60	M	98.5	Very high	97	Very high	13 Å²	13	62.6 Å²	62.6	6%	0.064	33%	0.328	C	S	.	.	H	α-helix	trans	-63.5	-41.5	179.4	179.9	52.2	71.2	0	0	110.9	I44 E47 L48 N56 R57 G62 Q63 I64	I44-M60 HydrophobicContact CG2-CG 4.5Å; I44-M60 HydrophobicContact CG2-SD 4.15Å; E47-M60 HydrophobicContact CB-CE 4.05Å; E47-M60 HydrophobicContact CB-CG 4.29Å; E47-M60 VanDerWaalsContact CD-CE 3.45Å; E47-M60 HydrophobicContact CG-CE 4.34Å; E47-M60 WeakPolarHBondContact OE2-CE 3.23Å; L48-M60 HydrophobicContact CD1-CG 4.37Å; L48-M60 HydrophobicContact CD2-CB 3.83Å; L48-M60 HydrophobicContact CD2-CG 3.57Å; L48-M60 HydrophobicContact CG-CB 4.37Å; L48-M60 HydrophobicContact CG-CG 3.66Å; N56-M60 WeakPolarHBondContact O-CB 3.22Å; N56-M60 PolarHBondContact O-N 2.78Å; R57-M60 PolarHBondContact O-N 3.13Å; M60-G62 VanDerWaalsContact C-N 3.29Å; M60-G62 PolarHBondContact O-N 3.03Å; M60-Q63 WeakPolarHBondContact O-CB 3.28Å; M60-Q63 PolarHBondContact O-N 3.45Å; M60-Q63 HydrophobicContact SD-CB 4.43Å; M60-Q63 PolarHBondContact SD-OE1 3.32Å; M60-I64 WeakPolarHBondContact O-CG1 3.49Å; M60-I64 PolarHBondContact O-N 3.49Å; M60-I64 HydrophobicContact SD-CD1 4.31Å; M60-I64 HydrophobicContact SD-CG1 4.18Å
61	I	98.8	Very high	97.1	Very high	1 Å²	1	59.3 Å²	59.3	1%	0.005	31%	0.31	C	S	.	.	H	α-helix	trans	-54	-47.8	172	-71.8	166.2	0	0	0	111	L48 R57 I58 R59 Q63 I64 C65 V85 L88 A100 V101 L104	L48-I61 HydrophobicContact CD2-CG1 3.65Å; R57-I61 VanDerWaalsContact O-CG1 3.26Å; R57-I61 WeakPolarHBondContact O-CG1 3.37Å; R57-I61 PolarHBondContact O-N 3.43Å; I58-I61 PolarHBondContact O-N 3.28Å; R59-I61 VanDerWaalsContact C-N 3.34Å; I61-Q63 VanDerWaalsContact C-N 3.28Å; I61-Q63 PolarHBondContact O-N 3.49Å; I61-I64 PolarHBondContact O-N 3.35Å; I61-I64 VanDerWaalsContact O-N 3.15Å; I61-C65 PolarHBondContact O-N 3.04Å; I61-C65 PolarHBondContact O-SG 3.09Å; I61-V85 HydrophobicContact CD1-CB 4.33Å; I61-V85 HydrophobicContact CD1-CG1 4.02Å; I61-V85 HydrophobicContact CG1-CG1 4.05Å; I61-L88 HydrophobicContact CD1-CD1 3.7Å; I61-A100 HydrophobicContact CB-CB 4.44Å; I61-A100 HydrophobicContact CD1-CB 4.27Å; I61-A100 HydrophobicContact CG2-CB 4Å; I61-A100 WeakPolarHBondContact CG2-O 3.32Å; I61-V101 HydrophobicContact CD1-CG2 4.02Å; I61-L104 HydrophobicContact CG2-CB 3.83Å; I61-L104 HydrophobicContact CG2-CD2 4.28Å; I61-L104 HydrophobicContact CG2-CG 4.47Å
62	G	98.6	Very high	97.2	Very high	37 Å²	37	53.7 Å²	53.7	38%	0.381	28%	0.283	S	S	.	.	H	α-helix	trans	-57.7	-38.7	176.9	0	0	0	0	0	113.3	I58 R59 M60 C65	I58-G62 PolarHBondContact O-N 3.07Å; R59-G62 PolarHBondContact O-N 3.33Å; M60-G62 VanDerWaalsContact C-N 3.29Å; M60-G62 PolarHBondContact O-N 3.03Å; G62-C65 WeakPolarHBondContact O-CB 2.9Å; G62-C65 PolarHBondContact O-N 3.45Å
63	Q	98.1	Very high	97.2	Very high	78 Å²	78	52.4 Å²	52.4	36%	0.364	27%	0.274	S	S	.	.	H	α-helix	trans	-66	-45.1	175.2	-66.9	175.5	-30.1	0	0	111.5	R59 M60 I61 C65 E66 V67	R59-Q63 PolarHBondContact O-N 3.43Å; R59-Q63 VanDerWaalsContact O-N 3.12Å; M60-Q63 WeakPolarHBondContact O-CB 3.28Å; M60-Q63 PolarHBondContact O-N 3.45Å; M60-Q63 HydrophobicContact SD-CB 4.43Å; M60-Q63 PolarHBondContact SD-OE1 3.32Å; I61-Q63 VanDerWaalsContact C-N 3.28Å; I61-Q63 PolarHBondContact O-N 3.49Å; Q63-C65 VanDerWaalsContact C-N 3.29Å; Q63-C65 PolarHBondContact O-N 3.43Å; Q63-E66 PolarHBondContact O-N 3.08Å; Q63-V67 WeakPolarHBondContact O-CG2 3.48Å; Q63-V67 PolarHBondContact O-N 3.21Å
64	I	98.4	Very high	97.1	Very high	4 Å²	4	53.1 Å²	53.1	2%	0.021	27%	0.265	C	S	.	.	H	α-helix	trans	-64.2	-34.2	178.4	-61	-58.2	0	0	0	111.7	F38 I40 I44 M60 I61 E66 V67 A68 F73 L81 L104	F38-I64 HydrophobicContact CE1-CD1 4.49Å; I40-I64 HydrophobicContact CD1-CD1 4.2Å; I44-I64 HydrophobicContact CD1-CD1 4.36Å; I44-I64 HydrophobicContact CG2-CD1 3.76Å; I44-I64 HydrophobicContact CG2-CG1 4.28Å; M60-I64 WeakPolarHBondContact O-CG1 3.49Å; M60-I64 PolarHBondContact O-N 3.49Å; M60-I64 HydrophobicContact SD-CD1 4.31Å; M60-I64 HydrophobicContact SD-CG1 4.18Å; I61-I64 PolarHBondContact O-N 3.35Å; I61-I64 VanDerWaalsContact O-N 3.15Å; I64-E66 VanDerWaalsContact C-N 3.3Å; I64-E66 PolarHBondContact O-N 3.23Å; I64-V67 PolarHBondContact O-N 3.42Å; I64-A68 VanDerWaalsContact O-CB 3.29Å; I64-A68 WeakPolarHBondContact O-CB 3.08Å; I64-A68 PolarHBondContact O-N 3.33Å; I64-F73 HydrophobicContact CG2-CE2 4.31Å; I64-F73 HydrophobicContact CG2-CZ 3.89Å; I64-L81 HydrophobicContact CG1-CD2 4.42Å; I64-L81 HydrophobicContact CG2-CD1 3.73Å; I64-L81 HydrophobicContact CG2-CD2 4.1Å; I64-L104 HydrophobicContact CB-CD1 4.19Å; I64-L104 HydrophobicContact CG2-CD1 3.69Å
65	C	98.5	Very high	96.8	Very high	9 Å²	9	57.2 Å²	57.2	6%	0.061	28%	0.283	C	S	.	.	H	α-helix	trans	-55	-43.6	172.7	-71.1	0	0	0	0	112.6	I61 G62 Q63 A68 K69 L104 A107	I61-C65 PolarHBondContact O-N 3.04Å; I61-C65 PolarHBondContact O-SG 3.09Å; G62-C65 WeakPolarHBondContact O-CB 2.9Å; G62-C65 PolarHBondContact O-N 3.45Å; Q63-C65 VanDerWaalsContact C-N 3.29Å; Q63-C65 PolarHBondContact O-N 3.43Å; C65-A68 PolarHBondContact O-N 3.38Å; C65-K69 WeakPolarHBondContact O-CG 3.44Å; C65-K69 PolarHBondContact O-N 3.36Å; C65-L104 WeakPolarHBondContact SG-CA 3.39Å; C65-A107 HydrophobicContact CB-CB 4.08Å
66	E	97.3	Very high	96.7	Very high	111 Å²	111	56.8 Å²	56.8	52%	0.519	28%	0.276	S	S	.	.	H	α-helix	trans	-70.2	-37	-179.5	-62.8	-52.6	111.5	0	0	112	Q63 I64 K69 T70	Q63-E66 PolarHBondContact O-N 3.08Å; I64-E66 VanDerWaalsContact C-N 3.3Å; I64-E66 PolarHBondContact O-N 3.23Å; E66-K69 IonicContact OE1-NZ 2.82Å; E66-K69 PolarHBondContact OE1-NZ 3.21Å; E66-T70 PolarHBondContact O-OG1 3.5Å
67	V	97.1	Very high	96.7	Very high	10 Å²	10	53.4 Å²	53.4	6%	0.061	26%	0.259	C	S	.	.	H	α-helix	trans	-68.6	-43.7	175	-170.8	0	0	0	0	110.9	L19 F38 Q63 I64 K69 T70 K71 F73	L19-V67 HydrophobicContact CD2-CG2 4.48Å; F38-V67 HydrophobicContact CB-CG1 4.06Å; F38-V67 HydrophobicContact CD1-CG1 3.66Å; F38-V67 HydrophobicContact CD2-CG1 3.64Å; F38-V67 HydrophobicContact CE1-CG1 3.92Å; F38-V67 HydrophobicContact CE2-CG1 3.91Å; F38-V67 HydrophobicContact CE2-CG2 4.46Å; F38-V67 HydrophobicContact CG-CG1 3.5Å; F38-V67 VanDerWaalsContact CG-CG1 3.5Å; F38-V67 HydrophobicContact CZ-CG1 4.04Å; F38-V67 HydrophobicContact CZ-CG2 4.29Å; Q63-V67 WeakPolarHBondContact O-CG2 3.48Å; Q63-V67 PolarHBondContact O-N 3.21Å; I64-V67 PolarHBondContact O-N 3.42Å; V67-K69 PolarHBondContact O-N 3.46Å; V67-K69 VanDerWaalsContact O-N 3.15Å; V67-T70 PolarHBondContact O-N 2.87Å; V67-T70 PolarHBondContact O-OG1 3.13Å; V67-K71 HydrophobicContact CG1-CB 4.08Å; V67-K71 HydrophobicContact CG1-CD 4.07Å; V67-K71 HydrophobicContact CG1-CG 4.29Å; V67-K71 PolarHBondContact O-N 3.42Å; V67-F73 HydrophobicContact CB-CE1 4.2Å; V67-F73 HydrophobicContact CG1-CE1 3.8Å
68	A	96.8	Very high	96.7	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-58.2	-30.2	-179	0	0	0	0	0	112.8	I64 C65 F73 A107 I108 G111 Q112	I64-A68 VanDerWaalsContact O-CB 3.29Å; I64-A68 WeakPolarHBondContact O-CB 3.08Å; I64-A68 PolarHBondContact O-N 3.33Å; C65-A68 PolarHBondContact O-N 3.38Å; A68-F73 VanDerWaalsContact CA-CZ 3.5Å; A68-F73 HydrophobicContact CB-CE1 4.34Å; A68-F73 HydrophobicContact CB-CE2 4Å; A68-F73 HydrophobicContact CB-CZ 3.56Å; A68-A107 HydrophobicContact CB-CB 4.19Å; A68-I108 HydrophobicContact CB-CG1 4.19Å; A68-G111 WeakPolarHBondContact O-CA 3.34Å; A68-Q112 PolarHBondContact O-NE2 2.88Å
69	K	93.6	Very high	96.6	Very high	103 Å²	103	54.4 Å²	54.4	45%	0.448	26%	0.264	S	S	.	.	H	α-helix	trans	-77.4	-23.6	178.1	-67.7	166	-169.9	166.8	0	113.5	C65 E66 V67 A107	C65-K69 WeakPolarHBondContact O-CG 3.44Å; C65-K69 PolarHBondContact O-N 3.36Å; E66-K69 IonicContact OE1-NZ 2.82Å; E66-K69 PolarHBondContact OE1-NZ 3.21Å; V67-K69 PolarHBondContact O-N 3.46Å; V67-K69 VanDerWaalsContact O-N 3.15Å; K69-A107 HydrophobicContact CG-CB 4.2Å
70	T	92.4	Very high	96.6	Very high	103 Å²	103	48.3 Å²	48.3	63%	0.632	25%	0.248	S	C	*	.	H	α-helix	trans	-120.1	-21.6	-164.7	56.3	0	0	0	0	114.2	E66 V67	E66-T70 PolarHBondContact O-OG1 3.5Å; V67-T70 PolarHBondContact O-N 2.87Å; V67-T70 PolarHBondContact O-OG1 3.13Å
71	K	95.1	Very high	96.6	Very high	70 Å²	70	47.7 Å²	47.7	30%	0.304	25%	0.245	S	C	.	.	S	Bend	trans	-129	145	-179.1	-57.9	-172.4	-176.6	175.8	0	110.3	F38 V67 Q112	F38-K71 HydrophobicContact CB-CB 4.02Å; F38-K71 HydrophobicContact CB-CD 4.23Å; F38-K71 HydrophobicContact CD2-CD 4.02Å; V67-K71 HydrophobicContact CG1-CB 4.08Å; V67-K71 HydrophobicContact CG1-CD 4.07Å; V67-K71 HydrophobicContact CG1-CG 4.29Å; V67-K71 PolarHBondContact O-N 3.42Å; K71-Q112 PolarHBondContact O-NE2 2.92Å
72	K	95.3	Very high	96.5	Very high	53 Å²	53	49.7 Å²	49.7	23%	0.23	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-76.5	133.4	169.8	-62.5	-60.5	-179.1	177.3	0	109.2	E37 F38 G111	E37-K72 CarbonylContact C-O 3.48Å; E37-K72 VanDerWaalsContact CA-O 3.25Å; E37-K72 WeakPolarHBondContact CA-O 3.44Å; F38-K72 PolarHBondContact N-O 3.25Å; K72-G111 PolarHBondContact NZ-O 2.94Å
73	F	96.3	Very high	96.5	Very high	2 Å²	2	56 Å²	56	1%	0.009	27%	0.269	C	S	.	.	B	Isolated β-bridge	trans	-79.2	156.9	176	-65.8	-16.7	0	0	0	111.4	F38 I40 I64 V67 A68 A77 V78 L81 I108 Q112 R115	F38-F73 HydrophobicContact CB-CD1 4.06Å; F38-F73 HydrophobicContact CB-CE1 4.5Å; F38-F73 HydrophobicContact CD1-CD1 4.1Å; F38-F73 HydrophobicContact CD1-CE1 4Å; F38-F73 WeakPolarHBondContact O-CA 3.34Å; I40-F73 HydrophobicContact CD1-CE1 4.42Å; I40-F73 HydrophobicContact CD1-CZ 4.39Å; I64-F73 HydrophobicContact CG2-CE2 4.31Å; I64-F73 HydrophobicContact CG2-CZ 3.89Å; V67-F73 HydrophobicContact CB-CE1 4.2Å; V67-F73 HydrophobicContact CG1-CE1 3.8Å; A68-F73 VanDerWaalsContact CA-CZ 3.5Å; A68-F73 HydrophobicContact CB-CE1 4.34Å; A68-F73 HydrophobicContact CB-CE2 4Å; A68-F73 HydrophobicContact CB-CZ 3.56Å; F73-A77 HydrophobicContact CB-CB 3.7Å; F73-A77 HydrophobicContact CD2-CB 4.38Å; F73-A77 HydrophobicContact CG-CB 4.34Å; F73-V78 HydrophobicContact CD2-CG2 3.97Å; F73-L81 HydrophobicContact CD2-CD1 4.03Å; F73-L81 HydrophobicContact CE2-CD1 3.49Å; F73-L81 VanDerWaalsContact CE2-CD1 3.49Å; F73-L81 HydrophobicContact CZ-CD1 4.24Å; F73-I108 HydrophobicContact CE2-CG1 4.42Å; F73-Q112 HydrophobicContact CD2-CG 4.27Å; F73-R115 PolarHBondContact O-NH1 3.1Å; F73-R115 PolarHBondContact O-NH2 3.48Å
74	E	95.1	Very high	96.5	Very high	60 Å²	60	53.3 Å²	53.3	28%	0.28	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-62	167.5	169.7	66.8	-175.7	150	0	0	112.4	E37 F38 I39 I40 A77	E37-E74 HydrophobicContact CB-CB 4.42Å; E37-E74 WeakPolarHBondContact OE2-CA 2.91Å; F38-E74 PolarHBondContact O-N 3.37Å; I39-E74 VanDerWaalsContact CA-OE1 3.3Å; I39-E74 WeakPolarHBondContact CA-OE1 3.17Å; I39-E74 VanDerWaalsContact CG2-OE1 3.27Å; I39-E74 WeakPolarHBondContact CG2-OE1 3.45Å; I40-E74 PolarHBondContact N-OE1 3.43Å; E74-A77 HydrophobicContact CG-CB 3.8Å; E74-A77 WeakPolarHBondContact O-CB 3.09Å; E74-A77 PolarHBondContact O-N 3.27Å
75	E	92.9	Very high	96.5	Very high	142 Å²	142	53.1 Å²	53.1	66%	0.664	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	141.1	173.6	-165.7	175.1	-166.3	0	0	111.1	A77	E75-A77 PolarHBondContact O-N 2.97Å
76	H	95.2	Very high	96.4	Very high	115 Å²	115	54 Å²	54	53%	0.532	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.6	-2.2	-179.4	-53.5	-47.4	0	0	0	117.8	V78 E79 A80	H76-V78 VanDerWaalsContact C-N 3.33Å; H76-V78 PolarHBondContact O-N 2.95Å; H76-E79 VanDerWaalsContact C-OE2 3.28Å; H76-E79 WeakPolarHBondContact CA-OE2 3.45Å; H76-E79 IonicContact ND1-OE1 2.77Å; H76-E79 PolarHBondContact ND1-OE1 3.28Å; H76-E79 VanDerWaalsContact ND1-OE1 3.15Å; H76-E79 PolarHBondContact O-N 3.02Å; H76-A80 PolarHBondContact O-N 3.3Å
77	A	96.8	Very high	96.4	Very high	3 Å²	3	50.3 Å²	50.3	3%	0.025	25%	0.25	C	S	.	.	H	α-helix	trans	-60.6	-39.5	179.5	0	0	0	0	0	113.3	I40 F73 E74 E75 E79 A80 L81	I40-A77 HydrophobicContact CB-CB 4.17Å; I40-A77 HydrophobicContact CG1-CB 3.5Å; F73-A77 HydrophobicContact CB-CB 3.7Å; F73-A77 HydrophobicContact CD2-CB 4.38Å; F73-A77 HydrophobicContact CG-CB 4.34Å; E74-A77 HydrophobicContact CG-CB 3.8Å; E74-A77 WeakPolarHBondContact O-CB 3.09Å; E74-A77 PolarHBondContact O-N 3.27Å; E75-A77 PolarHBondContact O-N 2.97Å; A77-E79 VanDerWaalsContact C-N 3.34Å; A77-A80 PolarHBondContact O-N 2.91Å; A77-L81 WeakPolarHBondContact O-CB 3.43Å; A77-L81 VanDerWaalsContact O-CG 3.3Å; A77-L81 WeakPolarHBondContact O-CG 3.39Å; A77-L81 PolarHBondContact O-N 2.8Å
78	V	97.9	Very high	96.4	Very high	11 Å²	11	49.8 Å²	49.8	7%	0.067	25%	0.247	C	C	.	.	H	α-helix	trans	-66.3	-39.9	179.9	175.1	0	0	0	0	110.6	F73 H76 L81 W82 I108 Q112 L116 L119 F123	F73-V78 HydrophobicContact CD2-CG2 3.97Å; H76-V78 VanDerWaalsContact C-N 3.33Å; H76-V78 PolarHBondContact O-N 2.95Å; V78-L81 PolarHBondContact O-N 3.47Å; V78-W82 WeakPolarHBondContact O-CB 3.33Å; V78-W82 PolarHBondContact O-N 3.41Å; V78-I108 HydrophobicContact CG1-CD1 4.36Å; V78-I108 HydrophobicContact CG1-CG2 3.79Å; V78-I108 HydrophobicContact CG2-CG2 4.03Å; V78-Q112 HydrophobicContact CG2-CG 4.47Å; V78-L116 HydrophobicContact CB-CD2 4.44Å; V78-L116 HydrophobicContact CG1-CD2 3.93Å; V78-L116 HydrophobicContact CG2-CD2 4.1Å; V78-L119 HydrophobicContact CB-CD1 3.86Å; V78-L119 HydrophobicContact CG1-CD1 3.64Å; V78-F123 HydrophobicContact CG1-CE2 4.03Å; V78-F123 HydrophobicContact CG1-CZ 3.69Å
79	E	97.8	Very high	96.3	Very high	58 Å²	58	50.3 Å²	50.3	27%	0.271	25%	0.25	S	S	.	.	H	α-helix	trans	-62.6	-43.5	175.2	-64.1	93.2	130	0	0	111.6	H76 A77 W82 K83 L119	H76-E79 VanDerWaalsContact C-OE2 3.28Å; H76-E79 WeakPolarHBondContact CA-OE2 3.45Å; H76-E79 IonicContact ND1-OE1 2.77Å; H76-E79 PolarHBondContact ND1-OE1 3.28Å; H76-E79 VanDerWaalsContact ND1-OE1 3.15Å; H76-E79 PolarHBondContact O-N 3.02Å; A77-E79 VanDerWaalsContact C-N 3.34Å; E79-W82 PolarHBondContact O-N 3.13Å; E79-K83 VanDerWaalsContact O-CG 3.31Å; E79-K83 WeakPolarHBondContact O-CG 3.34Å; E79-K83 PolarHBondContact O-N 2.93Å; E79-L119 VanDerWaalsContact CD-CD1 3.45Å; E79-L119 HydrophobicContact CG-CD1 3.67Å; E79-L119 HydrophobicContact CG-CD2 3.8Å; E79-L119 HydrophobicContact CG-CG 4.25Å; E79-L119 WeakPolarHBondContact OE2-CD1 3.43Å
80	A	98	Very high	96.4	Very high	32 Å²	32	50.2 Å²	50.2	26%	0.264	25%	0.251	S	S	.	.	H	α-helix	trans	-64.4	-46.5	177.4	0	0	0	0	0	111.6	L45 H76 A77 W82 K83 A84	L45-A80 HydrophobicContact CD1-CB 4.12Å; L45-A80 HydrophobicContact CD2-CB 4.05Å; H76-A80 PolarHBondContact O-N 3.3Å; A77-A80 PolarHBondContact O-N 2.91Å; A80-W82 PolarHBondContact O-N 3.4Å; A80-K83 PolarHBondContact O-N 2.82Å; A80-A84 WeakPolarHBondContact O-CB 3.5Å; A80-A84 PolarHBondContact O-N 2.7Å
81	L	98.2	Very high	96.4	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-59.2	-46.7	175.5	-74.2	171.6	0	0	0	111.5	I40 L48 I64 F73 A77 V78 K83 A84 V85 I108	I40-L81 HydrophobicContact CD1-CD1 3.93Å; I40-L81 HydrophobicContact CD1-CD2 4.27Å; I40-L81 HydrophobicContact CD1-CG 4.3Å; I40-L81 HydrophobicContact CG1-CD1 4.11Å; I40-L81 HydrophobicContact CG1-CG 4.24Å; I40-L81 HydrophobicContact CG2-CD2 4.03Å; I40-L81 HydrophobicContact CG2-CG 4.26Å; L48-L81 HydrophobicContact CD1-CD2 3.48Å; L48-L81 VanDerWaalsContact CD1-CD2 3.48Å; I64-L81 HydrophobicContact CG1-CD2 4.42Å; I64-L81 HydrophobicContact CG2-CD1 3.73Å; I64-L81 HydrophobicContact CG2-CD2 4.1Å; F73-L81 HydrophobicContact CD2-CD1 4.03Å; F73-L81 HydrophobicContact CE2-CD1 3.49Å; F73-L81 VanDerWaalsContact CE2-CD1 3.49Å; F73-L81 HydrophobicContact CZ-CD1 4.24Å; A77-L81 WeakPolarHBondContact O-CB 3.43Å; A77-L81 VanDerWaalsContact O-CG 3.3Å; A77-L81 WeakPolarHBondContact O-CG 3.39Å; A77-L81 PolarHBondContact O-N 2.8Å; V78-L81 PolarHBondContact O-N 3.47Å; L81-K83 PolarHBondContact O-N 2.85Å; L81-A84 PolarHBondContact O-N 3.44Å; L81-A84 VanDerWaalsContact O-N 3.15Å; L81-V85 WeakPolarHBondContact O-CG2 3.3Å; L81-V85 PolarHBondContact O-N 3.45Å; L81-I108 HydrophobicContact CD1-CD1 4.46Å
82	W	98.1	Very high	96.3	Very high	43 Å²	43	52 Å²	52	16%	0.163	26%	0.258	C	S	.	.	H	α-helix	trans	-59.6	-48.5	179	173.3	-118	0	0	0	111.9	V78 E79 A80 A84 V85 A86 L89 V101 L105 F123 V126	V78-W82 WeakPolarHBondContact O-CB 3.33Å; V78-W82 PolarHBondContact O-N 3.41Å; E79-W82 PolarHBondContact O-N 3.13Å; A80-W82 PolarHBondContact O-N 3.4Å; W82-A84 PolarHBondContact O-N 3.3Å; W82-V85 PolarHBondContact O-N 2.86Å; W82-A86 HydrophobicContact CD2-CB 4.12Å; W82-A86 HydrophobicContact CE3-CB 4.24Å; W82-A86 HydrophobicContact CH2-CB 3.86Å; W82-A86 HydrophobicContact CZ2-CB 3.72Å; W82-A86 HydrophobicContact CZ3-CB 4.12Å; W82-A86 WeakPolarHBondContact O-CB 3.36Å; W82-A86 PolarHBondContact O-N 3.36Å; W82-L89 HydrophobicContact CH2-CD1 3.89Å; W82-L89 HydrophobicContact CZ3-CD1 3.93Å; W82-V101 HydrophobicContact CZ3-CG1 4.21Å; W82-L105 HydrophobicContact CE3-CD2 4.01Å; W82-L105 HydrophobicContact CZ3-CD1 4.31Å; W82-L105 HydrophobicContact CZ3-CD2 4.09Å; W82-F123 HydrophobicContact CB-CE1 4.34Å; W82-F123 HydrophobicContact CD2-CE1 4.06Å; W82-F123 HydrophobicContact CE3-CE1 4.19Å; W82-F123 HydrophobicContact CG-CE1 4.12Å; W82-V126 HydrophobicContact CH2-CB 4.46Å; W82-V126 HydrophobicContact CH2-CG1 3.87Å; W82-V126 HydrophobicContact CH2-CG2 3.77Å; W82-V126 HydrophobicContact CZ2-CG2 3.6Å
83	K	97.6	Very high	96.3	Very high	170 Å²	170	54 Å²	54	74%	0.739	26%	0.264	S	S	*	.	H	α-helix	trans	-56.9	-36.5	176	-73.8	172.5	-175.9	175	0	112.2	E79 A80 L81	E79-K83 VanDerWaalsContact O-CG 3.31Å; E79-K83 WeakPolarHBondContact O-CG 3.34Å; E79-K83 PolarHBondContact O-N 2.93Å; A80-K83 PolarHBondContact O-N 2.82Å; L81-K83 PolarHBondContact O-N 2.85Å
84	A	98.1	Very high	96.3	Very high	20 Å²	20	56.6 Å²	56.6	17%	0.165	28%	0.281	C	S	.	.	H	α-helix	trans	-74.4	-21.4	-177.6	0	0	0	0	0	114.1	L45 L48 R57 A80 L81 W82	L45-A84 HydrophobicContact CD2-CB 4.32Å; L48-A84 HydrophobicContact CB-CB 3.99Å; R57-A84 PolarHBondContact NH2-O 3.49Å; A80-A84 WeakPolarHBondContact O-CB 3.5Å; A80-A84 PolarHBondContact O-N 2.7Å; L81-A84 PolarHBondContact O-N 3.44Å; L81-A84 VanDerWaalsContact O-N 3.15Å; W82-A84 PolarHBondContact O-N 3.3Å
85	V	98.1	Very high	96.4	Very high	1 Å²	1	56.5 Å²	56.5	1%	0.006	28%	0.283	C	S	.	.	H	α-helix	trans	-124.2	-7.5	-172.2	-51.9	0	0	0	0	115	L48 I61 L81 W82 D87 L88 V101 L104	L48-V85 HydrophobicContact CB-CG1 4.43Å; L48-V85 HydrophobicContact CD1-CG1 4.4Å; L48-V85 HydrophobicContact CD2-CG1 3.99Å; I61-V85 HydrophobicContact CD1-CB 4.33Å; I61-V85 HydrophobicContact CD1-CG1 4.02Å; I61-V85 HydrophobicContact CG1-CG1 4.05Å; L81-V85 WeakPolarHBondContact O-CG2 3.3Å; L81-V85 PolarHBondContact O-N 3.45Å; W82-V85 PolarHBondContact O-N 2.86Å; V85-D87 PolarHBondContact O-N 2.74Å; V85-D87 VanDerWaalsContact O-N 3.13Å; V85-L88 WeakPolarHBondContact O-CB 3.2Å; V85-L88 PolarHBondContact O-N 3.18Å; V85-V101 HydrophobicContact CB-CG2 4.03Å; V85-V101 HydrophobicContact CG2-CG1 3.9Å; V85-V101 HydrophobicContact CG2-CG2 4.1Å; V85-L104 HydrophobicContact CG2-CD2 4Å
86	A	97.3	Very high	96.6	Very high	26 Å²	26	55.5 Å²	55.5	22%	0.215	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-58.3	-28.8	-176.5	0	0	0	0	0	113.7	W82 L88 L89	W82-A86 HydrophobicContact CD2-CB 4.12Å; W82-A86 HydrophobicContact CE3-CB 4.24Å; W82-A86 HydrophobicContact CH2-CB 3.86Å; W82-A86 HydrophobicContact CZ2-CB 3.72Å; W82-A86 HydrophobicContact CZ3-CB 4.12Å; W82-A86 WeakPolarHBondContact O-CB 3.36Å; W82-A86 PolarHBondContact O-N 3.36Å; A86-L88 PolarHBondContact O-N 3.15Å; A86-L89 PolarHBondContact O-N 2.81Å
87	D	97	Very high	96.7	Very high	34 Å²	34	50 Å²	50	18%	0.182	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-67.7	-16.9	176.9	74.4	-67.5	0	0	0	113.4	R57 V85 L89 Q90 R93	R57-D87 IonicContact CZ-OD1 3.93Å; R57-D87 IonicContact CZ-OD2 3.53Å; R57-D87 IonicContact NH1-OD1 2.71Å; R57-D87 PolarHBondContact NH1-OD1 3.15Å; R57-D87 IonicContact NH1-OD2 3.36Å; R57-D87 PolarHBondContact NH1-OD2 3.2Å; R57-D87 IonicContact NH2-OD1 3.67Å; R57-D87 PolarHBondContact NH2-OD1 3.36Å; R57-D87 IonicContact NH2-OD2 2.83Å; V85-D87 PolarHBondContact O-N 2.74Å; V85-D87 VanDerWaalsContact O-N 3.13Å; D87-L89 VanDerWaalsContact C-N 3.31Å; D87-Q90 WeakPolarHBondContact O-CG 3.46Å; D87-R93 WeakPolarHBondContact O-CG 3.4Å; D87-R93 PolarHBondContact O-NE 3Å; D87-R93 IonicContact OD2-CZ 3.71Å; D87-R93 IonicContact OD2-NE 3.78Å; D87-R93 IonicContact OD2-NH2 3.95Å; D87-R93 PolarHBondContact OD2-NH2 2.9Å
88	L	97.1	Very high	96.8	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-81	-11.2	178.3	-63.8	179.6	0	0	0	112.9	L54 R57 I61 V85 A86 R93 A97 R98 V101	L54-L88 HydrophobicContact CD1-CD2 3.53Å; R57-L88 HydrophobicContact CB-CD1 4.3Å; R57-L88 VanDerWaalsContact NH1-CD2 3.26Å; I61-L88 HydrophobicContact CD1-CD1 3.7Å; V85-L88 WeakPolarHBondContact O-CB 3.2Å; V85-L88 PolarHBondContact O-N 3.18Å; A86-L88 PolarHBondContact O-N 3.15Å; L88-R93 WeakPolarHBondContact O-CB 3.36Å; L88-A97 HydrophobicContact CB-CB 4.44Å; L88-A97 HydrophobicContact CD2-CB 4.33Å; L88-R98 WeakPolarHBondContact O-CG 3.44Å; L88-V101 HydrophobicContact CB-CG2 3.65Å; L88-V101 HydrophobicContact CD1-CG2 4.21Å
89	L	95.5	Very high	96.8	Very high	11 Å²	11	51.9 Å²	51.9	6%	0.058	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-87.5	1.7	174.8	-74.1	-173.9	0	0	0	114.3	W82 A86 D87 R98 V101 L102 L105 V126 Y130	W82-L89 HydrophobicContact CH2-CD1 3.89Å; W82-L89 HydrophobicContact CZ3-CD1 3.93Å; A86-L89 PolarHBondContact O-N 2.81Å; D87-L89 VanDerWaalsContact C-N 3.31Å; L89-R98 HydrophobicContact CD2-CB 4.32Å; L89-R98 WeakPolarHBondContact CD2-O 3.32Å; L89-V101 HydrophobicContact CD1-CB 4.45Å; L89-V101 HydrophobicContact CD1-CG1 3.75Å; L89-V101 HydrophobicContact CD2-CB 3.62Å; L89-V101 HydrophobicContact CD2-CG1 3.88Å; L89-V101 HydrophobicContact CD2-CG2 4.46Å; L89-V101 HydrophobicContact CG-CB 3.83Å; L89-V101 HydrophobicContact CG-CG1 3.6Å; L89-V101 HydrophobicContact CG-CG2 4.46Å; L89-L102 HydrophobicContact CD2-CD2 4.34Å; L89-L102 HydrophobicContact CD2-CG 4.06Å; L89-L105 HydrophobicContact CD1-CD1 4.31Å; L89-V126 HydrophobicContact CD1-CG1 3.88Å; L89-Y130 HydrophobicContact CD1-CE2 4.38Å; L89-Y130 HydrophobicContact CD2-CE2 3.91Å; L89-Y130 HydrophobicContact CG-CE2 4.5Å
90	Q	94.1	Very high	96.8	Very high	100 Å²	100	49.8 Å²	49.8	47%	0.467	25%	0.252	S	S	.	.	S	Bend	trans	-66	144.1	177.7	-58	-59.3	-50	0	0	110.6	D87 E92 R93 R98	D87-Q90 WeakPolarHBondContact O-CG 3.46Å; Q90-E92 PolarHBondContact O-N 2.93Å; Q90-E92 VanDerWaalsContact O-N 3.11Å; Q90-R93 HydrophobicContact CB-CG 4.03Å; Q90-R93 VanDerWaalsContact O-CB 3.3Å; Q90-R93 WeakPolarHBondContact O-CB 3.26Å; Q90-R93 PolarHBondContact O-N 2.89Å; Q90-R98 WeakPolarHBondContact O-CD 3.29Å
91	P	92.3	Very high	96.9	Very high	55 Å²	55	48.2 Å²	48.2	36%	0.357	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-33.5	-179.2	-23.7	29.8	0	0	0	114.3	R93 R98 P131	P91-R93 PolarHBondContact O-N 3.28Å; P91-R98 PolarHBondContact O-NH1 3.41Å; P91-P131 HydrophobicContact CG-CB 3.89Å; P91-P131 HydrophobicContact CG-CG 3.53Å
92	E	93.8	Very high	96.9	Very high	157 Å²	157	48.3 Å²	48.3	73%	0.734	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-11.9	-176.7	-56.8	70.7	-151.5	0	0	112.4	Q90	Q90-E92 PolarHBondContact O-N 2.93Å; Q90-E92 VanDerWaalsContact O-N 3.11Å
93	R	95.9	Very high	96.9	Very high	93 Å²	93	48.7 Å²	48.7	35%	0.351	25%	0.252	S	S	.	.	S	Bend	trans	-75.3	146.2	177.7	-62.4	-66.4	-164.4	-166.2	7.8	110	D87 L88 Q90 P91 A97 R98	D87-R93 WeakPolarHBondContact O-CG 3.4Å; D87-R93 PolarHBondContact O-NE 3Å; D87-R93 IonicContact OD2-CZ 3.71Å; D87-R93 IonicContact OD2-NE 3.78Å; D87-R93 IonicContact OD2-NH2 3.95Å; D87-R93 PolarHBondContact OD2-NH2 2.9Å; L88-R93 WeakPolarHBondContact O-CB 3.36Å; Q90-R93 HydrophobicContact CB-CG 4.03Å; Q90-R93 VanDerWaalsContact O-CB 3.3Å; Q90-R93 WeakPolarHBondContact O-CB 3.26Å; Q90-R93 PolarHBondContact O-N 2.89Å; P91-R93 PolarHBondContact O-N 3.28Å; R93-A97 HydrophobicContact CB-CB 4.48Å; R93-R98 HydrophobicContact CB-CG 4.06Å; R93-R98 PolarHBondContact O-NH1 3.4Å
94	P	96.6	Very high	97	Very high	57 Å²	57	40.7 Å²	40.7	37%	0.37	22%	0.217	S	C	.	.			trans	-54.7	147.5	174.1	-26.5	36.3	0	0	0	112.1	L54 E96 A97 R98	L54-P94 HydrophobicContact CD2-CB 4.38Å; L54-P94 HydrophobicContact CD2-CG 3.72Å; P94-E96 WeakPolarHBondContact CB-OE2 3.49Å; P94-E96 PolarHBondContact O-N 2.97Å; P94-A97 WeakPolarHBondContact O-CB 3.42Å; P94-A97 PolarHBondContact O-N 3.32Å; P94-R98 PolarHBondContact O-N 2.91Å
95	L	96.1	Very high	97	Very high	59 Å²	59	39.9 Å²	39.9	31%	0.309	21%	0.21	S	C	.	.	H	α-helix	trans	-52.8	-42.4	-176.9	176.9	147.5	0	0	0	111.9	A97 R98 H99 E134	L95-A97 VanDerWaalsContact C-N 3.25Å; L95-A97 PolarHBondContact O-N 3.06Å; L95-R98 PolarHBondContact O-N 3.34Å; L95-H99 VanDerWaalsContact CD2-CE1 3.48Å; L95-H99 WeakPolarHBondContact CD2-CE1 3.25Å; L95-H99 WeakPolarHBondContact O-CB 3.42Å; L95-H99 PolarHBondContact O-CD2 3.15Å; L95-H99 PolarHBondContact O-N 3.42Å; L95-E134 HydrophobicContact CD1-CG 4.27Å
96	E	97.4	Very high	97	Very high	120 Å²	120	42.4 Å²	42.4	56%	0.561	22%	0.221	S	C	*	.	H	α-helix	trans	-62.3	-34.4	-178.8	-56	81.6	179.3	0	0	112.1	I58 P94 A100	I58-E96 HydrophobicContact CD1-CB 4.2Å; P94-E96 WeakPolarHBondContact CB-OE2 3.49Å; P94-E96 PolarHBondContact O-N 2.97Å; E96-A100 WeakPolarHBondContact O-CB 3.45Å; E96-A100 PolarHBondContact O-N 3.18Å
97	A	98	Very high	97	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-71.6	-44.6	177.8	0	0	0	0	0	111.5	L54 I58 L88 R93 P94 L95 A100 V101	L54-A97 HydrophobicContact CD1-CB 3.78Å; L54-A97 HydrophobicContact CD2-CB 4.38Å; L54-A97 HydrophobicContact CG-CB 4.42Å; I58-A97 HydrophobicContact CD1-CB 4.08Å; I58-A97 HydrophobicContact CG1-CB 4.38Å; L88-A97 HydrophobicContact CB-CB 4.44Å; L88-A97 HydrophobicContact CD2-CB 4.33Å; R93-A97 HydrophobicContact CB-CB 4.48Å; P94-A97 WeakPolarHBondContact O-CB 3.42Å; P94-A97 PolarHBondContact O-N 3.32Å; L95-A97 VanDerWaalsContact C-N 3.25Å; L95-A97 PolarHBondContact O-N 3.06Å; A97-A100 PolarHBondContact O-N 3.12Å; A97-V101 PolarHBondContact O-N 3.35Å
98	R	97.9	Very high	97.1	Very high	11 Å²	11	39.8 Å²	39.8	4%	0.042	20%	0.204	C	C	.	.	H	α-helix	trans	-62.5	-46.1	177.6	-58.4	-168	-48.7	-104.5	2.5	110.7	L88 L89 Q90 P91 R93 P94 L95 A100 V101 L102 E134 D135	L88-R98 WeakPolarHBondContact O-CG 3.44Å; L89-R98 HydrophobicContact CD2-CB 4.32Å; L89-R98 WeakPolarHBondContact CD2-O 3.32Å; Q90-R98 WeakPolarHBondContact O-CD 3.29Å; P91-R98 PolarHBondContact O-NH1 3.41Å; R93-R98 HydrophobicContact CB-CG 4.06Å; R93-R98 PolarHBondContact O-NH1 3.4Å; P94-R98 PolarHBondContact O-N 2.91Å; L95-R98 PolarHBondContact O-N 3.34Å; R98-A100 VanDerWaalsContact C-N 3.34Å; R98-A100 PolarHBondContact O-N 3.24Å; R98-V101 PolarHBondContact O-N 3.27Å; R98-L102 PolarHBondContact O-N 3.28Å; R98-E134 IonicContact CZ-OE2 3.72Å; R98-E134 IonicContact NH1-OE2 2.85Å; R98-E134 IonicContact NH2-OE2 2.96Å; R98-E134 PolarHBondContact NH2-OE2 3.49Å; R98-D135 IonicContact CZ-OD1 3.65Å; R98-D135 IonicContact CZ-OD2 3.49Å; R98-D135 IonicContact NE-OD1 3.7Å; R98-D135 IonicContact NE-OD2 2.78Å; R98-D135 PolarHBondContact NE-OD2 3.48Å; R98-D135 IonicContact NH2-OD1 3.44Å; R98-D135 PolarHBondContact NH2-OD1 3.46Å; R98-D135 IonicContact NH2-OD2 2.73Å; R98-D135 PolarHBondContact NH2-OD2 2.88Å
99	H	98.3	Very high	97.1	Very high	42 Å²	42	40 Å²	40	19%	0.194	21%	0.205	C	C	.	.	H	α-helix	trans	-63.1	-38.3	178.6	-75.1	-156.3	0	0	0	112.4	L95 V101 L102 A103 D135 E138	L95-H99 VanDerWaalsContact CD2-CE1 3.48Å; L95-H99 WeakPolarHBondContact CD2-CE1 3.25Å; L95-H99 WeakPolarHBondContact O-CB 3.42Å; L95-H99 PolarHBondContact O-CD2 3.15Å; L95-H99 PolarHBondContact O-N 3.42Å; H99-V101 VanDerWaalsContact C-N 3.32Å; H99-V101 PolarHBondContact O-N 3Å; H99-L102 PolarHBondContact O-N 3.42Å; H99-A103 WeakPolarHBondContact O-CB 3.49Å; H99-A103 PolarHBondContact O-N 3.35Å; H99-D135 IonicContact CD2-OD1 3.37Å; H99-D135 PolarHBondContact CD2-OD1 3.21Å; H99-D135 IonicContact NE2-OD1 2.87Å; H99-D135 PolarHBondContact NE2-OD1 3.38Å; H99-E138 IonicContact CE1-OE1 3.56Å; H99-E138 IonicContact CE1-OE2 3.56Å; H99-E138 IonicContact ND1-OE1 3.92Å; H99-E138 IonicContact NE2-OE2 3.55Å
100	A	98.6	Very high	97.1	Very high	14 Å²	14	45 Å²	45	12%	0.116	23%	0.228	C	C	.	.	H	α-helix	trans	-59.1	-43.7	174.7	0	0	0	0	0	111.7	I58 I61 E96 A97 R98 A103 L104	I58-A100 HydrophobicContact CG1-CB 4.35Å; I58-A100 HydrophobicContact CG2-CB 4.15Å; I61-A100 HydrophobicContact CB-CB 4.44Å; I61-A100 HydrophobicContact CD1-CB 4.27Å; I61-A100 HydrophobicContact CG2-CB 4Å; I61-A100 WeakPolarHBondContact CG2-O 3.32Å; E96-A100 WeakPolarHBondContact O-CB 3.45Å; E96-A100 PolarHBondContact O-N 3.18Å; A97-A100 PolarHBondContact O-N 3.12Å; R98-A100 VanDerWaalsContact C-N 3.34Å; R98-A100 PolarHBondContact O-N 3.24Å; A100-A103 PolarHBondContact O-N 2.88Å; A100-L104 PolarHBondContact O-N 3.38Å
101	V	98.4	Very high	97.2	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-70.2	-40.6	177.7	-178.5	0	0	0	0	111.9	I61 W82 V85 L88 L89 A97 R98 H99 A103 L104 L105	I61-V101 HydrophobicContact CD1-CG2 4.02Å; W82-V101 HydrophobicContact CZ3-CG1 4.21Å; V85-V101 HydrophobicContact CB-CG2 4.03Å; V85-V101 HydrophobicContact CG2-CG1 3.9Å; V85-V101 HydrophobicContact CG2-CG2 4.1Å; L88-V101 HydrophobicContact CB-CG2 3.65Å; L88-V101 HydrophobicContact CD1-CG2 4.21Å; L89-V101 HydrophobicContact CD1-CB 4.45Å; L89-V101 HydrophobicContact CD1-CG1 3.75Å; L89-V101 HydrophobicContact CD2-CB 3.62Å; L89-V101 HydrophobicContact CD2-CG1 3.88Å; L89-V101 HydrophobicContact CD2-CG2 4.46Å; L89-V101 HydrophobicContact CG-CB 3.83Å; L89-V101 HydrophobicContact CG-CG1 3.6Å; L89-V101 HydrophobicContact CG-CG2 4.46Å; A97-V101 PolarHBondContact O-N 3.35Å; R98-V101 PolarHBondContact O-N 3.27Å; H99-V101 VanDerWaalsContact C-N 3.32Å; H99-V101 PolarHBondContact O-N 3Å; V101-A103 VanDerWaalsContact C-N 3.28Å; V101-A103 PolarHBondContact O-N 3.29Å; V101-L104 WeakPolarHBondContact O-CB 3.37Å; V101-L104 PolarHBondContact O-N 3.36Å; V101-L104 VanDerWaalsContact O-N 3.1Å; V101-L105 HydrophobicContact CG1-CG 4.4Å; V101-L105 WeakPolarHBondContact O-CG 3.43Å; V101-L105 PolarHBondContact O-N 3.21Å
102	L	98.4	Very high	97.3	Very high	2 Å²	2	38.4 Å²	38.4	1%	0.01	20%	0.196	C	C	.	.	H	α-helix	trans	-59.5	-41	174.2	-69.9	173	0	0	0	111.3	L89 R98 H99 L104 L105 K106 I127 Y130 D135 E138 R139 V142	L89-L102 HydrophobicContact CD2-CD2 4.34Å; L89-L102 HydrophobicContact CD2-CG 4.06Å; R98-L102 PolarHBondContact O-N 3.28Å; H99-L102 PolarHBondContact O-N 3.42Å; L102-L104 VanDerWaalsContact C-N 3.33Å; L102-L104 PolarHBondContact O-N 3.35Å; L102-L105 PolarHBondContact O-N 3.49Å; L102-K106 PolarHBondContact O-N 2.85Å; L102-I127 HydrophobicContact CD2-CD1 3.61Å; L102-Y130 HydrophobicContact CD1-CE2 4.29Å; L102-Y130 HydrophobicContact CD2-CD2 4.43Å; L102-Y130 HydrophobicContact CD2-CE2 3.96Å; L102-Y130 HydrophobicContact CG-CE2 4.4Å; L102-D135 HydrophobicContact CD1-CB 3.9Å; L102-E138 HydrophobicContact CB-CB 4.21Å; L102-E138 HydrophobicContact CD1-CB 3.61Å; L102-R139 HydrophobicContact CD1-CG 4.31Å; L102-R139 HydrophobicContact CD2-CG 4.39Å; L102-V142 HydrophobicContact CB-CG2 4.24Å; L102-V142 HydrophobicContact CD2-CG2 4.24Å; L102-V142 WeakPolarHBondContact O-CG2 3.44Å
103	A	98.6	Very high	97.1	Very high	50 Å²	50	32.1 Å²	32.1	41%	0.413	17%	0.173	S	C	.	.	H	α-helix	trans	-62.2	-39.8	173.7	0	0	0	0	0	112.3	H99 A100 V101 K106 A107	H99-A103 WeakPolarHBondContact O-CB 3.49Å; H99-A103 PolarHBondContact O-N 3.35Å; A100-A103 PolarHBondContact O-N 2.88Å; V101-A103 VanDerWaalsContact C-N 3.28Å; V101-A103 PolarHBondContact O-N 3.29Å; A103-K106 PolarHBondContact O-N 3.25Å; A103-A107 WeakPolarHBondContact O-CB 3.37Å; A103-A107 PolarHBondContact O-N 2.91Å
104	L	98.8	Very high	96.8	Very high	3 Å²	3	36.3 Å²	36.3	2%	0.016	20%	0.197	C	C	.	.	H	α-helix	trans	-63.2	-46.5	174.5	-178.5	63.5	0	0	0	112.2	I61 I64 C65 V85 A100 V101 L102 K106 A107 I108	I61-L104 HydrophobicContact CG2-CB 3.83Å; I61-L104 HydrophobicContact CG2-CD2 4.28Å; I61-L104 HydrophobicContact CG2-CG 4.47Å; I64-L104 HydrophobicContact CB-CD1 4.19Å; I64-L104 HydrophobicContact CG2-CD1 3.69Å; C65-L104 WeakPolarHBondContact SG-CA 3.39Å; V85-L104 HydrophobicContact CG2-CD2 4Å; A100-L104 PolarHBondContact O-N 3.38Å; V101-L104 WeakPolarHBondContact O-CB 3.37Å; V101-L104 PolarHBondContact O-N 3.36Å; V101-L104 VanDerWaalsContact O-N 3.1Å; L102-L104 VanDerWaalsContact C-N 3.33Å; L102-L104 PolarHBondContact O-N 3.35Å; L104-K106 VanDerWaalsContact C-N 3.31Å; L104-K106 PolarHBondContact O-N 3.31Å; L104-A107 PolarHBondContact O-N 2.99Å; L104-I108 HydrophobicContact CD1-CD1 3.89Å; L104-I108 HydrophobicContact CD1-CG1 4.13Å; L104-I108 HydrophobicContact CD2-CD1 4.4Å; L104-I108 HydrophobicContact CG-CD1 3.78Å; L104-I108 HydrophobicContact CG-CG1 4.37Å; L104-I108 WeakPolarHBondContact O-CB 3.4Å; L104-I108 WeakPolarHBondContact O-CG1 3.41Å; L104-I108 PolarHBondContact O-N 3.13Å
105	L	98.4	Very high	96.5	Very high	2 Å²	2	38.8 Å²	38.8	1%	0.01	20%	0.199	C	C	.	.	H	α-helix	trans	-58.3	-45.8	176.6	-67.5	-177.2	0	0	0	110.7	W82 L89 V101 L102 A107 I108 V109 F123 V126 I127 V142	W82-L105 HydrophobicContact CE3-CD2 4.01Å; W82-L105 HydrophobicContact CZ3-CD1 4.31Å; W82-L105 HydrophobicContact CZ3-CD2 4.09Å; L89-L105 HydrophobicContact CD1-CD1 4.31Å; V101-L105 HydrophobicContact CG1-CG 4.4Å; V101-L105 WeakPolarHBondContact O-CG 3.43Å; V101-L105 PolarHBondContact O-N 3.21Å; L102-L105 PolarHBondContact O-N 3.49Å; L105-A107 PolarHBondContact O-N 2.64Å; L105-I108 PolarHBondContact O-N 2.94Å; L105-V109 WeakPolarHBondContact O-CB 3.3Å; L105-V109 WeakPolarHBondContact O-CG2 3.4Å; L105-V109 PolarHBondContact O-N 3Å; L105-F123 HydrophobicContact CD2-CD1 3.63Å; L105-F123 HydrophobicContact CD2-CD2 4.27Å; L105-F123 HydrophobicContact CD2-CE1 3.53Å; L105-F123 HydrophobicContact CD2-CE2 4.18Å; L105-F123 HydrophobicContact CD2-CG 4.01Å; L105-F123 HydrophobicContact CD2-CZ 3.81Å; L105-V126 HydrophobicContact CD1-CG1 4.26Å; L105-I127 HydrophobicContact CD1-CD1 4.34Å; L105-V142 HydrophobicContact CB-CG1 3.94Å; L105-V142 HydrophobicContact CB-CG2 4.35Å
106	K	98.4	Very high	96.3	Very high	55 Å²	55	36.2 Å²	36.2	24%	0.239	19%	0.185	C	C	.	.	H	α-helix	trans	-57.5	-49.7	174.6	-179.4	175.2	177.4	173.9	0	111.5	L102 A103 L104 I108 V109 Q110 E141 V142 A145	L102-K106 PolarHBondContact O-N 2.85Å; A103-K106 PolarHBondContact O-N 3.25Å; L104-K106 VanDerWaalsContact C-N 3.31Å; L104-K106 PolarHBondContact O-N 3.31Å; K106-I108 PolarHBondContact O-N 3.42Å; K106-V109 PolarHBondContact O-N 3.33Å; K106-Q110 WeakPolarHBondContact O-CB 3.17Å; K106-Q110 VanDerWaalsContact O-CG 3.31Å; K106-Q110 WeakPolarHBondContact O-CG 3.27Å; K106-Q110 PolarHBondContact O-N 3.25Å; K106-E141 HydrophobicContact CD-CB 4.09Å; K106-E141 IonicContact NZ-OE2 3.9Å; K106-E141 PolarHBondContact NZ-OE2 3.45Å; K106-V142 HydrophobicContact CB-CG2 4.1Å; K106-A145 HydrophobicContact CG-CB 4.42Å
107	A	98.4	Very high	96.1	Very high	2 Å²	2	33.4 Å²	33.4	2%	0.017	19%	0.189	C	C	.	.	H	α-helix	trans	-61.6	-42.7	-179	0	0	0	0	0	112.4	C65 A68 K69 A103 L104 L105 Q110 G111	C65-A107 HydrophobicContact CB-CB 4.08Å; A68-A107 HydrophobicContact CB-CB 4.19Å; K69-A107 HydrophobicContact CG-CB 4.2Å; A103-A107 WeakPolarHBondContact O-CB 3.37Å; A103-A107 PolarHBondContact O-N 2.91Å; L104-A107 PolarHBondContact O-N 2.99Å; L105-A107 PolarHBondContact O-N 2.64Å; A107-Q110 PolarHBondContact O-N 3.13Å; A107-G111 PolarHBondContact O-N 3.33Å
108	I	98	Very high	96	Very high	3 Å²	3	39.2 Å²	39.2	2%	0.015	22%	0.224	C	C	.	.	H	α-helix	trans	-63.8	-46.5	176.1	-72.2	173.8	0	0	0	110.7	A68 F73 V78 L81 L104 L105 K106 Q110 G111 Q112 L116 F123	A68-I108 HydrophobicContact CB-CG1 4.19Å; F73-I108 HydrophobicContact CE2-CG1 4.42Å; V78-I108 HydrophobicContact CG1-CD1 4.36Å; V78-I108 HydrophobicContact CG1-CG2 3.79Å; V78-I108 HydrophobicContact CG2-CG2 4.03Å; L81-I108 HydrophobicContact CD1-CD1 4.46Å; L104-I108 HydrophobicContact CD1-CD1 3.89Å; L104-I108 HydrophobicContact CD1-CG1 4.13Å; L104-I108 HydrophobicContact CD2-CD1 4.4Å; L104-I108 HydrophobicContact CG-CD1 3.78Å; L104-I108 HydrophobicContact CG-CG1 4.37Å; L104-I108 WeakPolarHBondContact O-CB 3.4Å; L104-I108 WeakPolarHBondContact O-CG1 3.41Å; L104-I108 PolarHBondContact O-N 3.13Å; L105-I108 PolarHBondContact O-N 2.94Å; K106-I108 PolarHBondContact O-N 3.42Å; I108-Q110 VanDerWaalsContact C-N 3.31Å; I108-Q110 PolarHBondContact O-N 2.98Å; I108-G111 PolarHBondContact O-N 3.11Å; I108-Q112 HydrophobicContact CG2-CB 4.3Å; I108-Q112 HydrophobicContact CG2-CG 4.26Å; I108-Q112 WeakPolarHBondContact O-CA 3.43Å; I108-Q112 WeakPolarHBondContact O-CB 3.38Å; I108-Q112 PolarHBondContact O-N 3.01Å; I108-L116 HydrophobicContact CG2-CD1 4.27Å; I108-L116 HydrophobicContact CG2-CD2 3.67Å; I108-F123 HydrophobicContact CG2-CE2 3.86Å
109	V	97.3	Very high	96	Very high	4 Å²	4	39.5 Å²	39.5	2%	0.024	23%	0.226	C	C	.	.	H	α-helix	trans	-61.6	-41.2	180	172.4	0	0	0	0	111.8	L105 K106 G113 L116 F123 A145 L146	L105-V109 WeakPolarHBondContact O-CB 3.3Å; L105-V109 WeakPolarHBondContact O-CG2 3.4Å; L105-V109 PolarHBondContact O-N 3Å; K106-V109 PolarHBondContact O-N 3.33Å; V109-G113 WeakPolarHBondContact O-CA 3.41Å; V109-G113 PolarHBondContact O-N 3.2Å; V109-L116 HydrophobicContact CB-CD1 4.43Å; V109-L116 HydrophobicContact CG2-CD1 4.04Å; V109-F123 HydrophobicContact CG2-CD2 3.97Å; V109-A145 HydrophobicContact CB-CB 4.25Å; V109-A145 HydrophobicContact CG1-CB 3.76Å; V109-A145 VanDerWaalsContact CG1-O 3.27Å; V109-A145 WeakPolarHBondContact CG1-O 3.37Å; V109-L146 HydrophobicContact CB-CD2 4.37Å; V109-L146 HydrophobicContact CG1-CD2 3.86Å; V109-L146 HydrophobicContact CG1-CG 4.1Å; V109-L146 HydrophobicContact CG2-CD2 3.49Å; V109-L146 VanDerWaalsContact CG2-CD2 3.49Å; V109-L146 HydrophobicContact CG2-CG 4Å
110	Q	95.9	Very high	95.9	Very high	115 Å²	115	41.3 Å²	41.3	54%	0.537	23%	0.232	S	C	.	.	H	α-helix	trans	-71.5	-45.3	179.2	-70.4	178.2	-34.3	0	0	112.5	K106 A107 I108 A145	K106-Q110 WeakPolarHBondContact O-CB 3.17Å; K106-Q110 VanDerWaalsContact O-CG 3.31Å; K106-Q110 WeakPolarHBondContact O-CG 3.27Å; K106-Q110 PolarHBondContact O-N 3.25Å; A107-Q110 PolarHBondContact O-N 3.13Å; I108-Q110 VanDerWaalsContact C-N 3.31Å; I108-Q110 PolarHBondContact O-N 2.98Å; Q110-A145 HydrophobicContact CG-CB 3.95Å
111	G	95.7	Very high	95.8	Very high	13 Å²	13	43.7 Å²	43.7	13%	0.134	25%	0.251	C	S	.	.	H	α-helix	trans	-89.5	-28.6	-173.1	0	0	0	0	0	115	A68 K72 A107 I108	A68-G111 WeakPolarHBondContact O-CA 3.34Å; K72-G111 PolarHBondContact NZ-O 2.94Å; A107-G111 PolarHBondContact O-N 3.33Å; I108-G111 PolarHBondContact O-N 3.11Å
112	Q	95.1	Very high	95.7	Very high	4 Å²	4	46.9 Å²	46.9	2%	0.019	27%	0.268	C	S	.	.	H	α-helix	trans	-107.9	2.8	-175.5	-47.4	-56	-55	0	0	113.4	A68 K71 F73 V78 I108 E114 R115 L116	A68-Q112 PolarHBondContact O-NE2 2.88Å; K71-Q112 PolarHBondContact O-NE2 2.92Å; F73-Q112 HydrophobicContact CD2-CG 4.27Å; V78-Q112 HydrophobicContact CG2-CG 4.47Å; I108-Q112 HydrophobicContact CG2-CB 4.3Å; I108-Q112 HydrophobicContact CG2-CG 4.26Å; I108-Q112 WeakPolarHBondContact O-CA 3.43Å; I108-Q112 WeakPolarHBondContact O-CB 3.38Å; I108-Q112 PolarHBondContact O-N 3.01Å; Q112-E114 VanDerWaalsContact C-N 3.32Å; Q112-E114 PolarHBondContact O-N 3.42Å; Q112-R115 PolarHBondContact O-N 3.46Å; Q112-L116 HydrophobicContact CB-CD2 4.05Å; Q112-L116 HydrophobicContact CB-CG 4.34Å; Q112-L116 PolarHBondContact O-N 2.94Å
113	G	90.1	Very high	95.7	Very high	25 Å²	25	46.8 Å²	46.8	26%	0.258	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-43.3	-45.9	-165.4	0	0	0	0	0	116.7	V109 R115 L116	V109-G113 WeakPolarHBondContact O-CA 3.41Å; V109-G113 PolarHBondContact O-N 3.2Å; G113-R115 PolarHBondContact O-N 2.99Å; G113-L116 PolarHBondContact O-N 2.98Å
114	E	87.9	Confident	95.6	Very high	182 Å²	182	48.6 Å²	48.6	85%	0.85	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-63.1	-25.9	179.9	-64.9	172.2	166.1	0	0	113.9	Q112	Q112-E114 VanDerWaalsContact C-N 3.32Å; Q112-E114 PolarHBondContact O-N 3.42Å
115	R	89.9	Confident	95.5	Very high	108 Å²	108	54.6 Å²	54.6	41%	0.408	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-100.9	-1.8	-176.5	-65.2	-177.1	66.1	171.2	7.2	113.9	E37 F73 Q112 G113	E37-R115 IonicContact OE1-CZ 3.15Å; E37-R115 IonicContact OE1-NH1 2.83Å; E37-R115 PolarHBondContact OE1-NH1 3.39Å; E37-R115 IonicContact OE1-NH2 3.13Å; E37-R115 PolarHBondContact OE1-NH2 3.49Å; F73-R115 PolarHBondContact O-NH1 3.1Å; F73-R115 PolarHBondContact O-NH2 3.48Å; Q112-R115 PolarHBondContact O-N 3.46Å; G113-R115 PolarHBondContact O-N 2.99Å
116	L	93.7	Very high	95.4	Very high	5 Å²	5	55.9 Å²	55.9	3%	0.026	30%	0.3	C	S	.	.			trans	-73.9	-28.4	-174.5	-69.5	-175.5	0	0	0	113.6	V78 I108 V109 Q112 G113 V118 L119 R120 F123	V78-L116 HydrophobicContact CB-CD2 4.44Å; V78-L116 HydrophobicContact CG1-CD2 3.93Å; V78-L116 HydrophobicContact CG2-CD2 4.1Å; I108-L116 HydrophobicContact CG2-CD1 4.27Å; I108-L116 HydrophobicContact CG2-CD2 3.67Å; V109-L116 HydrophobicContact CB-CD1 4.43Å; V109-L116 HydrophobicContact CG2-CD1 4.04Å; Q112-L116 HydrophobicContact CB-CD2 4.05Å; Q112-L116 HydrophobicContact CB-CG 4.34Å; Q112-L116 PolarHBondContact O-N 2.94Å; G113-L116 PolarHBondContact O-N 2.98Å; L116-V118 PolarHBondContact O-N 3.28Å; L116-V118 VanDerWaalsContact O-N 3.15Å; L116-L119 HydrophobicContact CB-CB 4.49Å; L116-L119 WeakPolarHBondContact O-CA 3.37Å; L116-L119 VanDerWaalsContact O-CB 3.23Å; L116-L119 WeakPolarHBondContact O-CB 3.31Å; L116-L119 PolarHBondContact O-N 3.41Å; L116-R120 HydrophobicContact CB-CB 4.17Å; L116-F123 HydrophobicContact CD1-CD2 4.48Å; L116-F123 HydrophobicContact CD1-CE2 4.43Å; L116-F123 HydrophobicContact CD2-CE2 4.38Å
117	G	93.4	Very high	95.4	Very high	62 Å²	62	53.6 Å²	53.6	64%	0.639	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.4	-123.2	-179.3	0	0	0	0	0	112.6	L119 R120	G117-L119 PolarHBondContact O-N 3.28Å; G117-R120 WeakPolarHBondContact O-CB 3.2Å; G117-R120 PolarHBondContact O-N 3.42Å
118	V	95.3	Very high	95.2	Very high	121 Å²	121	60.5 Å²	60.5	73%	0.733	32%	0.32	S	S	*	.	H	α-helix	trans	-62.9	-24.9	179.1	70.1	0	0	0	0	114	L116 R120 A121 L122	L116-V118 PolarHBondContact O-N 3.28Å; L116-V118 VanDerWaalsContact O-N 3.15Å; V118-R120 PolarHBondContact O-N 3.42Å; V118-A121 WeakPolarHBondContact O-CB 3.37Å; V118-A121 PolarHBondContact O-N 3.37Å; V118-A121 VanDerWaalsContact O-N 3.08Å; V118-L122 PolarHBondContact O-N 2.99Å; V118-L122 VanDerWaalsContact O-N 3.12Å
119	L	96.8	Very high	95.1	Very high	18 Å²	18	65 Å²	65	9%	0.094	34%	0.344	C	S	.	.	H	α-helix	trans	-65.8	-26.8	178	-59.3	172.8	0	0	0	112.4	V78 E79 L116 G117 A121 L122 F123	V78-L119 HydrophobicContact CB-CD1 3.86Å; V78-L119 HydrophobicContact CG1-CD1 3.64Å; E79-L119 VanDerWaalsContact CD-CD1 3.45Å; E79-L119 HydrophobicContact CG-CD1 3.67Å; E79-L119 HydrophobicContact CG-CD2 3.8Å; E79-L119 HydrophobicContact CG-CG 4.25Å; E79-L119 WeakPolarHBondContact OE2-CD1 3.43Å; L116-L119 HydrophobicContact CB-CB 4.49Å; L116-L119 WeakPolarHBondContact O-CA 3.37Å; L116-L119 VanDerWaalsContact O-CB 3.23Å; L116-L119 WeakPolarHBondContact O-CB 3.31Å; L116-L119 PolarHBondContact O-N 3.41Å; G117-L119 PolarHBondContact O-N 3.28Å; L119-A121 VanDerWaalsContact C-N 3.28Å; L119-A121 PolarHBondContact O-N 3.1Å; L119-L122 HydrophobicContact CD2-CD2 3.98Å; L119-L122 WeakPolarHBondContact O-CB 3.34Å; L119-L122 PolarHBondContact O-N 3.48Å; L119-F123 HydrophobicContact CB-CE2 4.48Å; L119-F123 WeakPolarHBondContact O-CD2 3.35Å; L119-F123 VanDerWaalsContact O-CG 3.3Å; L119-F123 WeakPolarHBondContact O-CG 3.21Å; L119-F123 PolarHBondContact O-N 3.46Å
120	R	96.5	Very high	94.9	Very high	80 Å²	80	65.5 Å²	65.5	30%	0.302	35%	0.345	S	S	.	.	H	α-helix	trans	-61	-41.4	172.8	-165.3	-177.3	-175.4	88.1	-6.8	111	L116 G117 V118 F123 F124 A145 L146	L116-R120 HydrophobicContact CB-CB 4.17Å; G117-R120 WeakPolarHBondContact O-CB 3.2Å; G117-R120 PolarHBondContact O-N 3.42Å; V118-R120 PolarHBondContact O-N 3.42Å; R120-F123 PolarHBondContact O-N 2.9Å; R120-F124 WeakPolarHBondContact O-CB 3.47Å; R120-F124 PolarHBondContact O-N 3.33Å; R120-A145 PolarHBondContact NH2-O 2.93Å; R120-A145 VanDerWaalsContact NH2-O 3.13Å; R120-L146 HydrophobicContact CG-CD2 3.67Å; R120-L146 PolarHBondContact NE-O 3.22Å; R120-L146 VanDerWaalsContact NE-O 3.13Å; R120-L146 PolarHBondContact NH2-O 2.78Å
121	A	96.3	Very high	94.3	Very high	64 Å²	64	64.2 Å²	64.2	53%	0.529	35%	0.347	S	S	.	.	H	α-helix	trans	-69.7	-37.5	176.3	0	0	0	0	0	112	V118 L119 F124 K125	V118-A121 WeakPolarHBondContact O-CB 3.37Å; V118-A121 PolarHBondContact O-N 3.37Å; V118-A121 VanDerWaalsContact O-N 3.08Å; L119-A121 VanDerWaalsContact C-N 3.28Å; L119-A121 PolarHBondContact O-N 3.1Å; A121-F124 PolarHBondContact O-N 3.25Å; A121-K125 PolarHBondContact O-N 3.05Å
122	L	97.2	Very high	93.7	Very high	66 Å²	66	64.8 Å²	64.8	35%	0.346	35%	0.349	S	S	.	.	H	α-helix	trans	-58.5	-51.4	172.2	176.7	63.5	0	0	0	111.1	V118 L119 F124 K125 V126	V118-L122 PolarHBondContact O-N 2.99Å; V118-L122 VanDerWaalsContact O-N 3.12Å; L119-L122 HydrophobicContact CD2-CD2 3.98Å; L119-L122 WeakPolarHBondContact O-CB 3.34Å; L119-L122 PolarHBondContact O-N 3.48Å; L122-F124 VanDerWaalsContact C-N 3.31Å; L122-F124 PolarHBondContact O-N 3.18Å; L122-K125 WeakPolarHBondContact O-CB 3.4Å; L122-K125 PolarHBondContact O-N 2.77Å; L122-K125 VanDerWaalsContact O-N 3.13Å; L122-V126 WeakPolarHBondContact O-CG2 3.46Å; L122-V126 PolarHBondContact O-N 3.36Å
123	F	97.8	Very high	93.4	Very high	1 Å²	1	71 Å²	71	0%	0.004	38%	0.382	C	S	.	.	H	α-helix	trans	-63.4	-37.7	178.6	-63.1	-22.1	0	0	0	112.1	V78 W82 L105 I108 V109 L116 L119 R120 K125 V126 I127 L146	V78-F123 HydrophobicContact CG1-CE2 4.03Å; V78-F123 HydrophobicContact CG1-CZ 3.69Å; W82-F123 HydrophobicContact CB-CE1 4.34Å; W82-F123 HydrophobicContact CD2-CE1 4.06Å; W82-F123 HydrophobicContact CE3-CE1 4.19Å; W82-F123 HydrophobicContact CG-CE1 4.12Å; L105-F123 HydrophobicContact CD2-CD1 3.63Å; L105-F123 HydrophobicContact CD2-CD2 4.27Å; L105-F123 HydrophobicContact CD2-CE1 3.53Å; L105-F123 HydrophobicContact CD2-CE2 4.18Å; L105-F123 HydrophobicContact CD2-CG 4.01Å; L105-F123 HydrophobicContact CD2-CZ 3.81Å; I108-F123 HydrophobicContact CG2-CE2 3.86Å; V109-F123 HydrophobicContact CG2-CD2 3.97Å; L116-F123 HydrophobicContact CD1-CD2 4.48Å; L116-F123 HydrophobicContact CD1-CE2 4.43Å; L116-F123 HydrophobicContact CD2-CE2 4.38Å; L119-F123 HydrophobicContact CB-CE2 4.48Å; L119-F123 WeakPolarHBondContact O-CD2 3.35Å; L119-F123 VanDerWaalsContact O-CG 3.3Å; L119-F123 WeakPolarHBondContact O-CG 3.21Å; L119-F123 PolarHBondContact O-N 3.46Å; R120-F123 PolarHBondContact O-N 2.9Å; F123-K125 VanDerWaalsContact C-N 3.33Å; F123-K125 PolarHBondContact O-N 3.46Å; F123-V126 PolarHBondContact O-N 2.99Å; F123-I127 WeakPolarHBondContact O-CG1 3.43Å; F123-I127 PolarHBondContact O-N 3.36Å; F123-L146 HydrophobicContact CB-CD1 4.27Å; F123-L146 HydrophobicContact CB-CD2 4.14Å
124	F	97.1	Very high	93.5	Very high	88 Å²	88	75.8 Å²	75.8	39%	0.386	40%	0.398	S	S	.	.	H	α-helix	trans	-58.2	-46.3	171.9	-172.3	-87.1	0	0	0	112	R120 A121 L122 V126 I127 K128 F143 L146	R120-F124 WeakPolarHBondContact O-CB 3.47Å; R120-F124 PolarHBondContact O-N 3.33Å; A121-F124 PolarHBondContact O-N 3.25Å; L122-F124 VanDerWaalsContact C-N 3.31Å; L122-F124 PolarHBondContact O-N 3.18Å; F124-V126 PolarHBondContact O-N 3.3Å; F124-I127 PolarHBondContact O-N 3.26Å; F124-K128 HydrophobicContact CE1-CD 4.38Å; F124-K128 VanDerWaalsContact O-CB 3.32Å; F124-K128 WeakPolarHBondContact O-CB 3.42Å; F124-K128 PolarHBondContact O-N 3.36Å; F124-F143 HydrophobicContact CD2-CE2 4.3Å; F124-F143 HydrophobicContact CE2-CD2 4.04Å; F124-F143 AromaticContact CE2-CE2 3.42Å; F124-F143 HydrophobicContact CE2-CE2 3.42Å; F124-F143 VanDerWaalsContact CE2-CE2 3.42Å; F124-F143 HydrophobicContact CE2-CZ 4.32Å; F124-F143 AromaticContact CZ-CE2 3.91Å; F124-F143 HydrophobicContact CZ-CE2 3.91Å; F124-L146 HydrophobicContact CB-CD1 4.4Å
125	K	97.2	Very high	93.9	Very high	129 Å²	129	67.1 Å²	67.1	56%	0.561	36%	0.357	S	S	*	.	H	α-helix	trans	-60.8	-44.4	175.7	-174.1	178.6	178.5	-178.3	0	111.6	A121 L122 F123 I127 K128 D129	A121-K125 PolarHBondContact O-N 3.05Å; L122-K125 WeakPolarHBondContact O-CB 3.4Å; L122-K125 PolarHBondContact O-N 2.77Å; L122-K125 VanDerWaalsContact O-N 3.13Å; F123-K125 VanDerWaalsContact C-N 3.33Å; F123-K125 PolarHBondContact O-N 3.46Å; K125-I127 VanDerWaalsContact C-N 3.32Å; K125-I127 PolarHBondContact O-N 3Å; K125-K128 PolarHBondContact O-N 3.35Å; K125-D129 WeakPolarHBondContact CE-OD2 3.4Å; K125-D129 WeakPolarHBondContact CG-OD2 3.43Å; K125-D129 WeakPolarHBondContact O-CB 3.43Å; K125-D129 PolarHBondContact O-N 3.23Å
126	V	96.6	Very high	94.1	Very high	29 Å²	29	66 Å²	66	18%	0.176	36%	0.359	C	S	.	.	H	α-helix	trans	-56.6	-44.9	176.7	168.6	0	0	0	0	111.6	W82 L89 L105 L122 F123 F124 Y130	W82-V126 HydrophobicContact CH2-CB 4.46Å; W82-V126 HydrophobicContact CH2-CG1 3.87Å; W82-V126 HydrophobicContact CH2-CG2 3.77Å; W82-V126 HydrophobicContact CZ2-CG2 3.6Å; L89-V126 HydrophobicContact CD1-CG1 3.88Å; L105-V126 HydrophobicContact CD1-CG1 4.26Å; L122-V126 WeakPolarHBondContact O-CG2 3.46Å; L122-V126 PolarHBondContact O-N 3.36Å; F123-V126 PolarHBondContact O-N 2.99Å; F124-V126 PolarHBondContact O-N 3.3Å; V126-Y130 WeakPolarHBondContact O-CB 3.24Å; V126-Y130 PolarHBondContact O-N 2.95Å
127	I	96.6	Very high	94.2	Very high	6 Å²	6	71.7 Å²	71.7	3%	0.031	39%	0.385	C	S	.	.	H	α-helix	trans	-72.3	-36.6	179.8	-62.8	-56.8	0	0	0	112.1	L102 L105 F123 F124 K125 Y130 R139 V142 F143 L146	L102-I127 HydrophobicContact CD2-CD1 3.61Å; L105-I127 HydrophobicContact CD1-CD1 4.34Å; F123-I127 WeakPolarHBondContact O-CG1 3.43Å; F123-I127 PolarHBondContact O-N 3.36Å; F124-I127 PolarHBondContact O-N 3.26Å; K125-I127 VanDerWaalsContact C-N 3.32Å; K125-I127 PolarHBondContact O-N 3Å; I127-Y130 WeakPolarHBondContact O-CB 3.44Å; I127-R139 HydrophobicContact CG2-CB 4.3Å; I127-R139 PolarHBondContact O-NE 3.25Å; I127-R139 PolarHBondContact O-NH2 3.2Å; I127-V142 HydrophobicContact CD1-CB 3.81Å; I127-V142 HydrophobicContact CD1-CG1 3.79Å; I127-V142 HydrophobicContact CD1-CG2 4.14Å; I127-V142 HydrophobicContact CG1-CB 4.05Å; I127-V142 HydrophobicContact CG1-CG1 3.71Å; I127-F143 HydrophobicContact CG2-CB 4.19Å; I127-L146 HydrophobicContact CG1-CD1 4.16Å
128	K	94.9	Very high	94.4	Very high	148 Å²	148	71.1 Å²	71.1	64%	0.643	37%	0.366	S	S	*	.	H	α-helix	trans	-65.4	-49.4	177.2	-177	-173.7	175	-176.8	0	111.6	F124 K125 Y130	F124-K128 HydrophobicContact CE1-CD 4.38Å; F124-K128 VanDerWaalsContact O-CB 3.32Å; F124-K128 WeakPolarHBondContact O-CB 3.42Å; F124-K128 PolarHBondContact O-N 3.36Å; K125-K128 PolarHBondContact O-N 3.35Å; K128-Y130 PolarHBondContact O-N 3.49Å
129	D	95.1	Very high	94.4	Very high	96 Å²	96	66.9 Å²	66.9	51%	0.513	34%	0.337	S	S	.	.	S	Bend	trans	-87.1	8.7	-174.3	-59.3	-12.4	0	0	0	112.1	K125	K125-D129 WeakPolarHBondContact CE-OD2 3.4Å; K125-D129 WeakPolarHBondContact CG-OD2 3.43Å; K125-D129 WeakPolarHBondContact O-CB 3.43Å; K125-D129 PolarHBondContact O-N 3.23Å
130	Y	93.4	Very high	94.4	Very high	16 Å²	16	69.9 Å²	69.9	6%	0.063	35%	0.352	C	S	.	.			trans	-62.4	130.7	-175.5	-165.3	-82.9	0	0	0	111.5	L89 L102 V126 I127 K128 S132 D135 R139	L89-Y130 HydrophobicContact CD1-CE2 4.38Å; L89-Y130 HydrophobicContact CD2-CE2 3.91Å; L89-Y130 HydrophobicContact CG-CE2 4.5Å; L102-Y130 HydrophobicContact CD1-CE2 4.29Å; L102-Y130 HydrophobicContact CD2-CD2 4.43Å; L102-Y130 HydrophobicContact CD2-CE2 3.96Å; L102-Y130 HydrophobicContact CG-CE2 4.4Å; V126-Y130 WeakPolarHBondContact O-CB 3.24Å; V126-Y130 PolarHBondContact O-N 2.95Å; I127-Y130 WeakPolarHBondContact O-CB 3.44Å; K128-Y130 PolarHBondContact O-N 3.49Å; Y130-S132 WeakPolarHBondContact CD1-O 3.47Å; Y130-S132 PolarHBondContact O-N 3.26Å; Y130-D135 HydrophobicContact CE1-CB 3.94Å; Y130-D135 VanDerWaalsContact CE1-OD2 3.29Å; Y130-D135 WeakPolarHBondContact CE1-OD2 3.16Å; Y130-D135 PolarHBondContact OH-OD2 3.3Å; Y130-R139 VanDerWaalsContact CD1-CD 3.43Å; Y130-R139 HydrophobicContact CD1-CG 4.15Å; Y130-R139 HydrophobicContact CD2-CG 4.38Å; Y130-R139 HydrophobicContact CE1-CG 4.43Å; Y130-R139 HydrophobicContact CG-CG 4.11Å; Y130-R139 PolarHBondContact O-NH1 3.4Å
131	P	83.5	Confident	94.5	Very high	87 Å²	87	68.3 Å²	68.3	57%	0.565	35%	0.348	S	S	*	.			trans	-81.3	-10.1	-161.9	30.6	-37.9	0	0	0	115.6	P91	P91-P131 HydrophobicContact CG-CB 3.89Å; P91-P131 HydrophobicContact CG-CG 3.53Å
132	S	84.1	Confident	94.5	Very high	26 Å²	26	65.3 Å²	65.3	18%	0.182	32%	0.323	C	S	.	.			trans	-125.8	142.1	-173.5	-178.5	0	0	0	0	113.5	Y130 E134 R139	Y130-S132 WeakPolarHBondContact CD1-O 3.47Å; Y130-S132 PolarHBondContact O-N 3.26Å; S132-E134 WeakPolarHBondContact OG-CB 3.29Å; S132-E134 PolarHBondContact OG-N 3.22Å; S132-E134 VanDerWaalsContact OG-N 3.1Å; S132-R139 PolarHBondContact O-NH1 3.43Å
133	N	87.7	Confident	94.5	Very high	135 Å²	135	66 Å²	66	72%	0.722	32%	0.324	S	S	*	.	S	Bend	trans	-87.5	-12	170.9	-72.3	-26.7	0	0	0	113	D135 L136	N133-D135 PolarHBondContact O-N 2.86Å; N133-L136 VanDerWaalsContact O-CB 3.28Å; N133-L136 WeakPolarHBondContact O-CB 3.44Å; N133-L136 PolarHBondContact O-N 3.14Å
134	E	92.6	Very high	94.5	Very high	124 Å²	124	70.5 Å²	70.5	58%	0.579	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-34.5	178.1	-171.2	178.5	-159.9	0	0	111.5	L95 R98 S132 L136	L95-E134 HydrophobicContact CD1-CG 4.27Å; R98-E134 IonicContact CZ-OE2 3.72Å; R98-E134 IonicContact NH1-OE2 2.85Å; R98-E134 IonicContact NH2-OE2 2.96Å; R98-E134 PolarHBondContact NH2-OE2 3.49Å; S132-E134 WeakPolarHBondContact OG-CB 3.29Å; S132-E134 PolarHBondContact OG-N 3.22Å; S132-E134 VanDerWaalsContact OG-N 3.1Å; E134-L136 VanDerWaalsContact C-N 3.35Å
135	D	95.4	Very high	94.4	Very high	0 Å²	0	67.2 Å²	67.2	0%	0	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	23.4	-177.4	-47.9	-40.2	0	0	0	112	R98 H99 L102 Y130 N133 H137 E138 R139	R98-D135 IonicContact CZ-OD1 3.65Å; R98-D135 IonicContact CZ-OD2 3.49Å; R98-D135 IonicContact NE-OD1 3.7Å; R98-D135 IonicContact NE-OD2 2.78Å; R98-D135 PolarHBondContact NE-OD2 3.48Å; R98-D135 IonicContact NH2-OD1 3.44Å; R98-D135 PolarHBondContact NH2-OD1 3.46Å; R98-D135 IonicContact NH2-OD2 2.73Å; R98-D135 PolarHBondContact NH2-OD2 2.88Å; H99-D135 IonicContact CD2-OD1 3.37Å; H99-D135 PolarHBondContact CD2-OD1 3.21Å; H99-D135 IonicContact NE2-OD1 2.87Å; H99-D135 PolarHBondContact NE2-OD1 3.38Å; L102-D135 HydrophobicContact CD1-CB 3.9Å; Y130-D135 HydrophobicContact CE1-CB 3.94Å; Y130-D135 VanDerWaalsContact CE1-OD2 3.29Å; Y130-D135 WeakPolarHBondContact CE1-OD2 3.16Å; Y130-D135 PolarHBondContact OH-OD2 3.3Å; N133-D135 PolarHBondContact O-N 2.86Å; D135-H137 VanDerWaalsContact C-N 3.28Å; D135-H137 PolarHBondContact O-N 3.42Å; D135-E138 PolarHBondContact O-N 2.92Å; D135-R139 WeakPolarHBondContact O-CB 3.5Å; D135-R139 WeakPolarHBondContact O-CD 3.37Å; D135-R139 WeakPolarHBondContact O-CG 3.44Å; D135-R139 PolarHBondContact O-N 3.36Å
136	L	95.4	Very high	94.3	Very high	84 Å²	84	61.6 Å²	61.6	44%	0.44	31%	0.308	S	S	.	.	H	α-helix	trans	-57.6	-40.8	-174.8	177.3	63.1	0	0	0	112.1	N133 E134 R139 L140	N133-L136 VanDerWaalsContact O-CB 3.28Å; N133-L136 WeakPolarHBondContact O-CB 3.44Å; N133-L136 PolarHBondContact O-N 3.14Å; E134-L136 VanDerWaalsContact C-N 3.35Å; L136-R139 PolarHBondContact O-N 3.38Å; L136-L140 HydrophobicContact CD1-CD1 4.07Å; L136-L140 HydrophobicContact CD1-CG 4.06Å; L136-L140 HydrophobicContact CG-CD1 4.03Å; L136-L140 HydrophobicContact CG-CG 4.42Å; L136-L140 WeakPolarHBondContact O-CB 3.42Å; L136-L140 VanDerWaalsContact O-CG 3.25Å; L136-L140 WeakPolarHBondContact O-CG 3.37Å; L136-L140 PolarHBondContact O-N 2.71Å
137	H	95.9	Very high	94.1	Very high	125 Å²	125	63.4 Å²	63.4	58%	0.579	32%	0.32	S	S	*	.	H	α-helix	trans	-62.3	-51.8	-179.6	-178.8	69.2	0	0	0	111	D135 R139 L140 E141	D135-H137 VanDerWaalsContact C-N 3.28Å; D135-H137 PolarHBondContact O-N 3.42Å; H137-R139 VanDerWaalsContact C-N 3.33Å; H137-R139 PolarHBondContact O-N 2.83Å; H137-L140 PolarHBondContact O-N 3.21Å; H137-E141 WeakPolarHBondContact O-CG 3.37Å; H137-E141 PolarHBondContact O-N 3.23Å; H137-E141 VanDerWaalsContact O-N 3.1Å
138	E	96.8	Very high	93.4	Very high	50 Å²	50	65.9 Å²	65.9	23%	0.234	35%	0.347	C	S	.	.	H	α-helix	trans	-63.1	-40.8	-179.7	-66.7	67	-143.6	0	0	111.1	H99 L102 D135 E141 V142	H99-E138 IonicContact CE1-OE1 3.56Å; H99-E138 IonicContact CE1-OE2 3.56Å; H99-E138 IonicContact ND1-OE1 3.92Å; H99-E138 IonicContact NE2-OE2 3.55Å; L102-E138 HydrophobicContact CB-CB 4.21Å; L102-E138 HydrophobicContact CD1-CB 3.61Å; D135-E138 PolarHBondContact O-N 2.92Å; E138-E141 WeakPolarHBondContact O-CB 3.44Å; E138-E141 PolarHBondContact O-N 3.27Å; E138-V142 WeakPolarHBondContact O-CG2 3.34Å; E138-V142 PolarHBondContact O-N 3Å; E138-V142 VanDerWaalsContact O-N 3.14Å
139	R	96.4	Very high	91.8	Very high	33 Å²	33	61.6 Å²	61.6	13%	0.125	34%	0.339	C	S	.	.	H	α-helix	trans	-60.5	-44.9	174.9	-74	168.7	65.2	178.6	1.2	112.4	L102 I127 Y130 S132 D135 L136 H137 E141 V142 F143	L102-R139 HydrophobicContact CD1-CG 4.31Å; L102-R139 HydrophobicContact CD2-CG 4.39Å; I127-R139 HydrophobicContact CG2-CB 4.3Å; I127-R139 PolarHBondContact O-NE 3.25Å; I127-R139 PolarHBondContact O-NH2 3.2Å; Y130-R139 VanDerWaalsContact CD1-CD 3.43Å; Y130-R139 HydrophobicContact CD1-CG 4.15Å; Y130-R139 HydrophobicContact CD2-CG 4.38Å; Y130-R139 HydrophobicContact CE1-CG 4.43Å; Y130-R139 HydrophobicContact CG-CG 4.11Å; Y130-R139 PolarHBondContact O-NH1 3.4Å; S132-R139 PolarHBondContact O-NH1 3.43Å; D135-R139 WeakPolarHBondContact O-CB 3.5Å; D135-R139 WeakPolarHBondContact O-CD 3.37Å; D135-R139 WeakPolarHBondContact O-CG 3.44Å; D135-R139 PolarHBondContact O-N 3.36Å; L136-R139 PolarHBondContact O-N 3.38Å; H137-R139 VanDerWaalsContact C-N 3.33Å; H137-R139 PolarHBondContact O-N 2.83Å; R139-E141 PolarHBondContact O-N 3.36Å; R139-V142 PolarHBondContact O-N 2.57Å; R139-F143 WeakPolarHBondContact O-CB 3.28Å; R139-F143 PolarHBondContact O-N 2.77Å
140	L	96.8	Very high	89.8	Confident	80 Å²	80	66 Å²	66	42%	0.419	38%	0.377	S	S	.	.	H	α-helix	trans	-63.5	-34.6	178.5	-74.1	173.8	0	0	0	111.2	L136 H137 F143 K144	L136-L140 HydrophobicContact CD1-CD1 4.07Å; L136-L140 HydrophobicContact CD1-CG 4.06Å; L136-L140 HydrophobicContact CG-CD1 4.03Å; L136-L140 HydrophobicContact CG-CG 4.42Å; L136-L140 WeakPolarHBondContact O-CB 3.42Å; L136-L140 VanDerWaalsContact O-CG 3.25Å; L136-L140 WeakPolarHBondContact O-CG 3.37Å; L136-L140 PolarHBondContact O-N 2.71Å; H137-L140 PolarHBondContact O-N 3.21Å; L140-F143 PolarHBondContact O-N 3.21Å; L140-K144 VanDerWaalsContact O-CG 3.28Å; L140-K144 WeakPolarHBondContact O-CG 3.45Å; L140-K144 PolarHBondContact O-N 3.49Å
141	E	97.6	Very high	89.6	Confident	47 Å²	47	68.5 Å²	68.5	22%	0.22	39%	0.393	C	S	.	.	H	α-helix	trans	-65.9	-38	174.8	-70.8	-61.2	119.9	0	0	112.8	K106 H137 E138 R139 K144 A145	K106-E141 HydrophobicContact CD-CB 4.09Å; K106-E141 IonicContact NZ-OE2 3.9Å; K106-E141 PolarHBondContact NZ-OE2 3.45Å; H137-E141 WeakPolarHBondContact O-CG 3.37Å; H137-E141 PolarHBondContact O-N 3.23Å; H137-E141 VanDerWaalsContact O-N 3.1Å; E138-E141 WeakPolarHBondContact O-CB 3.44Å; E138-E141 PolarHBondContact O-N 3.27Å; R139-E141 PolarHBondContact O-N 3.36Å; E141-K144 IonicContact OE1-NZ 2.7Å; E141-K144 PolarHBondContact OE1-NZ 3.1Å; E141-A145 PolarHBondContact O-N 3.21Å
142	V	97.3	Very high	89.9	Confident	1 Å²	1	67.5 Å²	67.5	1%	0.006	38%	0.384	C	S	.	.	H	α-helix	trans	-68.2	-43.1	171.1	-174.2	0	0	0	0	110.7	L102 L105 K106 I127 E138 R139 K144 A145 L146	L102-V142 HydrophobicContact CB-CG2 4.24Å; L102-V142 HydrophobicContact CD2-CG2 4.24Å; L102-V142 WeakPolarHBondContact O-CG2 3.44Å; L105-V142 HydrophobicContact CB-CG1 3.94Å; L105-V142 HydrophobicContact CB-CG2 4.35Å; K106-V142 HydrophobicContact CB-CG2 4.1Å; I127-V142 HydrophobicContact CD1-CB 3.81Å; I127-V142 HydrophobicContact CD1-CG1 3.79Å; I127-V142 HydrophobicContact CD1-CG2 4.14Å; I127-V142 HydrophobicContact CG1-CB 4.05Å; I127-V142 HydrophobicContact CG1-CG1 3.71Å; E138-V142 WeakPolarHBondContact O-CG2 3.34Å; E138-V142 PolarHBondContact O-N 3Å; E138-V142 VanDerWaalsContact O-N 3.14Å; R139-V142 PolarHBondContact O-N 2.57Å; V142-K144 PolarHBondContact O-N 2.85Å; V142-A145 WeakPolarHBondContact O-CB 3.28Å; V142-A145 PolarHBondContact O-N 3.34Å; V142-L146 HydrophobicContact CG1-CD1 3.97Å; V142-L146 HydrophobicContact CG1-CG 4.38Å; V142-L146 WeakPolarHBondContact O-CG 3.48Å; V142-L146 PolarHBondContact O-N 3.3Å
143	F	96.8	Very high	90.2	Very high	80 Å²	80	69.8 Å²	69.8	35%	0.351	40%	0.395	S	S	.	.	H	α-helix	trans	-59.5	-47.3	-180	-178.5	-97	0	0	0	112.1	F124 I127 R139 L140 A145 L146 T147	F124-F143 HydrophobicContact CD2-CE2 4.3Å; F124-F143 HydrophobicContact CE2-CD2 4.04Å; F124-F143 AromaticContact CE2-CE2 3.42Å; F124-F143 HydrophobicContact CE2-CE2 3.42Å; F124-F143 VanDerWaalsContact CE2-CE2 3.42Å; F124-F143 HydrophobicContact CE2-CZ 4.32Å; F124-F143 AromaticContact CZ-CE2 3.91Å; F124-F143 HydrophobicContact CZ-CE2 3.91Å; I127-F143 HydrophobicContact CG2-CB 4.19Å; R139-F143 WeakPolarHBondContact O-CB 3.28Å; R139-F143 PolarHBondContact O-N 2.77Å; L140-F143 PolarHBondContact O-N 3.21Å; F143-A145 VanDerWaalsContact C-N 3.29Å; F143-A145 PolarHBondContact O-N 3.32Å; F143-L146 CarbonylContact O-C 3.5Å; F143-L146 WeakPolarHBondContact O-CA 3.25Å; F143-L146 WeakPolarHBondContact O-CB 3.46Å; F143-L146 PolarHBondContact O-N 2.89Å; F143-T147 HydrophobicContact CD1-CG2 4.24Å; F143-T147 HydrophobicContact CE1-CG2 3.78Å; F143-T147 HydrophobicContact CE2-CG2 4.11Å; F143-T147 HydrophobicContact CZ-CG2 3.71Å; F143-T147 PolarHBondContact O-N 3.02Å; F143-T147 PolarHBondContact O-OG1 2.87Å
144	K	96.4	Very high	90.4	Very high	97 Å²	97	65.9 Å²	65.9	42%	0.422	38%	0.376	S	S	.	.	H	α-helix	trans	-56.1	-43.9	175.3	-72.9	171.2	-171.3	171.5	0	111.8	L140 E141 V142 L146 T147 G148 A149	L140-K144 VanDerWaalsContact O-CG 3.28Å; L140-K144 WeakPolarHBondContact O-CG 3.45Å; L140-K144 PolarHBondContact O-N 3.49Å; E141-K144 IonicContact OE1-NZ 2.7Å; E141-K144 PolarHBondContact OE1-NZ 3.1Å; V142-K144 PolarHBondContact O-N 2.85Å; K144-L146 VanDerWaalsContact C-N 3.3Å; K144-L146 PolarHBondContact O-N 2.97Å; K144-T147 PolarHBondContact O-N 3.1Å; K144-T147 PolarHBondContact O-OG1 2.73Å; K144-G148 PolarHBondContact O-N 2.96Å; K144-A149 PolarHBondContact O-N 3.37Å
145	A	95.7	Very high	90.2	Very high	19 Å²	19	62.3 Å²	62.3	16%	0.157	36%	0.363	C	S	.	.	H	α-helix	trans	-62.3	-38.1	175.3	0	0	0	0	0	112	K106 V109 Q110 R120 E141 V142 F143 T147	K106-A145 HydrophobicContact CG-CB 4.42Å; V109-A145 HydrophobicContact CB-CB 4.25Å; V109-A145 HydrophobicContact CG1-CB 3.76Å; V109-A145 VanDerWaalsContact CG1-O 3.27Å; V109-A145 WeakPolarHBondContact CG1-O 3.37Å; Q110-A145 HydrophobicContact CG-CB 3.95Å; R120-A145 PolarHBondContact NH2-O 2.93Å; R120-A145 VanDerWaalsContact NH2-O 3.13Å; E141-A145 PolarHBondContact O-N 3.21Å; V142-A145 WeakPolarHBondContact O-CB 3.28Å; V142-A145 PolarHBondContact O-N 3.34Å; F143-A145 VanDerWaalsContact C-N 3.29Å; F143-A145 PolarHBondContact O-N 3.32Å; A145-T147 VanDerWaalsContact C-N 3.33Å; A145-T147 PolarHBondContact O-N 3.24Å
146	L	95.4	Very high	89.9	Confident	10 Å²	10	66.5 Å²	66.5	5%	0.052	39%	0.387	C	S	.	.	H	α-helix	trans	-72.5	-20	177.1	-74.7	168.9	0	0	0	114.1	V109 R120 F123 F124 I127 V142 F143 K144	V109-L146 HydrophobicContact CB-CD2 4.37Å; V109-L146 HydrophobicContact CG1-CD2 3.86Å; V109-L146 HydrophobicContact CG1-CG 4.1Å; V109-L146 HydrophobicContact CG2-CD2 3.49Å; V109-L146 VanDerWaalsContact CG2-CD2 3.49Å; V109-L146 HydrophobicContact CG2-CG 4Å; R120-L146 HydrophobicContact CG-CD2 3.67Å; R120-L146 PolarHBondContact NE-O 3.22Å; R120-L146 VanDerWaalsContact NE-O 3.13Å; R120-L146 PolarHBondContact NH2-O 2.78Å; F123-L146 HydrophobicContact CB-CD1 4.27Å; F123-L146 HydrophobicContact CB-CD2 4.14Å; F124-L146 HydrophobicContact CB-CD1 4.4Å; I127-L146 HydrophobicContact CG1-CD1 4.16Å; V142-L146 HydrophobicContact CG1-CD1 3.97Å; V142-L146 HydrophobicContact CG1-CG 4.38Å; V142-L146 WeakPolarHBondContact O-CG 3.48Å; V142-L146 PolarHBondContact O-N 3.3Å; F143-L146 CarbonylContact O-C 3.5Å; F143-L146 WeakPolarHBondContact O-CA 3.25Å; F143-L146 WeakPolarHBondContact O-CB 3.46Å; F143-L146 PolarHBondContact O-N 2.89Å; K144-L146 VanDerWaalsContact C-N 3.3Å; K144-L146 PolarHBondContact O-N 2.97Å
147	T	92.1	Very high	89.5	Confident	67 Å²	67	65.2 Å²	65.2	41%	0.411	38%	0.383	S	S	.	.	H	α-helix	trans	-103	-8.8	177.1	59.4	0	0	0	0	113.5	F143 K144 A145 A149	F143-T147 HydrophobicContact CD1-CG2 4.24Å; F143-T147 HydrophobicContact CE1-CG2 3.78Å; F143-T147 HydrophobicContact CE2-CG2 4.11Å; F143-T147 HydrophobicContact CZ-CG2 3.71Å; F143-T147 PolarHBondContact O-N 3.02Å; F143-T147 PolarHBondContact O-OG1 2.87Å; K144-T147 PolarHBondContact O-N 3.1Å; K144-T147 PolarHBondContact O-OG1 2.73Å; A145-T147 VanDerWaalsContact C-N 3.33Å; A145-T147 PolarHBondContact O-N 3.24Å; T147-A149 PolarHBondContact O-N 3.31Å
148	G	81.8	Confident	89	Confident	58 Å²	58	60.6 Å²	60.6	60%	0.598	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.7	19.4	-174.5	0	0	0	0	0	112.8	K144 S150	K144-G148 PolarHBondContact O-N 2.96Å; G148-S150 PolarHBondContact O-N 2.87Å
149	A	62.2	Low	88.3	Confident	58 Å²	58	61.5 Å²	61.5	48%	0.479	38%	0.38	S	S	.	.			trans	-81.5	100	174.7	0	0	0	0	0	108.4	K144 T147	K144-A149 PolarHBondContact O-N 3.37Å; T147-A149 PolarHBondContact O-N 3.31Å
150	S	51.4	Low	87.6	Confident	188 Å²	188	64.1 Å²	64.1	100%	1.315	40%	0.403	S	S	*	.			trans	-96	0	170.1	53.5	0	0	0	0	111	G148	G148-S150 PolarHBondContact O-N 2.87Å

Retrieved 150 of 150 residues in 272.5 ms (Link to these results)

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