A0A087Y6J9_POEFO Loading...

Troponin T type 3a (skeletal, fast)

Troponin T is the tropomyosin-binding subunit of troponin, the thin filament regulatory complex which confers calcium-sensitivity to striated muscle actomyosin ATPase activity.

AlphaFold DB , UniProt , Accession A0A087Y6J9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 229 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	43.2	Very low	39	Very low	228 Å²	228	158.2 Å²	158.2	100%	1.123	84%	0.838	S	S	*	*				0	84.4	0	-56.6	-65.3	-174.2	0	0	105.4
2	S	40.2	Very low	38.8	Very low	105 Å²	105	159.9 Å²	159.9	73%	0.734	84%	0.838	S	S	*	*				50.1	124.3	81.3	64.6	0	0	0	0	110.4
3	D	37.3	Very low	39	Very low	144 Å²	144	161.5 Å²	161.5	77%	0.77	84%	0.838	S	S	*	*			cis	-162.9	146.5	16.6	-150.9	-23.5	0	0	0	106.9
4	A	43	Very low	39.3	Very low	97 Å²	97	161.6 Å²	161.6	80%	0.802	83%	0.829	S	S	*	*			trans	-115.1	112.4	172.8	0	0	0	0	0	106.2
5	E	43	Very low	39.6	Very low	176 Å²	176	159.5 Å²	159.5	82%	0.822	83%	0.83	S	S	*	*			trans	-133.8	103.2	174.6	-143.7	173.1	-169.7	0	0	109.3	V7	E5-V7 HydrophobicContact CG-CG2 4.48Å
6	E	42.5	Very low	40.5	Very low	193 Å²	193	160.6 Å²	160.6	90%	0.902	83%	0.826	S	S	*	*			trans	-101.1	110.9	171.7	171.7	-173.5	-159.9	0	0	106.3
7	V	34.4	Very low	40.9	Very low	106 Å²	106	162.1 Å²	162.1	64%	0.642	83%	0.825	S	S	*	*			trans	-150.2	128.6	165.8	-164.3	0	0	0	0	113	E5	E5-V7 HydrophobicContact CG-CG2 4.48Å
8	E	36.1	Very low	41.9	Very low	170 Å²	170	163.6 Å²	163.6	79%	0.794	83%	0.825	S	S	*	*			trans	67.5	103.3	150.7	-78.2	171.6	150.6	0	0	122.1
9	Q	32.8	Very low	42.2	Very low	197 Å²	197	160.7 Å²	160.7	92%	0.921	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-79.7	123.9	146.1	-69.5	174.3	2.3	0	0	109.3
10	V	37.7	Very low	42.5	Very low	137 Å²	137	158.3 Å²	158.3	83%	0.83	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-87.3	127.1	170.5	176.3	0	0	0	0	109.2
11	E	39.4	Very low	42.9	Very low	187 Å²	187	154.8 Å²	154.8	87%	0.874	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-94.9	129.6	172.6	-169.7	-174.7	-153.6	0	0	109.3
12	E	36.4	Very low	43.4	Very low	179 Å²	179	149.6 Å²	149.6	84%	0.836	80%	0.795	S	S	*	*			trans	-160.2	122.5	148.2	-133.3	-179.4	-178.5	0	0	114.6
13	E	41.8	Very low	43.7	Very low	181 Å²	181	154.2 Å²	154.2	85%	0.846	80%	0.802	S	S	*	*			trans	45.9	144.5	151.2	-74.7	-153.4	126.7	0	0	127.9
14	K	41.9	Very low	44.4	Very low	163 Å²	163	154.6 Å²	154.6	71%	0.709	80%	0.802	S	S	*	*			trans	-74.2	166.6	-170.7	-72.5	168.7	170.3	128	0	115.1	K16	K14-K16 HydrophobicContact CD-CG 4.24Å
15	P	44.8	Very low	45.2	Very low	129 Å²	129	155.5 Å²	155.5	84%	0.838	80%	0.8	S	S	*	*				-132.9	136.3	105.8	24.1	-7.4	0	0	0	113.8	F17	P15-F17 PolarHBondContact O-N 3.14Å
16	K	53	Low	45.4	Very low	178 Å²	178	155 Å²	155	77%	0.774	80%	0.803	S	S	*	*			trans	-71	105.6	173.4	-70.4	175.2	178.3	175.1	0	110	K14	K14-K16 HydrophobicContact CD-CG 4.24Å
17	F	48.6	Very low	46	Very low	186 Å²	186	149.3 Å²	149.3	82%	0.816	80%	0.796	S	S	*	*			trans	-89.5	115.2	167.7	-169.9	-101.9	0	0	0	110	P15 P19	P15-F17 PolarHBondContact O-N 3.14Å; F17-P19 WeakPolarHBondContact O-CD 3.45Å
18	K	57.6	Low	47	Very low	188 Å²	188	153 Å²	153	82%	0.817	81%	0.807	S	S	*	*			trans	-83.4	117.8	169.8	-62.1	-178.5	-178.5	-178.4	0	107.8	S20	K18-S20 PolarHBondContact O-N 3.23Å; K18-S20 VanDerWaalsContact O-N 3.14Å
19	P	48.3	Very low	48.2	Very low	110 Å²	110	154.2 Å²	154.2	71%	0.714	81%	0.809	S	S	*	*			trans	-72.7	111.4	168.2	28.5	-28.9	0	0	0	107.9	F17 A21	F17-P19 WeakPolarHBondContact O-CD 3.45Å; P19-A21 PolarHBondContact O-N 3.39Å
20	S	47.8	Very low	49.5	Very low	112 Å²	112	149.2 Å²	149.2	78%	0.783	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-60	124.6	166.7	-170.9	0	0	0	0	108	K18 P22	K18-S20 PolarHBondContact O-N 3.23Å; K18-S20 VanDerWaalsContact O-N 3.14Å; S20-P22 WeakPolarHBondContact O-CD 3.49Å
21	A	51.7	Low	51.1	Low	85 Å²	85	147.6 Å²	147.6	70%	0.702	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-53.9	123.7	178.7	0	0	0	0	0	110.2	P19 K23	P19-A21 PolarHBondContact O-N 3.39Å; A21-K23 PolarHBondContact O-N 3.02Å; A21-K23 VanDerWaalsContact O-N 3.14Å
22	P	53.9	Low	52.6	Low	118 Å²	118	146.6 Å²	146.6	77%	0.766	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-59.2	121.1	172.9	-21.3	32.5	0	0	0	109.1	S20 I24	S20-P22 WeakPolarHBondContact O-CD 3.49Å; P22-I24 PolarHBondContact O-N 3.14Å
23	K	46	Very low	54.8	Low	203 Å²	203	142.9 Å²	142.9	88%	0.883	76%	0.757	S	S	*	*			trans	-61.3	104.9	171.6	-138.6	155.4	-175.5	168.9	0	106.8	A21 P25	A21-K23 PolarHBondContact O-N 3.02Å; A21-K23 VanDerWaalsContact O-N 3.14Å; K23-P25 WeakPolarHBondContact O-CD 3.22Å
24	I	52.3	Low	56.9	Low	152 Å²	152	137.5 Å²	137.5	78%	0.779	73%	0.734	S	S	*	*			trans	-62.8	115	173.1	-59.9	171.7	0	0	0	106.1	P22	P22-I24 PolarHBondContact O-N 3.14Å
25	P	58.7	Low	58.9	Low	116 Å²	116	133.9 Å²	133.9	75%	0.753	72%	0.722	S	S	*	*			trans	-68.7	134.9	168.4	-7.3	24.9	0	0	0	107.8	K23 G27	K23-P25 WeakPolarHBondContact O-CD 3.22Å; P25-G27 PolarHBondContact O-N 3.2Å
26	D	46.9	Very low	61	Low	165 Å²	165	133.2 Å²	133.2	88%	0.882	71%	0.708	S	S	*	*	S	Bend	trans	-48.3	127.8	179.9	-76	-56.8	0	0	0	113.5	E28	D26-E28 PolarHBondContact O-N 3.36Å
27	G	55.1	Low	62.7	Low	74 Å²	74	130.6 Å²	130.6	76%	0.763	70%	0.697	S	S	*	*			trans	59.7	53.6	133.1	0	0	0	0	0	118.1	P25 K29	P25-G27 PolarHBondContact O-N 3.2Å; G27-K29 PolarHBondContact O-N 3.42Å
28	E	56.5	Low	64.8	Low	183 Å²	183	127.7 Å²	127.7	86%	0.855	68%	0.684	S	S	*	*			trans	-74.3	102.1	149.2	-164.8	169.6	-164.6	0	0	106.5	D26 V30	D26-E28 PolarHBondContact O-N 3.36Å; E28-V30 PolarHBondContact O-N 2.84Å
29	K	60.4	Low	66.3	Low	195 Å²	195	127.1 Å²	127.1	85%	0.848	68%	0.676	S	S	*	*			trans	-51.4	108	169.7	-88.6	178.9	177.9	176.3	0	106.8	G27 D31	G27-K29 PolarHBondContact O-N 3.42Å; K29-D31 VanDerWaalsContact C-N 3.34Å; K29-D31 PolarHBondContact O-N 2.85Å
30	V	60.5	Low	68.3	Low	92 Å²	92	127 Å²	127	56%	0.558	67%	0.666	S	S	*	*			trans	-58.8	102.1	173.7	-162.9	0	0	0	0	106.2	E28 F32 I35	E28-V30 PolarHBondContact O-N 2.84Å; V30-F32 WeakPolarHBondContact O-CD2 3.19Å; V30-F32 PolarHBondContact O-N 2.65Å; V30-I35 HydrophobicContact CG1-CD1 3.36Å; V30-I35 HydrophobicContact CG1-CG1 4.28Å
31	D	71.8	Confident	70.5	Confident	104 Å²	104	126.4 Å²	126.4	56%	0.556	65%	0.654	S	S	*	*			trans	-74.6	101.5	-176.4	-163.3	-6.8	0	0	0	107.4	K29 D33 D34 I35	K29-D31 VanDerWaalsContact C-N 3.34Å; K29-D31 PolarHBondContact O-N 2.85Å; D31-D33 PolarHBondContact O-N 3.05Å; D31-D33 VanDerWaalsContact O-N 3.16Å; D31-D34 HydrophobicContact CB-CB 3.93Å; D31-D34 WeakPolarHBondContact O-CA 3.24Å; D31-D34 WeakPolarHBondContact O-CB 3.42Å; D31-D34 PolarHBondContact O-N 3.17Å; D31-I35 PolarHBondContact O-N 2.96Å; D31-I35 VanDerWaalsContact O-N 3.08Å
32	F	71.3	Confident	72.5	Confident	165 Å²	165	128.2 Å²	128.2	72%	0.724	65%	0.646	S	S	*	*	H	α-helix	trans	-59	-27.9	-176.3	-73.5	-83.8	0	0	0	111.8	V30 Q36	V30-F32 WeakPolarHBondContact O-CD2 3.19Å; V30-F32 PolarHBondContact O-N 2.65Å; F32-Q36 WeakPolarHBondContact O-CB 3.46Å; F32-Q36 PolarHBondContact O-N 3.47Å
33	D	81.4	Confident	74.4	Confident	101 Å²	101	126.5 Å²	126.5	54%	0.54	63%	0.63	S	S	.	*	H	α-helix	trans	-68.3	-36.8	172.9	-103.4	9.1	0	0	0	112.3	D31 Q36 K37	D31-D33 PolarHBondContact O-N 3.05Å; D31-D33 VanDerWaalsContact O-N 3.16Å; D33-Q36 PolarHBondContact O-N 2.93Å; D33-K37 WeakPolarHBondContact O-CB 3.44Å; D33-K37 WeakPolarHBondContact O-CG 3.39Å; D33-K37 PolarHBondContact O-N 3.42Å
34	D	86.6	Confident	76.8	Confident	68 Å²	68	122 Å²	122	36%	0.364	62%	0.616	S	S	.	*	H	α-helix	trans	-71.1	-37.7	176.5	-172.1	39.2	0	0	0	111.3	D31 K37 K38	D31-D34 HydrophobicContact CB-CB 3.93Å; D31-D34 WeakPolarHBondContact O-CA 3.24Å; D31-D34 WeakPolarHBondContact O-CB 3.42Å; D31-D34 PolarHBondContact O-N 3.17Å; D34-K37 PolarHBondContact O-N 2.95Å; D34-K38 VanDerWaalsContact O-CB 3.28Å; D34-K38 WeakPolarHBondContact O-CB 3.3Å; D34-K38 VanDerWaalsContact O-CG 3.24Å; D34-K38 WeakPolarHBondContact O-CG 3.4Å; D34-K38 PolarHBondContact O-N 2.87Å; D34-K38 WeakPolarHBondContact OD1-CE 3.32Å; D34-K38 IonicContact OD1-NZ 3.83Å; D34-K38 WeakPolarHBondContact OD2-CE 3.28Å; D34-K38 IonicContact OD2-NZ 2.65Å; D34-K38 PolarHBondContact OD2-NZ 3.36Å
35	I	84.1	Confident	78.8	Confident	87 Å²	87	121.6 Å²	121.6	45%	0.446	61%	0.612	S	S	.	*	H	α-helix	trans	-61.3	-45.5	171.5	-68.2	-178.7	0	0	0	110.8	V30 D31 K38 R39	V30-I35 HydrophobicContact CG1-CD1 3.36Å; V30-I35 HydrophobicContact CG1-CG1 4.28Å; D31-I35 PolarHBondContact O-N 2.96Å; D31-I35 VanDerWaalsContact O-N 3.08Å; I35-K38 PolarHBondContact O-N 3.43Å; I35-R39 WeakPolarHBondContact O-CB 3.41Å; I35-R39 PolarHBondContact O-N 2.91Å
36	Q	87.5	Confident	80.5	Confident	115 Å²	115	120.7 Å²	120.7	54%	0.537	60%	0.598	S	S	.	*	H	α-helix	trans	-67.1	-40.8	-178.7	-169.4	166.9	-17.5	0	0	111.8	F32 D33 R39 Q40	F32-Q36 WeakPolarHBondContact O-CB 3.46Å; F32-Q36 PolarHBondContact O-N 3.47Å; D33-Q36 PolarHBondContact O-N 2.93Å; Q36-R39 PolarHBondContact O-N 3.41Å; Q36-Q40 WeakPolarHBondContact O-CG 3.49Å; Q36-Q40 PolarHBondContact O-N 3.33Å
37	K	90.4	Very high	82.8	Confident	124 Å²	124	117.5 Å²	117.5	54%	0.539	58%	0.58	S	S	.	*	H	α-helix	trans	-64.2	-43.6	173	-78	174.9	-177.2	167.4	0	112.7	D33 D34 R39 Q40 N41	D33-K37 WeakPolarHBondContact O-CB 3.44Å; D33-K37 WeakPolarHBondContact O-CG 3.39Å; D33-K37 PolarHBondContact O-N 3.42Å; D34-K37 PolarHBondContact O-N 2.95Å; K37-R39 VanDerWaalsContact C-N 3.29Å; K37-R39 PolarHBondContact O-N 2.87Å; K37-Q40 PolarHBondContact O-N 3.39Å; K37-N41 WeakPolarHBondContact O-CB 3.45Å; K37-N41 PolarHBondContact O-N 3.48Å
38	K	91	Very high	84.7	Confident	125 Å²	125	118.8 Å²	118.8	54%	0.543	57%	0.566	S	S	.	*	H	α-helix	trans	-61.8	-38.4	175.6	-77.5	170	176.3	165.4	0	111.7	D34 I35 K42	D34-K38 VanDerWaalsContact O-CB 3.28Å; D34-K38 WeakPolarHBondContact O-CB 3.3Å; D34-K38 VanDerWaalsContact O-CG 3.24Å; D34-K38 WeakPolarHBondContact O-CG 3.4Å; D34-K38 PolarHBondContact O-N 2.87Å; D34-K38 WeakPolarHBondContact OD1-CE 3.32Å; D34-K38 IonicContact OD1-NZ 3.83Å; D34-K38 WeakPolarHBondContact OD2-CE 3.28Å; D34-K38 IonicContact OD2-NZ 2.65Å; D34-K38 PolarHBondContact OD2-NZ 3.36Å; I35-K38 PolarHBondContact O-N 3.43Å; K38-K42 VanDerWaalsContact O-CB 3.32Å; K38-K42 WeakPolarHBondContact O-CB 3.46Å; K38-K42 PolarHBondContact O-N 3.16Å
39	R	90.6	Very high	86.5	Confident	175 Å²	175	112.8 Å²	112.8	66%	0.66	55%	0.548	S	S	*	.	H	α-helix	trans	-64.2	-50.9	174.1	-167.1	-178.5	-153.4	172.4	8.1	111.7	I35 Q36 K37 N41 K42 D43	I35-R39 WeakPolarHBondContact O-CB 3.41Å; I35-R39 PolarHBondContact O-N 2.91Å; Q36-R39 PolarHBondContact O-N 3.41Å; K37-R39 VanDerWaalsContact C-N 3.29Å; K37-R39 PolarHBondContact O-N 2.87Å; R39-N41 VanDerWaalsContact C-N 3.33Å; R39-N41 PolarHBondContact O-N 3.02Å; R39-K42 WeakPolarHBondContact O-CB 3.39Å; R39-K42 PolarHBondContact O-N 3.19Å; R39-K42 VanDerWaalsContact O-N 3.17Å; R39-D43 PolarHBondContact O-N 2.98Å
40	Q	90.1	Very high	88.3	Confident	109 Å²	109	109.3 Å²	109.3	51%	0.509	54%	0.538	S	S	.	.	H	α-helix	trans	-59.3	-42.9	177.5	-73.8	177.4	-23.3	0	0	112.2	Q36 K37 D43 L44	Q36-Q40 WeakPolarHBondContact O-CG 3.49Å; Q36-Q40 PolarHBondContact O-N 3.33Å; K37-Q40 PolarHBondContact O-N 3.39Å; Q40-D43 PolarHBondContact O-N 2.92Å; Q40-L44 WeakPolarHBondContact O-CB 3.22Å; Q40-L44 VanDerWaalsContact O-CG 3.25Å; Q40-L44 WeakPolarHBondContact O-CG 3.45Å; Q40-L44 PolarHBondContact O-N 3.32Å
41	N	93.3	Very high	89.9	Confident	99 Å²	99	108.1 Å²	108.1	53%	0.529	53%	0.528	S	S	.	.	H	α-helix	trans	-64.3	-40.6	176.2	-77.3	-15	0	0	0	112.1	K37 R39 L44 M45	K37-N41 WeakPolarHBondContact O-CB 3.45Å; K37-N41 PolarHBondContact O-N 3.48Å; R39-N41 VanDerWaalsContact C-N 3.33Å; R39-N41 PolarHBondContact O-N 3.02Å; N41-L44 PolarHBondContact O-N 3.08Å; N41-M45 WeakPolarHBondContact O-CB 3.24Å; N41-M45 VanDerWaalsContact O-CG 3.3Å; N41-M45 WeakPolarHBondContact O-CG 3.21Å; N41-M45 PolarHBondContact O-N 2.92Å
42	K	94.9	Very high	91.1	Very high	122 Å²	122	107 Å²	107	53%	0.53	52%	0.522	S	S	.	.	H	α-helix	trans	-62.1	-48.8	174.4	179.9	-179.2	170.6	-179.5	0	111.2	K38 R39 L44 M45 E46	K38-K42 VanDerWaalsContact O-CB 3.32Å; K38-K42 WeakPolarHBondContact O-CB 3.46Å; K38-K42 PolarHBondContact O-N 3.16Å; R39-K42 WeakPolarHBondContact O-CB 3.39Å; R39-K42 PolarHBondContact O-N 3.19Å; R39-K42 VanDerWaalsContact O-N 3.17Å; K42-L44 VanDerWaalsContact C-N 3.3Å; K42-L44 PolarHBondContact O-N 2.93Å; K42-M45 PolarHBondContact O-N 3.44Å; K42-E46 WeakPolarHBondContact CE-OE1 2.77Å; K42-E46 HydrophobicContact CG-CG 4.41Å; K42-E46 IonicContact NZ-OE1 3.64Å; K42-E46 WeakPolarHBondContact O-CB 3.37Å; K42-E46 WeakPolarHBondContact O-CG 3.32Å; K42-E46 PolarHBondContact O-N 3.39Å
43	D	93.9	Very high	92.3	Very high	82 Å²	82	102 Å²	102	44%	0.439	51%	0.511	S	S	.	.	H	α-helix	trans	-62.5	-38.3	-179.9	-63.6	-15	0	0	0	111.1	R39 Q40 L47	R39-D43 PolarHBondContact O-N 2.98Å; Q40-D43 PolarHBondContact O-N 2.92Å; D43-L47 WeakPolarHBondContact O-CB 3.25Å; D43-L47 PolarHBondContact O-N 3.5Å
44	L	95	Very high	93.1	Very high	110 Å²	110	102.6 Å²	102.6	58%	0.576	51%	0.51	S	S	*	.	H	α-helix	trans	-66	-41.9	174.1	-75.4	171.7	0	0	0	112.4	Q40 N41 K42 L47 Q48	Q40-L44 WeakPolarHBondContact O-CB 3.22Å; Q40-L44 VanDerWaalsContact O-CG 3.25Å; Q40-L44 WeakPolarHBondContact O-CG 3.45Å; Q40-L44 PolarHBondContact O-N 3.32Å; N41-L44 PolarHBondContact O-N 3.08Å; K42-L44 VanDerWaalsContact C-N 3.3Å; K42-L44 PolarHBondContact O-N 2.93Å; L44-L47 PolarHBondContact O-N 3.25Å; L44-Q48 WeakPolarHBondContact O-CB 3.43Å; L44-Q48 PolarHBondContact O-N 3.32Å
45	M	94.6	Very high	93.6	Very high	143 Å²	143	105.6 Å²	105.6	70%	0.704	52%	0.52	S	S	*	.	H	α-helix	trans	-67.1	-42.3	176.3	-74.7	-176	70.4	0	0	112	N41 K42 Q48 A49	N41-M45 WeakPolarHBondContact O-CB 3.24Å; N41-M45 VanDerWaalsContact O-CG 3.3Å; N41-M45 WeakPolarHBondContact O-CG 3.21Å; N41-M45 PolarHBondContact O-N 2.92Å; K42-M45 PolarHBondContact O-N 3.44Å; M45-Q48 PolarHBondContact O-N 3.18Å; M45-A49 WeakPolarHBondContact O-CB 3.41Å; M45-A49 PolarHBondContact O-N 2.9Å
46	E	93.9	Very high	94.2	Very high	97 Å²	97	105.9 Å²	105.9	45%	0.453	52%	0.52	S	S	.	.	H	α-helix	trans	-64.7	-41	175.8	-75.1	-178.1	178.8	0	0	111.3	K42 A49 L50	K42-E46 WeakPolarHBondContact CE-OE1 2.77Å; K42-E46 HydrophobicContact CG-CG 4.41Å; K42-E46 IonicContact NZ-OE1 3.64Å; K42-E46 WeakPolarHBondContact O-CB 3.37Å; K42-E46 WeakPolarHBondContact O-CG 3.32Å; K42-E46 PolarHBondContact O-N 3.39Å; E46-A49 PolarHBondContact O-N 3.4Å; E46-L50 WeakPolarHBondContact O-CB 3.39Å; E46-L50 WeakPolarHBondContact O-CG 3.47Å; E46-L50 PolarHBondContact O-N 2.85Å
47	L	95.6	Very high	94.6	Very high	98 Å²	98	103.6 Å²	103.6	51%	0.513	52%	0.516	S	S	.	.	H	α-helix	trans	-62.2	-44.9	175.1	-177.2	62.8	0	0	0	111.5	D43 L44 A49 L50 I51	D43-L47 WeakPolarHBondContact O-CB 3.25Å; D43-L47 PolarHBondContact O-N 3.5Å; L44-L47 PolarHBondContact O-N 3.25Å; L47-A49 PolarHBondContact O-N 3.39Å; L47-L50 PolarHBondContact O-N 2.96Å; L47-I51 HydrophobicContact CD1-CD1 4.36Å; L47-I51 HydrophobicContact CG-CD1 4.03Å; L47-I51 VanDerWaalsContact O-CG1 3.24Å; L47-I51 WeakPolarHBondContact O-CG1 3.29Å; L47-I51 PolarHBondContact O-N 2.95Å
48	Q	94.6	Very high	94.9	Very high	100 Å²	100	104 Å²	104	47%	0.467	51%	0.514	S	S	.	.	H	α-helix	trans	-61.7	-43.9	176	-174.3	60.8	51.4	0	0	111.3	L44 M45 L50 I51 D52	L44-Q48 WeakPolarHBondContact O-CB 3.43Å; L44-Q48 PolarHBondContact O-N 3.32Å; M45-Q48 PolarHBondContact O-N 3.18Å; Q48-L50 VanDerWaalsContact C-N 3.35Å; Q48-L50 PolarHBondContact O-N 3.49Å; Q48-I51 PolarHBondContact O-N 2.88Å; Q48-D52 PolarHBondContact NE2-OD1 3.36Å; Q48-D52 PolarHBondContact NE2-OD2 3.44Å; Q48-D52 VanDerWaalsContact O-CG 3.29Å; Q48-D52 PolarHBondContact O-N 3.05Å
49	A	95.5	Very high	95.2	Very high	58 Å²	58	103 Å²	103	48%	0.479	51%	0.51	S	S	.	.	H	α-helix	trans	-62.9	-39	177.1	0	0	0	0	0	112.6	M45 E46 L47 A53	M45-A49 WeakPolarHBondContact O-CB 3.41Å; M45-A49 PolarHBondContact O-N 2.9Å; E46-A49 PolarHBondContact O-N 3.4Å; L47-A49 PolarHBondContact O-N 3.39Å; A49-A53 WeakPolarHBondContact O-CB 3.5Å; A49-A53 PolarHBondContact O-N 2.89Å
50	L	96.7	Very high	95.5	Very high	121 Å²	121	100.2 Å²	100.2	63%	0.634	50%	0.502	S	S	*	.	H	α-helix	trans	-64.6	-42.4	174.4	-85.6	156.3	0	0	0	112	E46 L47 Q48 H54	E46-L50 WeakPolarHBondContact O-CB 3.39Å; E46-L50 WeakPolarHBondContact O-CG 3.47Å; E46-L50 PolarHBondContact O-N 2.85Å; L47-L50 PolarHBondContact O-N 2.96Å; Q48-L50 VanDerWaalsContact C-N 3.35Å; Q48-L50 PolarHBondContact O-N 3.49Å; L50-H54 WeakPolarHBondContact O-CB 3.15Å; L50-H54 PolarHBondContact O-N 2.83Å
51	I	95.8	Very high	95.8	Very high	68 Å²	68	100.8 Å²	100.8	35%	0.349	51%	0.505	S	S	.	.	H	α-helix	trans	-61	-51.6	176.4	-71.7	167.1	0	0	0	109.9	L47 Q48 A53 H54 F55	L47-I51 HydrophobicContact CD1-CD1 4.36Å; L47-I51 HydrophobicContact CG-CD1 4.03Å; L47-I51 VanDerWaalsContact O-CG1 3.24Å; L47-I51 WeakPolarHBondContact O-CG1 3.29Å; L47-I51 PolarHBondContact O-N 2.95Å; Q48-I51 PolarHBondContact O-N 2.88Å; I51-A53 PolarHBondContact O-N 2.94Å; I51-H54 PolarHBondContact O-N 3.5Å; I51-F55 HydrophobicContact CG2-CD2 3.71Å; I51-F55 HydrophobicContact CG2-CE2 3.66Å; I51-F55 WeakPolarHBondContact O-CD2 3.19Å; I51-F55 PolarHBondContact O-N 2.91Å
52	D	96.4	Very high	95.9	Very high	81 Å²	81	100.5 Å²	100.5	43%	0.433	50%	0.5	S	S	.	.	H	α-helix	trans	-64.2	-42.1	-178.4	-65.9	-24.3	0	0	0	111.4	Q48 H54 F55 E56	Q48-D52 PolarHBondContact NE2-OD1 3.36Å; Q48-D52 PolarHBondContact NE2-OD2 3.44Å; Q48-D52 VanDerWaalsContact O-CG 3.29Å; Q48-D52 PolarHBondContact O-N 3.05Å; D52-H54 VanDerWaalsContact C-N 3.34Å; D52-H54 PolarHBondContact O-N 2.9Å; D52-F55 PolarHBondContact O-N 2.9Å; D52-E56 WeakPolarHBondContact O-CB 3.43Å; D52-E56 WeakPolarHBondContact O-CG 3.43Å; D52-E56 PolarHBondContact O-N 3.03Å
53	A	96.9	Very high	96	Very high	58 Å²	58	99.9 Å²	99.9	48%	0.479	50%	0.499	S	S	.	.	H	α-helix	trans	-61.3	-41.1	175.6	0	0	0	0	0	112.2	A49 I51 C57	A49-A53 WeakPolarHBondContact O-CB 3.5Å; A49-A53 PolarHBondContact O-N 2.89Å; I51-A53 PolarHBondContact O-N 2.94Å; A53-C57 WeakPolarHBondContact O-CB 3.34Å; A53-C57 PolarHBondContact O-N 3.47Å
54	H	97.6	Very high	96	Very high	115 Å²	115	102.7 Å²	102.7	53%	0.532	51%	0.51	S	S	.	.	H	α-helix	trans	-65	-45.9	177.4	177.1	-86.9	0	0	0	111.7	L50 I51 D52 C57 R58	L50-H54 WeakPolarHBondContact O-CB 3.15Å; L50-H54 PolarHBondContact O-N 2.83Å; I51-H54 PolarHBondContact O-N 3.5Å; D52-H54 VanDerWaalsContact C-N 3.34Å; D52-H54 PolarHBondContact O-N 2.9Å; H54-C57 PolarHBondContact O-N 3.42Å; H54-R58 VanDerWaalsContact O-CB 3.3Å; H54-R58 WeakPolarHBondContact O-CB 3.47Å; H54-R58 PolarHBondContact O-N 2.92Å
55	F	97.5	Very high	96.1	Very high	130 Å²	130	101.6 Å²	101.6	57%	0.57	50%	0.504	S	S	*	.	H	α-helix	trans	-65.4	-43.5	178.3	-80.7	-67.8	0	0	0	112.4	I51 D52 R58 K59	I51-F55 HydrophobicContact CG2-CD2 3.71Å; I51-F55 HydrophobicContact CG2-CE2 3.66Å; I51-F55 WeakPolarHBondContact O-CD2 3.19Å; I51-F55 PolarHBondContact O-N 2.91Å; D52-F55 PolarHBondContact O-N 2.9Å; F55-R58 PolarHBondContact O-N 3.09Å; F55-K59 WeakPolarHBondContact O-CB 3.44Å; F55-K59 PolarHBondContact O-N 2.88Å
56	E	96.7	Very high	96.1	Very high	93 Å²	93	99.1 Å²	99.1	44%	0.435	49%	0.493	S	S	.	.	H	α-helix	trans	-66.2	-40.2	177.4	-77.8	-64.3	134.9	0	0	112.3	D52 K60	D52-E56 WeakPolarHBondContact O-CB 3.43Å; D52-E56 WeakPolarHBondContact O-CG 3.43Å; D52-E56 PolarHBondContact O-N 3.03Å; E56-K60 WeakPolarHBondContact O-CB 3.49Å; E56-K60 VanDerWaalsContact O-CG 3.29Å; E56-K60 WeakPolarHBondContact O-CG 3.45Å; E56-K60 PolarHBondContact O-N 3.24Å
57	C	96.7	Very high	96.3	Very high	67 Å²	67	96.9 Å²	96.9	45%	0.453	49%	0.491	S	S	.	.	H	α-helix	trans	-61.4	-50.8	175	-170.4	0	0	0	0	110.7	A53 H54 K59 K60 E61	A53-C57 WeakPolarHBondContact O-CB 3.34Å; A53-C57 PolarHBondContact O-N 3.47Å; H54-C57 PolarHBondContact O-N 3.42Å; C57-K59 PolarHBondContact O-N 3.38Å; C57-K60 PolarHBondContact O-N 3.36Å; C57-E61 WeakPolarHBondContact O-CG 3.4Å; C57-E61 PolarHBondContact O-N 2.91Å
58	R	96.6	Very high	96.3	Very high	133 Å²	133	96.5 Å²	96.5	50%	0.502	49%	0.489	S	S	.	.	H	α-helix	trans	-62.9	-41.2	179.8	-170.9	178.8	-179.6	114.6	0.5	112.4	H54 F55 E61 E62	H54-R58 VanDerWaalsContact O-CB 3.3Å; H54-R58 WeakPolarHBondContact O-CB 3.47Å; H54-R58 PolarHBondContact O-N 2.92Å; F55-R58 PolarHBondContact O-N 3.09Å; R58-E61 PolarHBondContact O-N 3.26Å; R58-E62 HydrophobicContact CG-CG 4.38Å; R58-E62 IonicContact CZ-OE1 3.75Å; R58-E62 IonicContact NE-OE1 2.75Å; R58-E62 PolarHBondContact NE-OE1 3.3Å; R58-E62 IonicContact NH2-OE1 3.64Å; R58-E62 WeakPolarHBondContact O-CB 3.44Å; R58-E62 VanDerWaalsContact O-CG 3.32Å; R58-E62 WeakPolarHBondContact O-CG 3.22Å; R58-E62 PolarHBondContact O-N 3.31Å
59	K	97	Very high	96.4	Very high	104 Å²	104	97.7 Å²	97.7	45%	0.452	49%	0.492	S	S	.	.	H	α-helix	trans	-61.7	-45	177.7	-177.6	-179.1	173.5	-169.3	0	111.4	F55 C57 E62 E63	F55-K59 WeakPolarHBondContact O-CB 3.44Å; F55-K59 PolarHBondContact O-N 2.88Å; C57-K59 PolarHBondContact O-N 3.38Å; K59-E62 PolarHBondContact O-N 2.89Å; K59-E63 WeakPolarHBondContact CE-OE1 3.48Å; K59-E63 WeakPolarHBondContact O-CB 3.37Å; K59-E63 VanDerWaalsContact O-CG 3.32Å; K59-E63 WeakPolarHBondContact O-CG 3.32Å; K59-E63 PolarHBondContact O-N 3.43Å
60	K	97	Very high	96.5	Very high	117 Å²	117	100.9 Å²	100.9	51%	0.509	50%	0.497	S	S	.	.	H	α-helix	trans	-62.3	-45.4	175.8	-72.2	171.2	-174.4	173.3	0	111.7	E56 C57 E62 E63 E64	E56-K60 WeakPolarHBondContact O-CB 3.49Å; E56-K60 VanDerWaalsContact O-CG 3.29Å; E56-K60 WeakPolarHBondContact O-CG 3.45Å; E56-K60 PolarHBondContact O-N 3.24Å; C57-K60 PolarHBondContact O-N 3.36Å; K60-E62 VanDerWaalsContact C-N 3.35Å; K60-E62 PolarHBondContact O-N 3.34Å; K60-E63 PolarHBondContact O-N 2.86Å; K60-E64 WeakPolarHBondContact O-CB 3.3Å; K60-E64 WeakPolarHBondContact O-CG 3.26Å; K60-E64 PolarHBondContact O-N 3.45Å
61	E	95.1	Very high	96.5	Very high	121 Å²	121	102.9 Å²	102.9	57%	0.565	50%	0.497	S	S	*	.	H	α-helix	trans	-61.4	-41.9	176	-72.7	178.6	-177.7	0	0	112.4	C57 R58 E64 L65	C57-E61 WeakPolarHBondContact O-CG 3.4Å; C57-E61 PolarHBondContact O-N 2.91Å; R58-E61 PolarHBondContact O-N 3.26Å; E61-E64 PolarHBondContact O-N 2.97Å; E61-L65 VanDerWaalsContact O-CB 3.29Å; E61-L65 WeakPolarHBondContact O-CB 3.45Å; E61-L65 PolarHBondContact O-N 2.97Å
62	E	95.7	Very high	96.6	Very high	93 Å²	93	102.8 Å²	102.8	44%	0.435	50%	0.496	S	S	.	.	H	α-helix	trans	-65.5	-43.6	177.3	-76.2	179.4	-172.4	0	0	111.5	R58 K59 K60 L65 I66	R58-E62 HydrophobicContact CG-CG 4.38Å; R58-E62 IonicContact CZ-OE1 3.75Å; R58-E62 IonicContact NE-OE1 2.75Å; R58-E62 PolarHBondContact NE-OE1 3.3Å; R58-E62 IonicContact NH2-OE1 3.64Å; R58-E62 WeakPolarHBondContact O-CB 3.44Å; R58-E62 VanDerWaalsContact O-CG 3.32Å; R58-E62 WeakPolarHBondContact O-CG 3.22Å; R58-E62 PolarHBondContact O-N 3.31Å; K59-E62 PolarHBondContact O-N 2.89Å; K60-E62 VanDerWaalsContact C-N 3.35Å; K60-E62 PolarHBondContact O-N 3.34Å; E62-L65 PolarHBondContact O-N 2.85Å; E62-I66 WeakPolarHBondContact O-CB 3.35Å; E62-I66 WeakPolarHBondContact O-CD1 3.45Å; E62-I66 WeakPolarHBondContact O-CG1 3.2Å; E62-I66 PolarHBondContact O-N 3.46Å
63	E	96.4	Very high	96.6	Very high	108 Å²	108	105.6 Å²	105.6	51%	0.505	51%	0.507	S	S	.	.	H	α-helix	trans	-61.1	-44.3	175	-75.2	174.9	-171.9	0	0	111.8	K59 K60 I66 A67	K59-E63 WeakPolarHBondContact CE-OE1 3.48Å; K59-E63 WeakPolarHBondContact O-CB 3.37Å; K59-E63 VanDerWaalsContact O-CG 3.32Å; K59-E63 WeakPolarHBondContact O-CG 3.32Å; K59-E63 PolarHBondContact O-N 3.43Å; K60-E63 PolarHBondContact O-N 2.86Å; E63-I66 PolarHBondContact O-N 3.35Å; E63-A67 WeakPolarHBondContact O-CB 3.18Å; E63-A67 PolarHBondContact O-N 2.91Å
64	E	95.6	Very high	96.6	Very high	141 Å²	141	109.2 Å²	109.2	66%	0.659	51%	0.512	S	S	*	.	H	α-helix	trans	-63.6	-41.5	175.7	-74.4	-178.9	-172.4	0	0	112.1	K60 E61 A67 L68	K60-E64 WeakPolarHBondContact O-CB 3.3Å; K60-E64 WeakPolarHBondContact O-CG 3.26Å; K60-E64 PolarHBondContact O-N 3.45Å; E61-E64 PolarHBondContact O-N 2.97Å; E64-A67 PolarHBondContact O-N 3.47Å; E64-L68 WeakPolarHBondContact O-CB 3.37Å; E64-L68 PolarHBondContact O-N 2.91Å
65	L	96.1	Very high	96.5	Very high	88 Å²	88	109.7 Å²	109.7	46%	0.461	51%	0.509	S	S	.	.	H	α-helix	trans	-65.8	-40.7	177.9	-173.8	66.4	0	0	0	111.6	E61 E62 L68 K69	E61-L65 VanDerWaalsContact O-CB 3.29Å; E61-L65 WeakPolarHBondContact O-CB 3.45Å; E61-L65 PolarHBondContact O-N 2.97Å; E62-L65 PolarHBondContact O-N 2.85Å; L65-L68 PolarHBondContact O-N 3.46Å; L65-K69 HydrophobicContact CG-CD 4.46Å; L65-K69 WeakPolarHBondContact O-CB 3.36Å; L65-K69 VanDerWaalsContact O-CG 3.31Å; L65-K69 WeakPolarHBondContact O-CG 3.49Å; L65-K69 PolarHBondContact O-N 2.94Å
66	I	95.4	Very high	96.5	Very high	91 Å²	91	111.5 Å²	111.5	47%	0.467	51%	0.512	S	S	.	.	H	α-helix	trans	-62.8	-50.8	174.9	-70	164.1	0	0	0	109.7	E62 E63 L68 K69 E70	E62-I66 WeakPolarHBondContact O-CB 3.35Å; E62-I66 WeakPolarHBondContact O-CD1 3.45Å; E62-I66 WeakPolarHBondContact O-CG1 3.2Å; E62-I66 PolarHBondContact O-N 3.46Å; E63-I66 PolarHBondContact O-N 3.35Å; I66-L68 VanDerWaalsContact C-N 3.27Å; I66-L68 PolarHBondContact O-N 3.07Å; I66-K69 WeakPolarHBondContact O-CB 3.33Å; I66-K69 PolarHBondContact O-N 3.37Å; I66-K69 VanDerWaalsContact O-N 3.09Å; I66-E70 HydrophobicContact CG2-CG 4.4Å; I66-E70 WeakPolarHBondContact O-CG 3.29Å; I66-E70 PolarHBondContact O-N 3.29Å
67	A	97.2	Very high	96.3	Very high	50 Å²	50	109.9 Å²	109.9	41%	0.413	52%	0.515	S	S	.	.	H	α-helix	trans	-58.9	-37.8	178.8	0	0	0	0	0	112.5	E63 E64 R71	E63-A67 WeakPolarHBondContact O-CB 3.18Å; E63-A67 PolarHBondContact O-N 2.91Å; E64-A67 PolarHBondContact O-N 3.47Å; A67-R71 WeakPolarHBondContact O-CB 3.42Å; A67-R71 PolarHBondContact O-N 2.99Å; A67-R71 VanDerWaalsContact O-N 3.07Å
68	L	97	Very high	96.3	Very high	90 Å²	90	111 Å²	111	47%	0.471	51%	0.513	S	S	.	.	H	α-helix	trans	-67	-44.7	175.3	-177.7	61.9	0	0	0	111.8	E64 L65 I66 R71 I72	E64-L68 WeakPolarHBondContact O-CB 3.37Å; E64-L68 PolarHBondContact O-N 2.91Å; L65-L68 PolarHBondContact O-N 3.46Å; I66-L68 VanDerWaalsContact C-N 3.27Å; I66-L68 PolarHBondContact O-N 3.07Å; L68-R71 PolarHBondContact O-N 2.93Å; L68-I72 HydrophobicContact CD1-CD1 4.41Å; L68-I72 HydrophobicContact CG-CD1 4.17Å; L68-I72 WeakPolarHBondContact O-CG1 3.36Å; L68-I72 PolarHBondContact O-N 3.43Å
69	K	96.2	Very high	96.3	Very high	124 Å²	124	111.3 Å²	111.3	54%	0.539	51%	0.514	S	S	.	.	H	α-helix	trans	-60.3	-47.2	176.5	-77.9	174.2	179.3	174.6	0	111.2	L65 I66 R71 I72 E73	L65-K69 HydrophobicContact CG-CD 4.46Å; L65-K69 WeakPolarHBondContact O-CB 3.36Å; L65-K69 VanDerWaalsContact O-CG 3.31Å; L65-K69 WeakPolarHBondContact O-CG 3.49Å; L65-K69 PolarHBondContact O-N 2.94Å; I66-K69 WeakPolarHBondContact O-CB 3.33Å; I66-K69 PolarHBondContact O-N 3.37Å; I66-K69 VanDerWaalsContact O-N 3.09Å; K69-R71 VanDerWaalsContact C-N 3.31Å; K69-R71 PolarHBondContact O-N 2.9Å; K69-I72 PolarHBondContact O-N 3.38Å; K69-I72 VanDerWaalsContact O-N 3.11Å; K69-E73 WeakPolarHBondContact O-CB 3.43Å; K69-E73 PolarHBondContact O-N 3.32Å
70	E	97	Very high	96.2	Very high	125 Å²	125	108.8 Å²	108.8	58%	0.584	51%	0.512	S	S	*	.	H	α-helix	trans	-58.2	-42.7	176.1	-72.5	-178.8	172.8	0	0	111.7	I66 I72 E73 K74	I66-E70 HydrophobicContact CG2-CG 4.4Å; I66-E70 WeakPolarHBondContact O-CG 3.29Å; I66-E70 PolarHBondContact O-N 3.29Å; E70-I72 VanDerWaalsContact C-N 3.33Å; E70-I72 PolarHBondContact O-N 3.25Å; E70-E73 PolarHBondContact O-N 2.87Å; E70-K74 WeakPolarHBondContact O-CB 3.48Å; E70-K74 PolarHBondContact O-N 3.2Å
71	R	97.4	Very high	96.1	Very high	164 Å²	164	108 Å²	108	62%	0.619	51%	0.51	S	S	*	.	H	α-helix	trans	-66.5	-33.6	177.2	-166.6	-177.7	-69.2	-178.6	-1	112.7	A67 L68 K69 R75	A67-R71 WeakPolarHBondContact O-CB 3.42Å; A67-R71 PolarHBondContact O-N 2.99Å; A67-R71 VanDerWaalsContact O-N 3.07Å; L68-R71 PolarHBondContact O-N 2.93Å; K69-R71 VanDerWaalsContact C-N 3.31Å; K69-R71 PolarHBondContact O-N 2.9Å; R71-R75 WeakPolarHBondContact O-CG 3.43Å; R71-R75 PolarHBondContact O-N 3.27Å; R71-R75 PolarHBondContact O-NE 3.42Å
72	I	96.3	Very high	96.1	Very high	66 Å²	66	107 Å²	107	34%	0.338	51%	0.506	S	S	.	.	H	α-helix	trans	-70.9	-44.7	174.5	-70.5	169.1	0	0	0	110.1	L68 K69 E70 R75 R76	L68-I72 HydrophobicContact CD1-CD1 4.41Å; L68-I72 HydrophobicContact CG-CD1 4.17Å; L68-I72 WeakPolarHBondContact O-CG1 3.36Å; L68-I72 PolarHBondContact O-N 3.43Å; K69-I72 PolarHBondContact O-N 3.38Å; K69-I72 VanDerWaalsContact O-N 3.11Å; E70-I72 VanDerWaalsContact C-N 3.33Å; E70-I72 PolarHBondContact O-N 3.25Å; I72-R75 PolarHBondContact O-N 2.83Å; I72-R76 WeakPolarHBondContact O-CG 3.39Å; I72-R76 PolarHBondContact O-N 2.92Å
73	E	96.4	Very high	95.9	Very high	139 Å²	139	109.1 Å²	109.1	65%	0.65	52%	0.516	S	S	*	.	H	α-helix	trans	-62.7	-46.1	179.5	-171.9	168.6	-171.7	0	0	111.3	K69 E70 R75 R76 A77	K69-E73 WeakPolarHBondContact O-CB 3.43Å; K69-E73 PolarHBondContact O-N 3.32Å; E70-E73 PolarHBondContact O-N 2.87Å; E73-R75 VanDerWaalsContact C-N 3.34Å; E73-R75 PolarHBondContact O-N 3.36Å; E73-R76 WeakPolarHBondContact O-CB 3.3Å; E73-R76 PolarHBondContact O-N 3.37Å; E73-A77 PolarHBondContact O-N 3.27Å
74	K	97.4	Very high	95.7	Very high	135 Å²	135	112.4 Å²	112.4	59%	0.587	52%	0.524	S	S	*	.	H	α-helix	trans	-55.1	-47.4	172.5	-174.7	176.4	178.9	178.2	0	112	E70 R76 A77 E78	E70-K74 WeakPolarHBondContact O-CB 3.48Å; E70-K74 PolarHBondContact O-N 3.2Å; K74-R76 VanDerWaalsContact C-N 3.29Å; K74-R76 PolarHBondContact O-N 2.85Å; K74-A77 PolarHBondContact O-N 3.25Å; K74-E78 VanDerWaalsContact CE-OE1 3.26Å; K74-E78 WeakPolarHBondContact CE-OE1 3.31Å; K74-E78 WeakPolarHBondContact O-CB 3.44Å; K74-E78 WeakPolarHBondContact O-CG 3.36Å; K74-E78 PolarHBondContact O-N 3.32Å
75	R	96.1	Very high	95.6	Very high	125 Å²	125	108.2 Å²	108.2	47%	0.472	51%	0.508	S	S	.	.	H	α-helix	trans	-66.2	-27.8	177	-80.3	-173.1	-83.5	-178	-7.3	113.5	R71 I72 E73 R79	R71-R75 WeakPolarHBondContact O-CG 3.43Å; R71-R75 PolarHBondContact O-N 3.27Å; R71-R75 PolarHBondContact O-NE 3.42Å; I72-R75 PolarHBondContact O-N 2.83Å; E73-R75 VanDerWaalsContact C-N 3.34Å; E73-R75 PolarHBondContact O-N 3.36Å; R75-R79 WeakPolarHBondContact O-CG 3.49Å; R75-R79 PolarHBondContact O-N 3.43Å; R75-R79 PolarHBondContact O-NE 3.04Å
76	R	96.3	Very high	95.5	Very high	167 Å²	167	111.7 Å²	111.7	63%	0.63	52%	0.515	S	S	*	.	H	α-helix	trans	-74.2	-44.7	173.3	-76.2	179.3	178.9	-171.1	-0	110.5	I72 E73 K74 R79 A80	I72-R76 WeakPolarHBondContact O-CG 3.39Å; I72-R76 PolarHBondContact O-N 2.92Å; E73-R76 WeakPolarHBondContact O-CB 3.3Å; E73-R76 PolarHBondContact O-N 3.37Å; K74-R76 VanDerWaalsContact C-N 3.29Å; K74-R76 PolarHBondContact O-N 2.85Å; R76-R79 PolarHBondContact O-N 3.11Å; R76-A80 WeakPolarHBondContact O-CB 3.46Å; R76-A80 PolarHBondContact O-N 2.97Å
77	A	94.1	Very high	95.4	Very high	60 Å²	60	110.3 Å²	110.3	50%	0.496	52%	0.517	S	S	.	.	H	α-helix	trans	-59.9	-45.7	175.7	0	0	0	0	0	111.4	E73 K74 R79 A80 E81	E73-A77 PolarHBondContact O-N 3.27Å; K74-A77 PolarHBondContact O-N 3.25Å; A77-R79 VanDerWaalsContact C-N 3.34Å; A77-R79 PolarHBondContact O-N 2.99Å; A77-A80 PolarHBondContact O-N 2.84Å; A77-E81 WeakPolarHBondContact O-CB 3.41Å; A77-E81 PolarHBondContact O-N 3.33Å
78	E	96.1	Very high	95.1	Very high	91 Å²	91	114.3 Å²	114.3	43%	0.425	53%	0.527	S	S	.	.	H	α-helix	trans	-59.4	-41.7	175.5	-75.3	170.2	-173.7	0	0	112.5	K74 E81 Q82	K74-E78 VanDerWaalsContact CE-OE1 3.26Å; K74-E78 WeakPolarHBondContact CE-OE1 3.31Å; K74-E78 WeakPolarHBondContact O-CB 3.44Å; K74-E78 WeakPolarHBondContact O-CG 3.36Å; K74-E78 PolarHBondContact O-N 3.32Å; E78-E81 PolarHBondContact O-N 2.84Å; E78-Q82 WeakPolarHBondContact O-CB 3.43Å; E78-Q82 VanDerWaalsContact O-CG 3.3Å; E78-Q82 WeakPolarHBondContact O-CG 3.46Å; E78-Q82 PolarHBondContact O-N 3.26Å
79	R	96.5	Very high	95	Very high	139 Å²	139	116 Å²	116	53%	0.525	53%	0.531	S	S	.	.	H	α-helix	trans	-67	-41.3	175.5	-83.1	179.7	-80.3	145.9	-12.6	112.4	R75 R76 A77 E81 Q82 Q83	R75-R79 WeakPolarHBondContact O-CG 3.49Å; R75-R79 PolarHBondContact O-N 3.43Å; R75-R79 PolarHBondContact O-NE 3.04Å; R76-R79 PolarHBondContact O-N 3.11Å; A77-R79 VanDerWaalsContact C-N 3.34Å; A77-R79 PolarHBondContact O-N 2.99Å; R79-E81 VanDerWaalsContact C-N 3.31Å; R79-Q82 PolarHBondContact O-N 3.31Å; R79-Q83 WeakPolarHBondContact O-CG 3.39Å; R79-Q83 PolarHBondContact O-N 2.81Å
80	A	95.2	Very high	94.7	Very high	50 Å²	50	114 Å²	114	41%	0.413	53%	0.526	S	S	.	.	H	α-helix	trans	-61.5	-43.1	175.4	0	0	0	0	0	110.7	R76 A77 Q83 R84	R76-A80 WeakPolarHBondContact O-CB 3.46Å; R76-A80 PolarHBondContact O-N 2.97Å; A77-A80 PolarHBondContact O-N 2.84Å; A80-Q83 WeakPolarHBondContact O-CB 3.49Å; A80-Q83 PolarHBondContact O-N 2.99Å; A80-R84 WeakPolarHBondContact O-CG 3.37Å; A80-R84 PolarHBondContact O-N 3.35Å
81	E	95.2	Very high	94.5	Very high	100 Å²	100	115.6 Å²	115.6	47%	0.467	53%	0.531	S	S	.	.	H	α-helix	trans	-66.2	-43	177.7	-168	57.8	-155	0	0	111.9	A77 E78 R79 Q83 R84 V85	A77-E81 WeakPolarHBondContact O-CB 3.41Å; A77-E81 PolarHBondContact O-N 3.33Å; E78-E81 PolarHBondContact O-N 2.84Å; R79-E81 VanDerWaalsContact C-N 3.31Å; E81-Q83 VanDerWaalsContact C-N 3.25Å; E81-Q83 PolarHBondContact O-N 2.84Å; E81-R84 WeakPolarHBondContact O-CB 3.44Å; E81-R84 PolarHBondContact O-N 3.2Å; E81-R84 VanDerWaalsContact O-N 3.1Å; E81-V85 WeakPolarHBondContact O-CG2 3.45Å; E81-V85 PolarHBondContact O-N 2.87Å
82	Q	94	Very high	94.2	Very high	100 Å²	100	114.1 Å²	114.1	47%	0.467	53%	0.531	S	S	.	.	H	α-helix	trans	-58	-38.5	172.8	-76.2	178	14.7	0	0	112.4	E78 R79 R86	E78-Q82 WeakPolarHBondContact O-CB 3.43Å; E78-Q82 VanDerWaalsContact O-CG 3.3Å; E78-Q82 WeakPolarHBondContact O-CG 3.46Å; E78-Q82 PolarHBondContact O-N 3.26Å; R79-Q82 PolarHBondContact O-N 3.31Å; Q82-R86 WeakPolarHBondContact O-CB 3.48Å; Q82-R86 VanDerWaalsContact O-CG 3.3Å; Q82-R86 WeakPolarHBondContact O-CG 3.25Å; Q82-R86 PolarHBondContact O-N 3.18Å
83	Q	91.4	Very high	93.9	Very high	138 Å²	138	117.6 Å²	117.6	65%	0.645	54%	0.54	S	S	*	.	H	α-helix	trans	-68	-41.5	174.9	-74.3	-179.3	-3.5	0	0	111.9	R79 A80 E81 R86 A87	R79-Q83 WeakPolarHBondContact O-CG 3.39Å; R79-Q83 PolarHBondContact O-N 2.81Å; A80-Q83 WeakPolarHBondContact O-CB 3.49Å; A80-Q83 PolarHBondContact O-N 2.99Å; E81-Q83 VanDerWaalsContact C-N 3.25Å; E81-Q83 PolarHBondContact O-N 2.84Å; Q83-R86 PolarHBondContact O-N 2.98Å; Q83-A87 WeakPolarHBondContact O-CB 3.41Å; Q83-A87 PolarHBondContact O-N 3.4Å
84	R	92.8	Very high	93.4	Very high	177 Å²	177	116.1 Å²	116.1	67%	0.668	53%	0.533	S	S	*	.	H	α-helix	trans	-60.2	-49.4	175.1	-73.2	-173.4	70.6	162.4	1	111.7	A80 E81 R86 A87 E88	A80-R84 WeakPolarHBondContact O-CG 3.37Å; A80-R84 PolarHBondContact O-N 3.35Å; E81-R84 WeakPolarHBondContact O-CB 3.44Å; E81-R84 PolarHBondContact O-N 3.2Å; E81-R84 VanDerWaalsContact O-N 3.1Å; R84-R86 VanDerWaalsContact C-N 3.32Å; R84-R86 PolarHBondContact O-N 3.45Å; R84-A87 PolarHBondContact O-N 2.82Å; R84-E88 WeakPolarHBondContact O-CB 3.42Å; R84-E88 PolarHBondContact O-N 3.1Å
85	V	94.4	Very high	92.9	Very high	54 Å²	54	112 Å²	112	33%	0.327	52%	0.524	S	S	.	.	H	α-helix	trans	-61.3	-40.4	178.6	172.7	0	0	0	0	111.4	E81 K89	E81-V85 WeakPolarHBondContact O-CG2 3.45Å; E81-V85 PolarHBondContact O-N 2.87Å; V85-K89 HydrophobicContact CG1-CD 4.29Å; V85-K89 WeakPolarHBondContact O-CB 3.49Å; V85-K89 WeakPolarHBondContact O-CG 3.36Å; V85-K89 PolarHBondContact O-N 3.29Å
86	R	92.7	Very high	92.6	Very high	160 Å²	160	114.8 Å²	114.8	60%	0.604	53%	0.534	S	S	*	.	H	α-helix	trans	-63.8	-46.7	174.5	-76.7	177.6	-175.1	149.6	4.4	111.6	Q82 Q83 R84 E88 K89 D90	Q82-R86 WeakPolarHBondContact O-CB 3.48Å; Q82-R86 VanDerWaalsContact O-CG 3.3Å; Q82-R86 WeakPolarHBondContact O-CG 3.25Å; Q82-R86 PolarHBondContact O-N 3.18Å; Q83-R86 PolarHBondContact O-N 2.98Å; R84-R86 VanDerWaalsContact C-N 3.32Å; R84-R86 PolarHBondContact O-N 3.45Å; R86-E88 VanDerWaalsContact C-N 3.32Å; R86-E88 PolarHBondContact O-N 2.92Å; R86-K89 PolarHBondContact O-N 3.22Å; R86-D90 WeakPolarHBondContact O-CB 3.48Å; R86-D90 VanDerWaalsContact O-CG 3.28Å; R86-D90 PolarHBondContact O-N 2.9Å
87	A	93.1	Very high	91.9	Very high	62 Å²	62	113.4 Å²	113.4	51%	0.512	53%	0.529	S	S	.	.	H	α-helix	trans	-62.6	-39.3	178.3	0	0	0	0	0	112.2	Q83 R84 D90 K91	Q83-A87 WeakPolarHBondContact O-CB 3.41Å; Q83-A87 PolarHBondContact O-N 3.4Å; R84-A87 PolarHBondContact O-N 2.82Å; A87-D90 PolarHBondContact O-N 3.39Å; A87-K91 WeakPolarHBondContact O-CB 3.45Å; A87-K91 PolarHBondContact O-N 3.4Å
88	E	92.6	Very high	91.3	Very high	134 Å²	134	115.1 Å²	115.1	63%	0.626	53%	0.527	S	S	*	.	H	α-helix	trans	-66.9	-46.7	176.9	-173.1	171	-160.3	0	0	111.7	R84 R86 D90 K91 E92	R84-E88 WeakPolarHBondContact O-CB 3.42Å; R84-E88 PolarHBondContact O-N 3.1Å; R86-E88 VanDerWaalsContact C-N 3.32Å; R86-E88 PolarHBondContact O-N 2.92Å; E88-D90 VanDerWaalsContact C-N 3.28Å; E88-D90 PolarHBondContact O-N 2.9Å; E88-K91 PolarHBondContact O-N 3.37Å; E88-E92 WeakPolarHBondContact O-CB 3.3Å; E88-E92 PolarHBondContact O-N 2.95Å
89	K	93.8	Very high	90.7	Very high	127 Å²	127	115.6 Å²	115.6	55%	0.552	53%	0.529	S	S	*	.	H	α-helix	trans	-60.2	-37.4	173.8	-75.9	-178.8	177.3	-179.4	0	112.4	V85 R86 R93	V85-K89 HydrophobicContact CG1-CD 4.29Å; V85-K89 WeakPolarHBondContact O-CB 3.49Å; V85-K89 WeakPolarHBondContact O-CG 3.36Å; V85-K89 PolarHBondContact O-N 3.29Å; R86-K89 PolarHBondContact O-N 3.22Å; K89-R93 WeakPolarHBondContact O-CB 3.45Å; K89-R93 VanDerWaalsContact O-CG 3.25Å; K89-R93 WeakPolarHBondContact O-CG 3.42Å; K89-R93 PolarHBondContact O-N 3.43Å
90	D	90.6	Very high	89.9	Confident	81 Å²	81	115.1 Å²	115.1	43%	0.433	53%	0.533	S	S	.	.	H	α-helix	trans	-67.9	-42.9	176.4	-74.2	-5.7	0	0	0	111.6	R86 A87 E88 R93 Q94	R86-D90 WeakPolarHBondContact O-CB 3.48Å; R86-D90 VanDerWaalsContact O-CG 3.28Å; R86-D90 PolarHBondContact O-N 2.9Å; A87-D90 PolarHBondContact O-N 3.39Å; E88-D90 VanDerWaalsContact C-N 3.28Å; E88-D90 PolarHBondContact O-N 2.9Å; D90-R93 PolarHBondContact O-N 3.48Å; D90-R93 IonicContact OD1-CZ 2.96Å; D90-R93 IonicContact OD1-NE 3.73Å; D90-R93 IonicContact OD1-NH2 3.2Å; D90-R93 PolarHBondContact OD1-NH2 2.97Å; D90-Q94 WeakPolarHBondContact O-CB 3.33Å; D90-Q94 PolarHBondContact O-N 2.97Å
91	K	92.9	Very high	89.2	Confident	159 Å²	159	119.6 Å²	119.6	69%	0.691	54%	0.539	S	S	*	.	H	α-helix	trans	-63.3	-42.7	175.1	-170	179.7	-180	-174.8	0	111.7	A87 E88 Q94 A95	A87-K91 WeakPolarHBondContact O-CB 3.45Å; A87-K91 PolarHBondContact O-N 3.4Å; E88-K91 PolarHBondContact O-N 3.37Å; K91-Q94 PolarHBondContact O-N 2.62Å; K91-A95 WeakPolarHBondContact O-CB 3.25Å; K91-A95 PolarHBondContact O-N 3.32Å
92	E	90.9	Very high	88.4	Confident	132 Å²	132	121.2 Å²	121.2	62%	0.617	54%	0.541	S	S	*	.	H	α-helix	trans	-63.3	-45.5	176	-172.5	-170.3	179	0	0	111.4	E88 Q94 A95 R96	E88-E92 WeakPolarHBondContact O-CB 3.3Å; E88-E92 PolarHBondContact O-N 2.95Å; E92-Q94 PolarHBondContact O-N 3.06Å; E92-A95 PolarHBondContact O-N 3.02Å; E92-R96 WeakPolarHBondContact O-CB 3.29Å; E92-R96 PolarHBondContact O-N 2.87Å
93	R	89.9	Confident	87.8	Confident	140 Å²	140	121 Å²	121	53%	0.528	54%	0.542	S	S	.	.	H	α-helix	trans	-61.5	-34.1	175	-74.3	-170.3	-60.3	168.2	-0.7	112.3	K89 D90 R97	K89-R93 WeakPolarHBondContact O-CB 3.45Å; K89-R93 VanDerWaalsContact O-CG 3.25Å; K89-R93 WeakPolarHBondContact O-CG 3.42Å; K89-R93 PolarHBondContact O-N 3.43Å; D90-R93 PolarHBondContact O-N 3.48Å; D90-R93 IonicContact OD1-CZ 2.96Å; D90-R93 IonicContact OD1-NE 3.73Å; D90-R93 IonicContact OD1-NH2 3.2Å; D90-R93 PolarHBondContact OD1-NH2 2.97Å; R93-R97 WeakPolarHBondContact O-CG 3.45Å; R93-R97 PolarHBondContact O-N 3.37Å; R93-R97 PolarHBondContact O-NH1 2.9Å
94	Q	85.3	Confident	87.3	Confident	108 Å²	108	122.8 Å²	122.8	51%	0.505	54%	0.543	S	S	.	.	H	α-helix	trans	-73	-46.5	175.4	-174.8	169.5	-13.6	0	0	111.3	D90 K91 E92 R96 R97 E98	D90-Q94 WeakPolarHBondContact O-CB 3.33Å; D90-Q94 PolarHBondContact O-N 2.97Å; K91-Q94 PolarHBondContact O-N 2.62Å; E92-Q94 PolarHBondContact O-N 3.06Å; Q94-R96 VanDerWaalsContact C-N 3.34Å; Q94-R96 PolarHBondContact O-N 3.38Å; Q94-R97 PolarHBondContact O-N 3.47Å; Q94-R97 VanDerWaalsContact O-N 3.15Å; Q94-E98 WeakPolarHBondContact CG-OE1 3.34Å; Q94-E98 PolarHBondContact NE2-OE1 3.14Å; Q94-E98 WeakPolarHBondContact O-CG 3.37Å; Q94-E98 PolarHBondContact O-N 3.08Å
95	A	87.8	Confident	86.6	Confident	49 Å²	49	119.8 Å²	119.8	41%	0.405	54%	0.536	S	S	.	.	H	α-helix	trans	-58.2	-44.3	177.1	0	0	0	0	0	111.6	K91 E92 R97 E98 E99	K91-A95 WeakPolarHBondContact O-CB 3.25Å; K91-A95 PolarHBondContact O-N 3.32Å; E92-A95 PolarHBondContact O-N 3.02Å; A95-R97 VanDerWaalsContact C-N 3.34Å; A95-R97 PolarHBondContact O-N 2.8Å; A95-E98 CarbonylContact O-C 3.59Å; A95-E98 PolarHBondContact O-N 2.78Å; A95-E98 VanDerWaalsContact O-N 3.14Å; A95-E99 WeakPolarHBondContact O-CB 3.34Å; A95-E99 PolarHBondContact O-N 2.95Å
96	R	88.4	Confident	85.8	Confident	182 Å²	182	122.3 Å²	122.3	69%	0.687	55%	0.545	S	S	*	.	H	α-helix	trans	-61.1	-39.7	176.1	-171.8	178.2	177.6	-166.1	-0	112.7	E92 Q94 E98 E100	E92-R96 WeakPolarHBondContact O-CB 3.29Å; E92-R96 PolarHBondContact O-N 2.87Å; Q94-R96 VanDerWaalsContact C-N 3.34Å; Q94-R96 PolarHBondContact O-N 3.38Å; R96-E98 VanDerWaalsContact C-N 3.34Å; R96-E100 VanDerWaalsContact O-CB 3.29Å; R96-E100 WeakPolarHBondContact O-CB 3.35Å; R96-E100 PolarHBondContact O-N 3.39Å
97	R	81.8	Confident	85.3	Confident	139 Å²	139	116.8 Å²	116.8	53%	0.525	53%	0.534	S	S	.	.	H	α-helix	trans	-70.9	-30.4	175.9	-72	-176.9	-166.4	107.4	-8.7	112.8	R93 Q94 A95 R101	R93-R97 WeakPolarHBondContact O-CG 3.45Å; R93-R97 PolarHBondContact O-N 3.37Å; R93-R97 PolarHBondContact O-NH1 2.9Å; Q94-R97 PolarHBondContact O-N 3.47Å; Q94-R97 VanDerWaalsContact O-N 3.15Å; A95-R97 VanDerWaalsContact C-N 3.34Å; A95-R97 PolarHBondContact O-N 2.8Å; R97-R101 WeakPolarHBondContact O-CB 3.29Å; R97-R101 WeakPolarHBondContact O-CG 3.34Å; R97-R101 PolarHBondContact O-N 2.81Å; R97-R101 PolarHBondContact O-NE 3.24Å
98	E	83.2	Confident	84.6	Confident	95 Å²	95	117.9 Å²	117.9	44%	0.444	53%	0.531	S	S	.	.	H	α-helix	trans	-76.4	-40.1	175.7	-73.2	173.7	-170.3	0	0	110.8	Q94 A95 R96 R101 R102	Q94-E98 WeakPolarHBondContact CG-OE1 3.34Å; Q94-E98 PolarHBondContact NE2-OE1 3.14Å; Q94-E98 WeakPolarHBondContact O-CG 3.37Å; Q94-E98 PolarHBondContact O-N 3.08Å; A95-E98 CarbonylContact O-C 3.59Å; A95-E98 PolarHBondContact O-N 2.78Å; A95-E98 VanDerWaalsContact O-N 3.14Å; R96-E98 VanDerWaalsContact C-N 3.34Å; E98-R101 PolarHBondContact O-N 3.15Å; E98-R102 WeakPolarHBondContact O-CB 3.33Å; E98-R102 PolarHBondContact O-N 2.92Å
99	E	81.7	Confident	83.9	Confident	102 Å²	102	114.3 Å²	114.3	48%	0.477	52%	0.524	S	S	.	.	H	α-helix	trans	-67.3	-44.4	174.9	-174.8	173.8	-155.9	0	0	112.2	A95 R101 R102 I103	A95-E99 WeakPolarHBondContact O-CB 3.34Å; A95-E99 PolarHBondContact O-N 2.95Å; E99-R101 VanDerWaalsContact C-N 3.28Å; E99-R101 PolarHBondContact O-N 3.24Å; E99-R102 CarbonylContact O-C 3.59Å; E99-R102 PolarHBondContact O-N 3.41Å; E99-R102 VanDerWaalsContact O-N 3.08Å; E99-I103 HydrophobicContact CG-CD1 3.99Å; E99-I103 HydrophobicContact CG-CG1 4.47Å; E99-I103 WeakPolarHBondContact O-CG1 3.48Å; E99-I103 PolarHBondContact O-N 3.41Å
100	E	81.1	Confident	83.4	Confident	128 Å²	128	115.1 Å²	115.1	60%	0.598	53%	0.528	S	S	*	.	H	α-helix	trans	-61.9	-38.4	174.1	-171.9	-175.4	164.2	0	0	111.3	R96 R104	R96-E100 VanDerWaalsContact O-CB 3.29Å; R96-E100 WeakPolarHBondContact O-CB 3.35Å; R96-E100 PolarHBondContact O-N 3.39Å; E100-R104 VanDerWaalsContact O-CB 3.29Å; E100-R104 WeakPolarHBondContact O-CB 3.37Å; E100-R104 PolarHBondContact O-N 3.2Å
101	R	79.8	Confident	82.9	Confident	144 Å²	144	117.8 Å²	117.8	54%	0.543	54%	0.535	S	S	.	.	H	α-helix	trans	-65.2	-41.8	171.3	-83.7	-168.6	-76	-166.7	1.3	111.9	R97 E98 E99 R104 E105	R97-R101 WeakPolarHBondContact O-CB 3.29Å; R97-R101 WeakPolarHBondContact O-CG 3.34Å; R97-R101 PolarHBondContact O-N 2.81Å; R97-R101 PolarHBondContact O-NE 3.24Å; E98-R101 PolarHBondContact O-N 3.15Å; E99-R101 VanDerWaalsContact C-N 3.28Å; E99-R101 PolarHBondContact O-N 3.24Å; R101-R104 PolarHBondContact O-N 3.41Å; R101-E105 VanDerWaalsContact O-CB 3.32Å; R101-E105 WeakPolarHBondContact O-CB 3.26Å; R101-E105 VanDerWaalsContact O-CG 3.25Å; R101-E105 WeakPolarHBondContact O-CG 3.37Å; R101-E105 PolarHBondContact O-N 2.99Å
102	R	79.1	Confident	82.3	Confident	134 Å²	134	112 Å²	112	51%	0.506	51%	0.51	S	S	.	.	H	α-helix	trans	-64.4	-44.3	178.5	-155.8	-172.8	76.3	-146	-8.2	111.4	E98 E99 R104 E105 E106	E98-R102 WeakPolarHBondContact O-CB 3.33Å; E98-R102 PolarHBondContact O-N 2.92Å; E99-R102 CarbonylContact O-C 3.59Å; E99-R102 PolarHBondContact O-N 3.41Å; E99-R102 VanDerWaalsContact O-N 3.08Å; R102-R104 VanDerWaalsContact C-N 3.34Å; R102-R104 PolarHBondContact O-N 2.97Å; R102-E105 PolarHBondContact O-N 3.45Å; R102-E106 WeakPolarHBondContact CG-OE1 3.32Å; R102-E106 IonicContact CZ-OE1 3.68Å; R102-E106 IonicContact NE-OE1 2.73Å; R102-E106 PolarHBondContact NE-OE1 3.25Å; R102-E106 VanDerWaalsContact O-CB 3.32Å; R102-E106 WeakPolarHBondContact O-CB 3.31Å; R102-E106 VanDerWaalsContact O-CG 3.25Å; R102-E106 WeakPolarHBondContact O-CG 3.37Å; R102-E106 PolarHBondContact O-N 2.9Å
103	I	80.8	Confident	81.7	Confident	95 Å²	95	108.1 Å²	108.1	49%	0.487	50%	0.501	S	S	.	.	H	α-helix	trans	-63.2	-41.3	175.9	-67.9	168.8	0	0	0	110.7	E99 E106 A107	E99-I103 HydrophobicContact CG-CD1 3.99Å; E99-I103 HydrophobicContact CG-CG1 4.47Å; E99-I103 WeakPolarHBondContact O-CG1 3.48Å; E99-I103 PolarHBondContact O-N 3.41Å; I103-E106 PolarHBondContact O-N 3.36Å; I103-A107 VanDerWaalsContact O-CB 3.25Å; I103-A107 WeakPolarHBondContact O-CB 3.44Å; I103-A107 PolarHBondContact O-N 3.47Å
104	R	80.6	Confident	81.2	Confident	176 Å²	176	105.6 Å²	105.6	66%	0.664	50%	0.498	S	S	*	.	H	α-helix	trans	-65.7	-42.7	175.4	-174.3	173.9	-176.8	165.6	3.9	112	E100 R101 R102 A107 D108	E100-R104 VanDerWaalsContact O-CB 3.29Å; E100-R104 WeakPolarHBondContact O-CB 3.37Å; E100-R104 PolarHBondContact O-N 3.2Å; R101-R104 PolarHBondContact O-N 3.41Å; R102-R104 VanDerWaalsContact C-N 3.34Å; R102-R104 PolarHBondContact O-N 2.97Å; R104-A107 PolarHBondContact O-N 2.87Å; R104-D108 VanDerWaalsContact O-CB 3.29Å; R104-D108 WeakPolarHBondContact O-CB 3.25Å; R104-D108 PolarHBondContact O-N 3.35Å
105	E	78.4	Confident	80.9	Confident	114 Å²	114	105 Å²	105	53%	0.533	50%	0.495	S	S	.	.	H	α-helix	trans	-66.1	-39.4	176.4	-75.3	175.6	-170.6	0	0	111.8	R101 R102 A109	R101-E105 VanDerWaalsContact O-CB 3.32Å; R101-E105 WeakPolarHBondContact O-CB 3.26Å; R101-E105 VanDerWaalsContact O-CG 3.25Å; R101-E105 WeakPolarHBondContact O-CG 3.37Å; R101-E105 PolarHBondContact O-N 2.99Å; R102-E105 PolarHBondContact O-N 3.45Å; E105-A109 WeakPolarHBondContact O-CB 3.37Å; E105-A109 PolarHBondContact O-N 2.83Å
106	E	77.8	Confident	80.2	Confident	107 Å²	107	108.1 Å²	108.1	50%	0.5	50%	0.501	S	S	.	.	H	α-helix	trans	-66.5	-41.9	174.2	-75.6	171.8	-156.8	0	0	111.4	R102 I103 A109 K110	R102-E106 WeakPolarHBondContact CG-OE1 3.32Å; R102-E106 IonicContact CZ-OE1 3.68Å; R102-E106 IonicContact NE-OE1 2.73Å; R102-E106 PolarHBondContact NE-OE1 3.25Å; R102-E106 VanDerWaalsContact O-CB 3.32Å; R102-E106 WeakPolarHBondContact O-CB 3.31Å; R102-E106 VanDerWaalsContact O-CG 3.25Å; R102-E106 WeakPolarHBondContact O-CG 3.37Å; R102-E106 PolarHBondContact O-N 2.9Å; I103-E106 PolarHBondContact O-N 3.36Å; E106-A109 PolarHBondContact O-N 3.37Å; E106-K110 VanDerWaalsContact O-CB 3.31Å; E106-K110 WeakPolarHBondContact O-CB 3.12Å; E106-K110 PolarHBondContact O-N 2.87Å
107	A	81.7	Confident	79.6	Confident	45 Å²	45	102.3 Å²	102.3	37%	0.372	49%	0.492	S	S	.	.	H	α-helix	trans	-68.3	-41.2	176.6	0	0	0	0	0	112.4	I103 R104 K110 K111	I103-A107 VanDerWaalsContact O-CB 3.25Å; I103-A107 WeakPolarHBondContact O-CB 3.44Å; I103-A107 PolarHBondContact O-N 3.47Å; R104-A107 PolarHBondContact O-N 2.87Å; A107-K110 PolarHBondContact O-N 3.44Å; A107-K111 WeakPolarHBondContact O-CB 3.29Å; A107-K111 WeakPolarHBondContact O-CG 3.32Å; A107-K111 PolarHBondContact O-N 2.81Å
108	D	77.9	Confident	79.3	Confident	85 Å²	85	103.1 Å²	103.1	46%	0.455	50%	0.499	S	S	.	.	H	α-helix	trans	-69.6	-38	175.7	-75.6	-21.1	0	0	0	110.9	R104 K112	R104-D108 VanDerWaalsContact O-CB 3.29Å; R104-D108 WeakPolarHBondContact O-CB 3.25Å; R104-D108 PolarHBondContact O-N 3.35Å; D108-K112 WeakPolarHBondContact O-CB 3.4Å; D108-K112 PolarHBondContact O-N 2.85Å
109	A	79.6	Confident	78.6	Confident	59 Å²	59	101.4 Å²	101.4	49%	0.488	49%	0.49	S	S	.	.	H	α-helix	trans	-64.8	-41.4	173.4	0	0	0	0	0	111.9	E105 E106 K112 A113	E105-A109 WeakPolarHBondContact O-CB 3.37Å; E105-A109 PolarHBondContact O-N 2.83Å; E106-A109 PolarHBondContact O-N 3.37Å; A109-K112 PolarHBondContact O-N 3.49Å; A109-A113 WeakPolarHBondContact O-CB 3.45Å; A109-A113 PolarHBondContact O-N 2.94Å
110	K	81.6	Confident	78	Confident	144 Å²	144	103.9 Å²	103.9	63%	0.626	50%	0.5	S	S	*	.	H	α-helix	trans	-65.6	-46.6	176	-171.5	176.3	179.8	-179.9	0	111.7	E106 A107 K112 A113 D114	E106-K110 VanDerWaalsContact O-CB 3.31Å; E106-K110 WeakPolarHBondContact O-CB 3.12Å; E106-K110 PolarHBondContact O-N 2.87Å; A107-K110 PolarHBondContact O-N 3.44Å; K110-K112 VanDerWaalsContact C-N 3.27Å; K110-K112 PolarHBondContact O-N 2.87Å; K110-A113 PolarHBondContact O-N 2.94Å; K110-D114 PolarHBondContact O-N 2.8Å
111	K	80.3	Confident	77.4	Confident	137 Å²	137	102.2 Å²	102.2	60%	0.596	50%	0.502	S	S	*	.	H	α-helix	trans	-60	-38.9	173.9	-76.8	178.8	-180	177.6	0	112	A107 D114 E115	A107-K111 WeakPolarHBondContact O-CB 3.29Å; A107-K111 WeakPolarHBondContact O-CG 3.32Å; A107-K111 PolarHBondContact O-N 2.81Å; K111-D114 PolarHBondContact O-N 2.79Å; K111-E115 WeakPolarHBondContact O-CB 3.25Å; K111-E115 WeakPolarHBondContact O-CG 3.38Å; K111-E115 PolarHBondContact O-N 3.24Å
112	K	80	Confident	76.6	Confident	36 Å²	36	98.1 Å²	98.1	16%	0.157	50%	0.499	C	S	.	.	H	α-helix	trans	-68.6	-40.6	177.6	-166	179.6	-177.9	-155.9	0	111.9	D108 A109 K110 E115 E116 D138	D108-K112 WeakPolarHBondContact O-CB 3.4Å; D108-K112 PolarHBondContact O-N 2.85Å; A109-K112 PolarHBondContact O-N 3.49Å; K110-K112 VanDerWaalsContact C-N 3.27Å; K110-K112 PolarHBondContact O-N 2.87Å; K112-E115 PolarHBondContact O-N 2.92Å; K112-E116 WeakPolarHBondContact O-CB 3.28Å; K112-E116 PolarHBondContact O-N 3.47Å; K112-D138 WeakPolarHBondContact CE-OD1 3.39Å; K112-D138 WeakPolarHBondContact CE-OD2 3.36Å; K112-D138 PolarHBondContact NZ-O 2.78Å; K112-D138 IonicContact NZ-OD1 2.78Å; K112-D138 PolarHBondContact NZ-OD1 2.99Å; K112-D138 IonicContact NZ-OD2 2.93Å; K112-D138 PolarHBondContact NZ-OD2 3.22Å
113	A	79.7	Confident	75.6	Confident	52 Å²	52	94.3 Å²	94.3	43%	0.43	49%	0.488	S	S	.	.	H	α-helix	trans	-64.3	-40.8	173.7	0	0	0	0	0	111.8	A109 K110 E116 A117	A109-A113 WeakPolarHBondContact O-CB 3.45Å; A109-A113 PolarHBondContact O-N 2.94Å; K110-A113 PolarHBondContact O-N 2.94Å; A113-E116 PolarHBondContact O-N 3.28Å; A113-A117 VanDerWaalsContact O-CB 3.28Å; A113-A117 WeakPolarHBondContact O-CB 3.21Å; A113-A117 PolarHBondContact O-N 3.41Å
114	D	79.4	Confident	74.5	Confident	86 Å²	86	94.8 Å²	94.8	46%	0.46	50%	0.5	S	S	.	.	H	α-helix	trans	-68.1	-40.6	176.2	-69.8	-22.6	0	0	0	112	K110 K111 K118	K110-D114 PolarHBondContact O-N 2.8Å; K111-D114 PolarHBondContact O-N 2.79Å; D114-K118 WeakPolarHBondContact O-CB 3.42Å; D114-K118 VanDerWaalsContact O-CG 3.26Å; D114-K118 WeakPolarHBondContact O-CG 3.1Å; D114-K118 PolarHBondContact O-N 2.97Å
115	E	77.3	Confident	73.4	Confident	96 Å²	96	91.3 Å²	91.3	45%	0.449	50%	0.503	S	S	.	.	H	α-helix	trans	-65.6	-40.7	172.9	-79.3	-175.4	-169	0	0	111.5	K111 K112 K118 K119 R141	K111-E115 WeakPolarHBondContact O-CB 3.25Å; K111-E115 WeakPolarHBondContact O-CG 3.38Å; K111-E115 PolarHBondContact O-N 3.24Å; K112-E115 PolarHBondContact O-N 2.92Å; E115-K118 PolarHBondContact O-N 2.73Å; E115-K119 WeakPolarHBondContact O-CB 3.41Å; E115-K119 PolarHBondContact O-N 3.34Å; E115-R141 IonicContact OE1-NH2 2.93Å; E115-R141 IonicContact OE2-CZ 3.5Å; E115-R141 IonicContact OE2-NH1 2.62Å; E115-R141 PolarHBondContact OE2-NH1 3.18Å; E115-R141 IonicContact OE2-NH2 3.62Å
116	E	74.6	Confident	72.2	Confident	115 Å²	115	93.1 Å²	93.1	54%	0.537	51%	0.513	S	S	.	.	H	α-helix	trans	-69.3	-38.6	177.8	-170.8	175.4	-174	0	0	111.7	K112 A113 K119 K120	K112-E116 WeakPolarHBondContact O-CB 3.28Å; K112-E116 PolarHBondContact O-N 3.47Å; A113-E116 PolarHBondContact O-N 3.28Å; E116-K119 PolarHBondContact O-N 2.94Å; E116-K120 WeakPolarHBondContact O-CB 3.18Å; E116-K120 PolarHBondContact O-N 3.49Å
117	A	76.2	Confident	71.1	Confident	59 Å²	59	91 Å²	91	49%	0.488	52%	0.52	S	S	.	.	H	α-helix	trans	-63.9	-47	173	0	0	0	0	0	111.4	A113 K119 K120 S121	A113-A117 VanDerWaalsContact O-CB 3.28Å; A113-A117 WeakPolarHBondContact O-CB 3.21Å; A113-A117 PolarHBondContact O-N 3.41Å; A117-K119 VanDerWaalsContact C-N 3.31Å; A117-K119 PolarHBondContact O-N 3.44Å; A117-K120 PolarHBondContact O-N 2.84Å; A117-S121 WeakPolarHBondContact O-CB 3.12Å; A117-S121 PolarHBondContact O-N 3.41Å
118	K	75.2	Confident	70.1	Confident	156 Å²	156	94.2 Å²	94.2	68%	0.678	54%	0.539	S	S	*	.	H	α-helix	trans	-61.9	-39.5	173.9	-74.8	174.5	-177.9	177.2	0	111.7	D114 E115 S121 A122	D114-K118 WeakPolarHBondContact O-CB 3.42Å; D114-K118 VanDerWaalsContact O-CG 3.26Å; D114-K118 WeakPolarHBondContact O-CG 3.1Å; D114-K118 PolarHBondContact O-N 2.97Å; E115-K118 PolarHBondContact O-N 2.73Å; K118-S121 WeakPolarHBondContact O-CB 3.12Å; K118-S121 PolarHBondContact O-N 2.77Å; K118-A122 WeakPolarHBondContact O-CB 2.71Å; K118-A122 PolarHBondContact O-N 2.8Å
119	K	68.4	Low	69.3	Low	59 Å²	59	97.4 Å²	97.4	26%	0.257	56%	0.556	S	S	.	*	H	α-helix	trans	-73.7	-36.5	179	-159.1	-155.4	-165.1	88.6	0	112.7	E115 E116 A117 S121 A122 L123 L134	E115-K119 WeakPolarHBondContact O-CB 3.41Å; E115-K119 PolarHBondContact O-N 3.34Å; E116-K119 PolarHBondContact O-N 2.94Å; A117-K119 VanDerWaalsContact C-N 3.31Å; A117-K119 PolarHBondContact O-N 3.44Å; K119-S121 VanDerWaalsContact C-N 3.31Å; K119-A122 CarbonylContact O-C 3.6Å; K119-A122 PolarHBondContact O-N 2.75Å; K119-L123 HydrophobicContact CD-CD1 3.57Å; K119-L123 HydrophobicContact CD-CG 4.43Å; K119-L123 VanDerWaalsContact CE-CD1 3.49Å; K119-L123 HydrophobicContact CG-CD1 3.73Å; K119-L123 HydrophobicContact CG-CG 4.08Å; K119-L123 WeakPolarHBondContact O-CB 3.3Å; K119-L123 WeakPolarHBondContact O-CG 3.39Å; K119-L123 PolarHBondContact O-N 2.96Å; K119-L134 HydrophobicContact CD-CD1 4.38Å; K119-L134 HydrophobicContact CD-CD2 3.13Å; K119-L134 HydrophobicContact CD-CG 4.23Å; K119-L134 VanDerWaalsContact NZ-CD2 3.32Å
120	K	68.9	Low	68	Low	155 Å²	155	100.6 Å²	100.6	67%	0.674	56%	0.557	S	S	*	*	H	α-helix	trans	-66.3	-37.6	173.3	-173.9	179.2	179.2	-175.9	0	110.7	E116 A117 S124	E116-K120 WeakPolarHBondContact O-CB 3.18Å; E116-K120 PolarHBondContact O-N 3.49Å; A117-K120 PolarHBondContact O-N 2.84Å; K120-S124 WeakPolarHBondContact O-CB 3.37Å; K120-S124 PolarHBondContact O-N 3.18Å; K120-S124 PolarHBondContact O-OG 3.14Å
121	S	67.4	Low	66.8	Low	92 Å²	92	96.7 Å²	96.7	64%	0.643	55%	0.547	S	S	*	.	H	α-helix	trans	-61.7	-43.4	169.4	-169.4	0	0	0	0	111.7	A117 K118 K119	A117-S121 WeakPolarHBondContact O-CB 3.12Å; A117-S121 PolarHBondContact O-N 3.41Å; K118-S121 WeakPolarHBondContact O-CB 3.12Å; K118-S121 PolarHBondContact O-N 2.77Å; K119-S121 VanDerWaalsContact C-N 3.31Å
122	A	63.1	Low	65.7	Low	59 Å²	59	94.1 Å²	94.1	49%	0.488	55%	0.547	S	S	.	.	H	α-helix	trans	-76.3	-36.6	-180	0	0	0	0	0	114	K118 K119 S125 M126	K118-A122 WeakPolarHBondContact O-CB 2.71Å; K118-A122 PolarHBondContact O-N 2.8Å; K119-A122 CarbonylContact O-C 3.6Å; K119-A122 PolarHBondContact O-N 2.75Å; A122-S125 VanDerWaalsContact O-CB 3.3Å; A122-S125 WeakPolarHBondContact O-CB 3.22Å; A122-S125 PolarHBondContact O-N 3.11Å; A122-S125 VanDerWaalsContact O-N 3.15Å; A122-M126 PolarHBondContact O-N 3.14Å
123	L	58.2	Low	64.7	Low	53 Å²	53	98.7 Å²	98.7	28%	0.277	57%	0.569	S	S	.	*	H	α-helix	trans	-80	-22.2	179.7	-75.1	172.3	0	0	0	113	K119 S125 M126 Y130	K119-L123 HydrophobicContact CD-CD1 3.57Å; K119-L123 HydrophobicContact CD-CG 4.43Å; K119-L123 VanDerWaalsContact CE-CD1 3.49Å; K119-L123 HydrophobicContact CG-CD1 3.73Å; K119-L123 HydrophobicContact CG-CG 4.08Å; K119-L123 WeakPolarHBondContact O-CB 3.3Å; K119-L123 WeakPolarHBondContact O-CG 3.39Å; K119-L123 PolarHBondContact O-N 2.96Å; L123-S125 PolarHBondContact O-N 3.03Å; L123-M126 CarbonylContact O-C 3.6Å; L123-M126 PolarHBondContact O-N 3.15Å; L123-Y130 HydrophobicContact CD2-CD1 4.01Å
124	S	59	Low	63.6	Low	105 Å²	105	98.4 Å²	98.4	73%	0.734	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.4	-21.6	163.7	-69.9	0	0	0	0	111.9	K120	K120-S124 WeakPolarHBondContact O-CB 3.37Å; K120-S124 PolarHBondContact O-N 3.18Å; K120-S124 PolarHBondContact O-OG 3.14Å
125	S	55.8	Low	62.7	Low	103 Å²	103	100.9 Å²	100.9	72%	0.72	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.4	-11.8	176	-170.1	0	0	0	0	113.8	A122 L123	A122-S125 VanDerWaalsContact O-CB 3.3Å; A122-S125 WeakPolarHBondContact O-CB 3.22Å; A122-S125 PolarHBondContact O-N 3.11Å; A122-S125 VanDerWaalsContact O-N 3.15Å; L123-S125 PolarHBondContact O-N 3.03Å
126	M	54	Low	61.8	Low	153 Å²	153	105.7 Å²	105.7	75%	0.754	58%	0.582	S	S	*	*	S	Bend	trans	-147.4	88.2	-174.7	-121.3	-166.1	155.6	0	0	111.8	A122 L123	A122-M126 PolarHBondContact O-N 3.14Å; L123-M126 CarbonylContact O-C 3.6Å; L123-M126 PolarHBondContact O-N 3.15Å
127	G	55.4	Low	61	Low	61 Å²	61	102.5 Å²	102.5	63%	0.629	58%	0.576	S	S	*	*			trans	53.1	117.7	148.4	0	0	0	0	0	119.6	N129	G127-N129 PolarHBondContact O-N 3.29Å
128	S	59.7	Low	59.9	Low	113 Å²	113	102 Å²	102	79%	0.79	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51	5.5	-178	-170.6	0	0	0	0	119.6
129	N	60.5	Low	59.1	Low	152 Å²	152	101.9 Å²	101.9	81%	0.813	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.9	-10.6	-172.6	-69	-19.1	0	0	0	115	G127	G127-N129 PolarHBondContact O-N 3.29Å
130	Y	52.9	Low	58.5	Low	127 Å²	127	108 Å²	108	50%	0.498	59%	0.594	S	S	.	*	S	Bend	trans	-87.4	-7.7	176.4	-166.6	-104.5	0	0	0	113.8	L123 S132 L134	L123-Y130 HydrophobicContact CD2-CD1 4.01Å; Y130-S132 VanDerWaalsContact C-N 3.34Å; Y130-S132 PolarHBondContact O-N 3Å; Y130-L134 HydrophobicContact CE1-CD1 4.05Å
131	S	55.9	Low	57.9	Low	61 Å²	61	108.3 Å²	108.3	43%	0.427	59%	0.591	S	S	.	*	H	α-helix	trans	-67.8	-26.1	-173.2	-169	0	0	0	0	114.4	Q135	S131-Q135 PolarHBondContact O-N 2.98Å
132	S	58.6	Low	57.1	Low	84 Å²	84	105.5 Å²	105.5	59%	0.587	58%	0.576	S	S	*	*	H	α-helix	trans	-78.1	-35	-175.2	65.6	0	0	0	0	113.2	Y130 L134	Y130-S132 VanDerWaalsContact C-N 3.34Å; Y130-S132 PolarHBondContact O-N 3Å; S132-L134 VanDerWaalsContact C-N 3.27Å; S132-L134 PolarHBondContact O-N 3.44Å
133	H	58.6	Low	56.8	Low	131 Å²	131	104.9 Å²	104.9	61%	0.606	58%	0.575	S	S	*	*	H	α-helix	trans	-69.3	-32.7	178.3	-165.2	4	0	0	0	111	A137	H133-A137 PolarHBondContact O-N 2.73Å
134	L	57.4	Low	57.2	Low	46 Å²	46	110.4 Å²	110.4	24%	0.241	60%	0.597	C	S	.	*	H	α-helix	trans	-75.9	-38.4	-178.6	-140.9	86	0	0	0	114.1	K119 Y130 S132 R136 A137 D138	K119-L134 HydrophobicContact CD-CD1 4.38Å; K119-L134 HydrophobicContact CD-CD2 3.13Å; K119-L134 HydrophobicContact CD-CG 4.23Å; K119-L134 VanDerWaalsContact NZ-CD2 3.32Å; Y130-L134 HydrophobicContact CE1-CD1 4.05Å; S132-L134 VanDerWaalsContact C-N 3.27Å; S132-L134 PolarHBondContact O-N 3.44Å; L134-R136 PolarHBondContact O-N 3.21Å; L134-A137 CarbonylContact O-C 3.52Å; L134-A137 PolarHBondContact O-N 2.71Å; L134-D138 VanDerWaalsContact O-CB 3.31Å; L134-D138 WeakPolarHBondContact O-CB 3.31Å; L134-D138 PolarHBondContact O-N 3.2Å
135	Q	59.6	Low	57.7	Low	139 Å²	139	113.2 Å²	113.2	65%	0.65	60%	0.596	S	S	*	*	H	α-helix	trans	-58.4	-32.8	174.8	-78.8	-179.8	-30.5	0	0	112.4	S131 Q139	S131-Q135 PolarHBondContact O-N 2.98Å; Q135-Q139 WeakPolarHBondContact O-CB 3.35Å; Q135-Q139 PolarHBondContact O-N 2.81Å
136	R	59.2	Low	58.8	Low	196 Å²	196	111.8 Å²	111.8	74%	0.74	58%	0.578	S	S	*	*	H	α-helix	trans	-70.8	-34.7	173	-86.6	-175.2	163.1	173.2	-2.8	113.6	L134	L134-R136 PolarHBondContact O-N 3.21Å
137	A	56.5	Low	60.4	Low	48 Å²	48	107.6 Å²	107.6	40%	0.397	56%	0.561	S	S	.	*	H	α-helix	trans	-73.6	-35.6	174.9	0	0	0	0	0	111.3	H133 L134 K140 R141	H133-A137 PolarHBondContact O-N 2.73Å; L134-A137 CarbonylContact O-C 3.52Å; L134-A137 PolarHBondContact O-N 2.71Å; A137-K140 WeakPolarHBondContact O-CB 3.48Å; A137-K140 PolarHBondContact O-N 3.2Å; A137-K140 VanDerWaalsContact O-N 3.13Å; A137-R141 PolarHBondContact O-N 3.34Å
138	D	54.1	Low	62	Low	50 Å²	50	111.1 Å²	111.1	27%	0.267	56%	0.561	S	S	.	*	H	α-helix	trans	-72.2	-33.7	-175.9	-144.3	56.5	0	0	0	112.9	K112 L134 K140 R141 G142	K112-D138 WeakPolarHBondContact CE-OD1 3.39Å; K112-D138 WeakPolarHBondContact CE-OD2 3.36Å; K112-D138 PolarHBondContact NZ-O 2.78Å; K112-D138 IonicContact NZ-OD1 2.78Å; K112-D138 PolarHBondContact NZ-OD1 2.99Å; K112-D138 IonicContact NZ-OD2 2.93Å; K112-D138 PolarHBondContact NZ-OD2 3.22Å; L134-D138 VanDerWaalsContact O-CB 3.31Å; L134-D138 WeakPolarHBondContact O-CB 3.31Å; L134-D138 PolarHBondContact O-N 3.2Å; D138-K140 PolarHBondContact O-N 3.2Å; D138-R141 PolarHBondContact O-N 3.13Å; D138-G142 PolarHBondContact O-N 2.98Å; D138-G142 VanDerWaalsContact O-N 3.16Å
139	Q	58.3	Low	63.5	Low	152 Å²	152	116.1 Å²	116.1	71%	0.71	56%	0.563	S	S	*	*	H	α-helix	trans	-68.6	-17.2	171.9	-153.8	164.5	65	0	0	113.2	Q135	Q135-Q139 WeakPolarHBondContact O-CB 3.35Å; Q135-Q139 PolarHBondContact O-N 2.81Å
140	K	55.6	Low	64.9	Low	189 Å²	189	112 Å²	112	82%	0.822	54%	0.539	S	S	*	.	H	α-helix	trans	-92.7	-20.6	171.5	-72.3	-174.8	176.2	-175.4	0	113.7	A137 D138	A137-K140 WeakPolarHBondContact O-CB 3.48Å; A137-K140 PolarHBondContact O-N 3.2Å; A137-K140 VanDerWaalsContact O-N 3.13Å; D138-K140 PolarHBondContact O-N 3.2Å
141	R	55.1	Low	66.9	Low	161 Å²	161	109.7 Å²	109.7	61%	0.608	53%	0.531	S	S	*	.	H	α-helix	trans	-105	-11.7	-171.6	-152.6	174.7	-179.3	-156.6	-3.6	114.3	E115 A137 D138	E115-R141 IonicContact OE1-NH2 2.93Å; E115-R141 IonicContact OE2-CZ 3.5Å; E115-R141 IonicContact OE2-NH1 2.62Å; E115-R141 PolarHBondContact OE2-NH1 3.18Å; E115-R141 IonicContact OE2-NH2 3.62Å; A137-R141 PolarHBondContact O-N 3.34Å; D138-R141 PolarHBondContact O-N 3.13Å
142	G	51.5	Low	68.7	Low	33 Å²	33	113.6 Å²	113.6	34%	0.34	54%	0.54	S	S	.	.	S	Bend	trans	-99.3	98.7	176.4	0	0	0	0	0	112.6	D138	D138-G142 PolarHBondContact O-N 2.98Å; D138-G142 VanDerWaalsContact O-N 3.16Å
143	G	57.3	Low	70.5	Confident	46 Å²	46	117.3 Å²	117.3	47%	0.474	55%	0.546	S	S	.	.	S	Bend	trans	60.4	125.1	177.5	0	0	0	0	0	112.8	K145	G143-K145 PolarHBondContact O-N 3.16Å
144	K	65.7	Low	72.2	Confident	169 Å²	169	117.5 Å²	117.5	74%	0.735	55%	0.545	S	S	*	.			trans	-65.7	83.3	177	-162	-175.1	-174.9	-149.8	0	108.9	E146 E150	K144-E146 PolarHBondContact O-N 2.64Å; K144-E146 VanDerWaalsContact O-N 3.1Å; K144-E150 IonicContact NZ-OE1 3.91Å; K144-E150 PolarHBondContact NZ-OE1 2.98Å
145	K	71.1	Confident	74	Confident	164 Å²	164	119.6 Å²	119.6	71%	0.713	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-53.8	122.3	175.2	-73.9	-172.4	179.9	-177.1	0	105.9	G143 T147	G143-K145 PolarHBondContact O-N 3.16Å; K145-T147 PolarHBondContact O-N 3.1Å
146	E	78.5	Confident	75.7	Confident	73 Å²	73	117.6 Å²	117.6	34%	0.341	55%	0.549	S	S	.	.	P	Polyproline II helix	trans	-49.3	117.2	-177.7	-169.5	-179.3	-165.2	0	0	107.9	K144 E150 K151 K154	K144-E146 PolarHBondContact O-N 2.64Å; K144-E146 VanDerWaalsContact O-N 3.1Å; E146-E150 HydrophobicContact CG-CB 3.51Å; E146-K151 HydrophobicContact CB-CG 4.09Å; E146-K151 HydrophobicContact CG-CG 3.68Å; E146-K151 VanDerWaalsContact O-CE 3.28Å; E146-K151 WeakPolarHBondContact O-CE 3.48Å; E146-K151 WeakPolarHBondContact OE2-CG 3.46Å; E146-K154 WeakPolarHBondContact OE1-CD 3.3Å
147	T	86.8	Confident	77.4	Confident	64 Å²	64	111.3 Å²	111.3	39%	0.393	54%	0.539	S	S	.	.	P	Polyproline II helix	trans	-63.6	151.8	-177.2	59.7	0	0	0	0	108.8	K145 R149 E150 K151	K145-T147 PolarHBondContact O-N 3.1Å; T147-R149 PolarHBondContact O-N 3.09Å; T147-E150 PolarHBondContact N-OE2 3.16Å; T147-E150 WeakPolarHBondContact O-CA 3.45Å; T147-E150 PolarHBondContact O-N 3.23Å; T147-E150 WeakPolarHBondContact OG1-CB 3.47Å; T147-E150 VanDerWaalsContact OG1-CD 3.31Å; T147-E150 VanDerWaalsContact OG1-CG 3.23Å; T147-E150 WeakPolarHBondContact OG1-CG 3.4Å; T147-E150 PolarHBondContact OG1-N 3.15Å; T147-E150 VanDerWaalsContact OG1-N 3.15Å; T147-E150 PolarHBondContact OG1-OE2 3.37Å; T147-E150 VanDerWaalsContact OG1-OE2 3.09Å; T147-K151 PolarHBondContact O-N 2.87Å
148	E	90.3	Very high	79.2	Confident	135 Å²	135	113.2 Å²	113.2	63%	0.631	55%	0.554	S	S	*	*	H	α-helix	trans	-55.7	-26.3	175.2	-67.5	-56.6	134.7	0	0	112.1	K151 K152	E148-K151 IonicContact OE1-NZ 2.94Å; E148-K151 PolarHBondContact OE1-NZ 3.29Å; E148-K152 VanDerWaalsContact O-CB 3.22Å; E148-K152 WeakPolarHBondContact O-CB 3.23Å; E148-K152 PolarHBondContact O-N 2.83Å
149	R	89.7	Confident	81.1	Confident	219 Å²	219	118.4 Å²	118.4	83%	0.826	57%	0.57	S	S	*	*	H	α-helix	trans	-68.3	-45.9	171.7	-170.9	179.7	-174.5	-173.7	2.4	112.6	T147 K153	T147-R149 PolarHBondContact O-N 3.09Å; R149-K153 WeakPolarHBondContact O-CB 3.44Å; R149-K153 PolarHBondContact O-N 3.47Å
150	E	90.8	Very high	82.8	Confident	66 Å²	66	121.4 Å²	121.4	31%	0.308	58%	0.575	S	S	.	*	H	α-helix	trans	-64.4	-45.7	176.6	-73.9	161.8	163.9	0	0	110.3	K144 E146 T147 K152 K153 K154	K144-E150 IonicContact NZ-OE1 3.91Å; K144-E150 PolarHBondContact NZ-OE1 2.98Å; E146-E150 HydrophobicContact CG-CB 3.51Å; T147-E150 PolarHBondContact N-OE2 3.16Å; T147-E150 WeakPolarHBondContact O-CA 3.45Å; T147-E150 PolarHBondContact O-N 3.23Å; T147-E150 WeakPolarHBondContact OG1-CB 3.47Å; T147-E150 VanDerWaalsContact OG1-CD 3.31Å; T147-E150 VanDerWaalsContact OG1-CG 3.23Å; T147-E150 WeakPolarHBondContact OG1-CG 3.4Å; T147-E150 PolarHBondContact OG1-N 3.15Å; T147-E150 VanDerWaalsContact OG1-N 3.15Å; T147-E150 PolarHBondContact OG1-OE2 3.37Å; T147-E150 VanDerWaalsContact OG1-OE2 3.09Å; E150-K152 PolarHBondContact O-N 3.49Å; E150-K153 PolarHBondContact O-N 3.44Å; E150-K153 VanDerWaalsContact O-N 3.16Å; E150-K154 WeakPolarHBondContact O-CB 3.28Å; E150-K154 PolarHBondContact O-N 3.5Å
151	K	93.7	Very high	84.4	Confident	78 Å²	78	121 Å²	121	34%	0.339	57%	0.573	S	S	.	*	H	α-helix	trans	-57.5	-48.9	174.1	-67.4	-179.5	-170.8	166.3	0	112.1	E146 T147 E148 K153 K154 I155	E146-K151 HydrophobicContact CB-CG 4.09Å; E146-K151 HydrophobicContact CG-CG 3.68Å; E146-K151 VanDerWaalsContact O-CE 3.28Å; E146-K151 WeakPolarHBondContact O-CE 3.48Å; E146-K151 WeakPolarHBondContact OE2-CG 3.46Å; T147-K151 PolarHBondContact O-N 2.87Å; E148-K151 IonicContact OE1-NZ 2.94Å; E148-K151 PolarHBondContact OE1-NZ 3.29Å; K151-K153 VanDerWaalsContact C-N 3.32Å; K151-K153 PolarHBondContact O-N 2.96Å; K151-K154 PolarHBondContact O-N 2.93Å; K151-I155 VanDerWaalsContact O-CG1 3.3Å; K151-I155 WeakPolarHBondContact O-CG1 3.28Å; K151-I155 PolarHBondContact O-N 3.28Å
152	K	95.1	Very high	86.1	Confident	142 Å²	142	118.1 Å²	118.1	62%	0.617	58%	0.584	S	S	*	*	H	α-helix	trans	-57.9	-45.8	176.5	179.4	178.3	177.6	178.9	0	110.9	E148 E150 K154 I155 L156	E148-K152 VanDerWaalsContact O-CB 3.22Å; E148-K152 WeakPolarHBondContact O-CB 3.23Å; E148-K152 PolarHBondContact O-N 2.83Å; E150-K152 PolarHBondContact O-N 3.49Å; K152-K154 VanDerWaalsContact C-N 3.35Å; K152-K154 PolarHBondContact O-N 3.1Å; K152-I155 PolarHBondContact O-N 3.46Å; K152-L156 HydrophobicContact CG-CD1 3.91Å; K152-L156 HydrophobicContact CG-CG 4.39Å; K152-L156 WeakPolarHBondContact O-CB 3.4Å; K152-L156 VanDerWaalsContact O-CG 3.27Å; K152-L156 WeakPolarHBondContact O-CG 3.43Å; K152-L156 PolarHBondContact O-N 3.4Å
153	K	95.6	Very high	88	Confident	163 Å²	163	121.1 Å²	121.1	71%	0.709	59%	0.592	S	S	*	*	H	α-helix	trans	-62.5	-42.9	178.6	-169.9	178.1	-179.2	-177.1	0	111.3	R149 E150 K151 L156 A157	R149-K153 WeakPolarHBondContact O-CB 3.44Å; R149-K153 PolarHBondContact O-N 3.47Å; E150-K153 PolarHBondContact O-N 3.44Å; E150-K153 VanDerWaalsContact O-N 3.16Å; K151-K153 VanDerWaalsContact C-N 3.32Å; K151-K153 PolarHBondContact O-N 2.96Å; K153-L156 PolarHBondContact O-N 3.35Å; K153-A157 VanDerWaalsContact O-CB 3.28Å; K153-A157 WeakPolarHBondContact O-CB 3.27Å; K153-A157 PolarHBondContact O-N 2.9Å
154	K	94.7	Very high	89.6	Confident	134 Å²	134	123.9 Å²	123.9	58%	0.583	60%	0.596	S	S	*	*	H	α-helix	trans	-62.3	-47.3	177.4	-175.4	177.5	177.7	-178.7	0	112	E146 E150 K151 K152 A157 A158	E146-K154 WeakPolarHBondContact OE1-CD 3.3Å; E150-K154 WeakPolarHBondContact O-CB 3.28Å; E150-K154 PolarHBondContact O-N 3.5Å; K151-K154 PolarHBondContact O-N 2.93Å; K152-K154 VanDerWaalsContact C-N 3.35Å; K152-K154 PolarHBondContact O-N 3.1Å; K154-A157 PolarHBondContact O-N 3.28Å; K154-A158 WeakPolarHBondContact O-CB 3.22Å; K154-A158 PolarHBondContact O-N 2.75Å
155	I	94.8	Very high	90.9	Very high	91 Å²	91	118.8 Å²	118.8	47%	0.467	58%	0.576	S	S	.	*	H	α-helix	trans	-63.3	-45.2	178	-66.4	164.8	0	0	0	110.9	K151 K152 A158 R159	K151-I155 VanDerWaalsContact O-CG1 3.3Å; K151-I155 WeakPolarHBondContact O-CG1 3.28Å; K151-I155 PolarHBondContact O-N 3.28Å; K152-I155 PolarHBondContact O-N 3.46Å; I155-A158 PolarHBondContact O-N 2.94Å; I155-R159 WeakPolarHBondContact O-CG 3.42Å; I155-R159 PolarHBondContact O-N 3.34Å
156	L	95.6	Very high	92	Very high	96 Å²	96	118.3 Å²	118.3	50%	0.503	58%	0.581	S	S	.	*	H	α-helix	trans	-65.8	-38.5	178.6	-70.3	176.1	0	0	0	112.1	K152 K153 R159 R160	K152-L156 HydrophobicContact CG-CD1 3.91Å; K152-L156 HydrophobicContact CG-CG 4.39Å; K152-L156 WeakPolarHBondContact O-CB 3.4Å; K152-L156 VanDerWaalsContact O-CG 3.27Å; K152-L156 WeakPolarHBondContact O-CG 3.43Å; K152-L156 PolarHBondContact O-N 3.4Å; K153-L156 PolarHBondContact O-N 3.35Å; L156-R159 PolarHBondContact O-N 3.01Å; L156-R160 WeakPolarHBondContact O-CB 3.4Å; L156-R160 PolarHBondContact O-N 3.41Å
157	A	95	Very high	92.7	Very high	65 Å²	65	121.2 Å²	121.2	54%	0.537	59%	0.594	S	S	.	*	H	α-helix	trans	-63.4	-41.4	174	0	0	0	0	0	111.7	K153 K154 R159 R160	K153-A157 VanDerWaalsContact O-CB 3.28Å; K153-A157 WeakPolarHBondContact O-CB 3.27Å; K153-A157 PolarHBondContact O-N 2.9Å; K154-A157 PolarHBondContact O-N 3.28Å; A157-R159 VanDerWaalsContact C-N 3.33Å; A157-R159 PolarHBondContact O-N 2.78Å; A157-R160 PolarHBondContact O-N 2.89Å
158	A	94.3	Very high	93.1	Very high	87 Å²	87	120.3 Å²	120.3	72%	0.719	59%	0.587	S	S	*	*	H	α-helix	trans	-65.5	-34.2	176.7	0	0	0	0	0	113.1	K154 I155	K154-A158 WeakPolarHBondContact O-CB 3.22Å; K154-A158 PolarHBondContact O-N 2.75Å; I155-A158 PolarHBondContact O-N 2.94Å
159	R	94.3	Very high	93.3	Very high	160 Å²	160	116.9 Å²	116.9	60%	0.604	58%	0.578	S	S	*	*	H	α-helix	trans	-75.4	-27.4	175.8	-70.4	-179.4	-175.9	-161.3	-0.7	113	I155 L156 A157 K161	I155-R159 WeakPolarHBondContact O-CG 3.42Å; I155-R159 PolarHBondContact O-N 3.34Å; L156-R159 PolarHBondContact O-N 3.01Å; A157-R159 VanDerWaalsContact C-N 3.33Å; A157-R159 PolarHBondContact O-N 2.78Å; R159-K161 PolarHBondContact O-N 2.89Å
160	R	93.6	Very high	93.6	Very high	215 Å²	215	112.7 Å²	112.7	81%	0.811	57%	0.568	S	S	*	*			trans	-78.1	103.5	-178	-174.7	179.8	175.1	-155.2	-1.6	110.1	L156 A157	L156-R160 WeakPolarHBondContact O-CB 3.4Å; L156-R160 PolarHBondContact O-N 3.41Å; A157-R160 PolarHBondContact O-N 2.89Å
161	K	89.4	Confident	93.9	Very high	179 Å²	179	114.8 Å²	114.8	78%	0.778	58%	0.581	S	S	*	*			trans	-73.6	134	167.8	-64.9	179.2	-177	174.3	0	109.4	R159 L163	R159-K161 PolarHBondContact O-N 2.89Å; K161-L163 PolarHBondContact O-N 2.88Å
162	A	90.7	Very high	94	Very high	101 Å²	101	116.9 Å²	116.9	84%	0.835	59%	0.59	S	S	*	*			trans	-64.2	134.9	172.1	0	0	0	0	0	109.2
163	L	91.3	Very high	94	Very high	96 Å²	96	113 Å²	113	50%	0.503	58%	0.576	S	S	.	*			trans	-91.3	114.5	178.8	-172.4	64.7	0	0	0	108.1	K161 I165 K176 L180	K161-L163 PolarHBondContact O-N 2.88Å; L163-I165 HydrophobicContact CD1-CG2 3.65Å; L163-I165 HydrophobicContact CD2-CD1 4.1Å; L163-I165 HydrophobicContact CD2-CG2 4.31Å; L163-I165 HydrophobicContact CG-CD1 4.44Å; L163-I165 HydrophobicContact CG-CG1 4.33Å; L163-I165 HydrophobicContact CG-CG2 3.72Å; L163-K176 HydrophobicContact CD1-CG 4.41Å; L163-L180 HydrophobicContact CD1-CD1 4.13Å
164	N	90.4	Very high	94.1	Very high	104 Å²	104	110 Å²	110	56%	0.556	56%	0.563	S	S	*	*			trans	-115.7	101.4	175.1	-176.1	8.9	0	0	0	108.3	H167	N164-H167 PolarHBondContact ND2-CE1 3.44Å; N164-H167 PolarHBondContact OD1-CE1 3.03Å; N164-H167 PolarHBondContact OD1-ND1 3.02Å; N164-H167 VanDerWaalsContact OD1-ND1 3.11Å
165	I	93.8	Very high	94.1	Very high	62 Å²	62	109.9 Å²	109.9	32%	0.318	56%	0.564	S	S	.	*			trans	-123.3	-11.5	-171.6	53.7	168.9	0	0	0	113.6	L163 H167 L168 L173 K176	L163-I165 HydrophobicContact CD1-CG2 3.65Å; L163-I165 HydrophobicContact CD2-CD1 4.1Å; L163-I165 HydrophobicContact CD2-CG2 4.31Å; L163-I165 HydrophobicContact CG-CD1 4.44Å; L163-I165 HydrophobicContact CG-CG1 4.33Å; L163-I165 HydrophobicContact CG-CG2 3.72Å; I165-H167 PolarHBondContact O-N 3.48Å; I165-L168 PolarHBondContact O-N 2.96Å; I165-L168 VanDerWaalsContact O-N 3.14Å; I165-L173 HydrophobicContact CB-CD2 3.94Å; I165-L173 HydrophobicContact CG2-CD2 4.21Å; I165-K176 HydrophobicContact CG2-CG 4.49Å
166	D	93.5	Very high	94.2	Very high	155 Å²	155	108.1 Å²	108.1	83%	0.829	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.5	-15.1	-168.6	-56.5	-21.9	0	0	0	114.3
167	H	92.9	Very high	94.2	Very high	133 Å²	133	108.9 Å²	108.9	62%	0.616	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.5	13.2	-176.4	65.2	-68.4	0	0	0	112.4	N164 I165	N164-H167 PolarHBondContact ND2-CE1 3.44Å; N164-H167 PolarHBondContact OD1-CE1 3.03Å; N164-H167 PolarHBondContact OD1-ND1 3.02Å; N164-H167 VanDerWaalsContact OD1-ND1 3.11Å; I165-H167 PolarHBondContact O-N 3.48Å
168	L	94.9	Very high	94.3	Very high	45 Å²	45	110.6 Å²	110.6	24%	0.236	56%	0.557	C	S	.	*			trans	-90.4	146	179.3	-86.5	63.1	0	0	0	111.4	I165 K172 L173	I165-L168 PolarHBondContact O-N 2.96Å; I165-L168 VanDerWaalsContact O-N 3.14Å; L168-K172 HydrophobicContact CB-CB 4.22Å; L168-K172 HydrophobicContact CD2-CB 4.1Å; L168-K172 HydrophobicContact CG-CB 4.14Å; L168-L173 HydrophobicContact CB-CD2 3.81Å; L168-L173 HydrophobicContact CB-CG 3.95Å; L168-L173 HydrophobicContact CD2-CD2 4.27Å
169	S	96.1	Very high	94.4	Very high	63 Å²	63	110.9 Å²	110.9	44%	0.441	54%	0.543	S	S	.	.			trans	-75.9	162.1	170	58.8	0	0	0	0	111.6	D171 K172 L173	S169-D171 VanDerWaalsContact C-N 3.32Å; S169-D171 PolarHBondContact O-N 3.36Å; S169-K172 PolarHBondContact O-N 3.2Å; S169-K172 VanDerWaalsContact O-N 3.1Å; S169-L173 WeakPolarHBondContact O-CG 3.28Å; S169-L173 PolarHBondContact O-N 2.93Å
170	E	95.5	Very high	94.5	Very high	131 Å²	131	106.9 Å²	106.9	61%	0.612	53%	0.533	S	S	*	.	H	α-helix	trans	-54.2	-44.5	-177.3	-166.9	-172.4	147.7	0	0	113.1	K172 L173 K174	E170-K172 PolarHBondContact O-N 2.96Å; E170-L173 WeakPolarHBondContact O-CB 3.3Å; E170-L173 PolarHBondContact O-N 2.69Å; E170-K174 WeakPolarHBondContact O-CG 3.46Å; E170-K174 PolarHBondContact O-N 3.21Å; E170-K174 VanDerWaalsContact OE1-CE 3.24Å; E170-K174 WeakPolarHBondContact OE1-CE 3.42Å; E170-K174 IonicContact OE1-NZ 3.76Å; E170-K174 PolarHBondContact OE1-NZ 3.29Å
171	D	95.9	Very high	94.7	Very high	111 Å²	111	99.9 Å²	99.9	59%	0.594	52%	0.517	S	S	*	.	H	α-helix	trans	-64	-40.6	179.4	-61.8	-32.5	0	0	0	112.1	S169 L173 K174 E175	S169-D171 VanDerWaalsContact C-N 3.32Å; S169-D171 PolarHBondContact O-N 3.36Å; D171-L173 VanDerWaalsContact C-N 3.31Å; D171-L173 PolarHBondContact O-N 3.44Å; D171-K174 WeakPolarHBondContact O-CB 3.42Å; D171-K174 PolarHBondContact O-N 2.99Å; D171-E175 PolarHBondContact O-N 2.9Å; D171-E175 VanDerWaalsContact O-N 3.08Å
172	K	95.7	Very high	95.1	Very high	121 Å²	121	96.2 Å²	96.2	53%	0.526	51%	0.506	S	S	.	.	H	α-helix	trans	-68.3	-31.7	175.4	-70.4	-177.3	178.3	178.5	0	112.2	L168 S169 E170 K176	L168-K172 HydrophobicContact CB-CB 4.22Å; L168-K172 HydrophobicContact CD2-CB 4.1Å; L168-K172 HydrophobicContact CG-CB 4.14Å; S169-K172 PolarHBondContact O-N 3.2Å; S169-K172 VanDerWaalsContact O-N 3.1Å; E170-K172 PolarHBondContact O-N 2.96Å; K172-K176 WeakPolarHBondContact O-CB 3.5Å; K172-K176 PolarHBondContact O-N 3Å
173	L	96.1	Very high	95.4	Very high	60 Å²	60	97.3 Å²	97.3	31%	0.314	49%	0.489	S	S	.	.	H	α-helix	trans	-66.7	-40.3	173.4	-69.8	172.4	0	0	0	111.1	I165 L168 S169 E170 D171 K176 I177	I165-L173 HydrophobicContact CB-CD2 3.94Å; I165-L173 HydrophobicContact CG2-CD2 4.21Å; L168-L173 HydrophobicContact CB-CD2 3.81Å; L168-L173 HydrophobicContact CB-CG 3.95Å; L168-L173 HydrophobicContact CD2-CD2 4.27Å; S169-L173 WeakPolarHBondContact O-CG 3.28Å; S169-L173 PolarHBondContact O-N 2.93Å; E170-L173 WeakPolarHBondContact O-CB 3.3Å; E170-L173 PolarHBondContact O-N 2.69Å; D171-L173 VanDerWaalsContact C-N 3.31Å; D171-L173 PolarHBondContact O-N 3.44Å; L173-K176 PolarHBondContact O-N 3.45Å; L173-I177 VanDerWaalsContact O-CG1 3.28Å; L173-I177 WeakPolarHBondContact O-CG1 3.24Å; L173-I177 PolarHBondContact O-N 3.44Å
174	K	96.8	Very high	95.6	Very high	101 Å²	101	98.2 Å²	98.2	44%	0.439	49%	0.492	S	S	.	.	H	α-helix	trans	-61.6	-44.9	174.5	-69.9	170.6	-175.2	158.5	0	111.8	E170 D171 K176 I177 N178	E170-K174 WeakPolarHBondContact O-CG 3.46Å; E170-K174 PolarHBondContact O-N 3.21Å; E170-K174 VanDerWaalsContact OE1-CE 3.24Å; E170-K174 WeakPolarHBondContact OE1-CE 3.42Å; E170-K174 IonicContact OE1-NZ 3.76Å; E170-K174 PolarHBondContact OE1-NZ 3.29Å; D171-K174 WeakPolarHBondContact O-CB 3.42Å; D171-K174 PolarHBondContact O-N 2.99Å; K174-K176 VanDerWaalsContact C-N 3.32Å; K174-K176 PolarHBondContact O-N 3.17Å; K174-I177 PolarHBondContact O-N 2.73Å; K174-N178 PolarHBondContact O-N 3.32Å; K174-N178 VanDerWaalsContact O-N 3.13Å; K174-N178 PolarHBondContact O-ND2 2.96Å
175	E	96.4	Very high	96	Very high	132 Å²	132	102 Å²	102	62%	0.617	50%	0.499	S	S	*	.	H	α-helix	trans	-58.6	-44.2	173.1	-70.3	176.3	178	0	0	111.7	D171 I177 N178 E179	D171-E175 PolarHBondContact O-N 2.9Å; D171-E175 VanDerWaalsContact O-N 3.08Å; E175-I177 VanDerWaalsContact C-N 3.34Å; E175-I177 PolarHBondContact O-N 3.08Å; E175-N178 PolarHBondContact O-N 3.24Å; E175-E179 PolarHBondContact O-N 2.97Å
176	K	95.6	Very high	96.1	Very high	54 Å²	54	103.5 Å²	103.5	24%	0.235	50%	0.504	C	S	.	.	H	α-helix	trans	-65.6	-35.3	179.4	-162	71.6	-163.3	165.3	0	112.9	L163 I165 K172 L173 K174 E179 L180	L163-K176 HydrophobicContact CD1-CG 4.41Å; I165-K176 HydrophobicContact CG2-CG 4.49Å; K172-K176 WeakPolarHBondContact O-CB 3.5Å; K172-K176 PolarHBondContact O-N 3Å; L173-K176 PolarHBondContact O-N 3.45Å; K174-K176 VanDerWaalsContact C-N 3.32Å; K174-K176 PolarHBondContact O-N 3.17Å; K176-E179 IonicContact NZ-OE1 2.69Å; K176-E179 PolarHBondContact NZ-OE1 3.2Å; K176-E179 IonicContact NZ-OE2 2.73Å; K176-E179 PolarHBondContact NZ-OE2 3.24Å; K176-E179 PolarHBondContact O-N 3.49Å; K176-L180 HydrophobicContact CG-CD1 4.41Å; K176-L180 WeakPolarHBondContact O-CB 3.44Å; K176-L180 VanDerWaalsContact O-CG 3.3Å; K176-L180 WeakPolarHBondContact O-CG 3.42Å; K176-L180 PolarHBondContact O-N 3.43Å
177	I	96.4	Very high	96.3	Very high	111 Å²	111	99.4 Å²	99.4	57%	0.569	48%	0.482	S	S	*	.	H	α-helix	trans	-62	-47.3	173.9	-72.3	163	0	0	0	110.1	L173 K174 E175 L180 S181	L173-I177 VanDerWaalsContact O-CG1 3.28Å; L173-I177 WeakPolarHBondContact O-CG1 3.24Å; L173-I177 PolarHBondContact O-N 3.44Å; K174-I177 PolarHBondContact O-N 2.73Å; E175-I177 VanDerWaalsContact C-N 3.34Å; E175-I177 PolarHBondContact O-N 3.08Å; I177-L180 PolarHBondContact O-N 2.88Å; I177-S181 VanDerWaalsContact O-CB 3.32Å; I177-S181 WeakPolarHBondContact O-CB 3.47Å; I177-S181 PolarHBondContact O-N 3.49Å
178	N	97.6	Very high	96.5	Very high	101 Å²	101	98.7 Å²	98.7	54%	0.54	48%	0.479	S	S	.	.	H	α-helix	trans	-61.9	-45.8	178.3	-68.5	-24.9	0	0	0	111.2	K174 E175 L180 S181 D182	K174-N178 PolarHBondContact O-N 3.32Å; K174-N178 VanDerWaalsContact O-N 3.13Å; K174-N178 PolarHBondContact O-ND2 2.96Å; E175-N178 PolarHBondContact O-N 3.24Å; N178-L180 VanDerWaalsContact C-N 3.34Å; N178-L180 PolarHBondContact O-N 3.13Å; N178-S181 WeakPolarHBondContact O-CB 3.31Å; N178-S181 PolarHBondContact O-N 3Å; N178-D182 PolarHBondContact O-N 3.37Å
179	E	95.8	Very high	96.7	Very high	93 Å²	93	99.7 Å²	99.7	44%	0.435	49%	0.49	S	S	.	.	H	α-helix	trans	-57.8	-44.6	176.4	-172.8	-165.4	148.8	0	0	112.2	E175 K176 W183	E175-E179 PolarHBondContact O-N 2.97Å; K176-E179 IonicContact NZ-OE1 2.69Å; K176-E179 PolarHBondContact NZ-OE1 3.2Å; K176-E179 IonicContact NZ-OE2 2.73Å; K176-E179 PolarHBondContact NZ-OE2 3.24Å; K176-E179 PolarHBondContact O-N 3.49Å; E179-W183 VanDerWaalsContact O-CB 3.31Å; E179-W183 WeakPolarHBondContact O-CB 3.32Å; E179-W183 PolarHBondContact O-N 2.88Å
180	L	95.9	Very high	96.8	Very high	76 Å²	76	100.2 Å²	100.2	40%	0.398	49%	0.485	S	S	.	.	H	α-helix	trans	-69.8	-35.7	179	-71.7	174.7	0	0	0	112.4	L163 K176 I177 N178 W183 M184	L163-L180 HydrophobicContact CD1-CD1 4.13Å; K176-L180 HydrophobicContact CG-CD1 4.41Å; K176-L180 WeakPolarHBondContact O-CB 3.44Å; K176-L180 VanDerWaalsContact O-CG 3.3Å; K176-L180 WeakPolarHBondContact O-CG 3.42Å; K176-L180 PolarHBondContact O-N 3.43Å; I177-L180 PolarHBondContact O-N 2.88Å; N178-L180 VanDerWaalsContact C-N 3.34Å; N178-L180 PolarHBondContact O-N 3.13Å; L180-W183 PolarHBondContact O-N 2.99Å; L180-M184 WeakPolarHBondContact O-CB 3.46Å; L180-M184 PolarHBondContact O-N 3.43Å
181	S	97.7	Very high	96.9	Very high	68 Å²	68	100.4 Å²	100.4	48%	0.476	48%	0.484	S	S	.	.	H	α-helix	trans	-63.7	-48	174.7	179.8	0	0	0	0	111	I177 N178 W183 M184 R185	I177-S181 VanDerWaalsContact O-CB 3.32Å; I177-S181 WeakPolarHBondContact O-CB 3.47Å; I177-S181 PolarHBondContact O-N 3.49Å; N178-S181 WeakPolarHBondContact O-CB 3.31Å; N178-S181 PolarHBondContact O-N 3Å; S181-W183 VanDerWaalsContact C-N 3.34Å; S181-W183 PolarHBondContact O-N 3.36Å; S181-M184 WeakPolarHBondContact O-CB 3.3Å; S181-M184 PolarHBondContact O-N 2.98Å; S181-R185 WeakPolarHBondContact O-CB 3.43Å; S181-R185 PolarHBondContact O-N 3.18Å
182	D	97.8	Very high	97	Very high	102 Å²	102	100.8 Å²	100.8	55%	0.545	48%	0.481	S	S	.	.	H	α-helix	trans	-63	-41.8	176.9	-71.5	-23.1	0	0	0	111.5	N178 M184 R185 Q186	N178-D182 PolarHBondContact O-N 3.37Å; D182-M184 PolarHBondContact O-N 3.12Å; D182-R185 PolarHBondContact O-N 2.95Å; D182-Q186 PolarHBondContact O-N 3.46Å
183	W	96.4	Very high	97.1	Very high	124 Å²	124	99 Å²	99	47%	0.47	48%	0.476	S	S	.	.	H	α-helix	trans	-61.2	-42.4	174.9	-177.3	-110.2	0	0	0	112.4	E179 L180 S181 Q186 L187	E179-W183 VanDerWaalsContact O-CB 3.31Å; E179-W183 WeakPolarHBondContact O-CB 3.32Å; E179-W183 PolarHBondContact O-N 2.88Å; L180-W183 PolarHBondContact O-N 2.99Å; S181-W183 VanDerWaalsContact C-N 3.34Å; S181-W183 PolarHBondContact O-N 3.36Å; W183-Q186 PolarHBondContact O-N 3.41Å; W183-L187 HydrophobicContact CZ2-CD2 4.24Å; W183-L187 WeakPolarHBondContact O-CG 3.45Å; W183-L187 PolarHBondContact O-N 3.46Å; W183-L187 VanDerWaalsContact O-N 3.12Å
184	M	96.6	Very high	97.2	Very high	116 Å²	116	101.1 Å²	101.1	57%	0.571	49%	0.485	S	S	*	.	H	α-helix	trans	-62	-47	175.7	-173	177.6	-60.5	0	0	111	L180 S181 D182 Q186 L187 E188	L180-M184 WeakPolarHBondContact O-CB 3.46Å; L180-M184 PolarHBondContact O-N 3.43Å; S181-M184 WeakPolarHBondContact O-CB 3.3Å; S181-M184 PolarHBondContact O-N 2.98Å; D182-M184 PolarHBondContact O-N 3.12Å; M184-Q186 VanDerWaalsContact C-N 3.33Å; M184-Q186 PolarHBondContact O-N 2.9Å; M184-L187 PolarHBondContact O-N 3.23Å; M184-E188 WeakPolarHBondContact O-CG 3.38Å; M184-E188 PolarHBondContact O-N 3.46Å
185	R	97.8	Very high	97.3	Very high	183 Å²	183	100.8 Å²	100.8	69%	0.691	49%	0.486	S	S	*	.	H	α-helix	trans	-62	-39.5	179.7	-165.8	172.2	-178.6	-122.7	-1	112.3	S181 D182 E188 S189	S181-R185 WeakPolarHBondContact O-CB 3.43Å; S181-R185 PolarHBondContact O-N 3.18Å; D182-R185 PolarHBondContact O-N 2.95Å; R185-E188 PolarHBondContact O-N 3.5Å; R185-S189 PolarHBondContact O-N 2.94Å
186	Q	97.5	Very high	97.4	Very high	93 Å²	93	97.7 Å²	97.7	44%	0.435	47%	0.471	S	S	.	.	H	α-helix	trans	-60.8	-48.8	173.3	-178.5	-179.3	-11.9	0	0	111.5	D182 W183 M184 E188 S189 E190	D182-Q186 PolarHBondContact O-N 3.46Å; W183-Q186 PolarHBondContact O-N 3.41Å; M184-Q186 VanDerWaalsContact C-N 3.33Å; M184-Q186 PolarHBondContact O-N 2.9Å; Q186-E188 VanDerWaalsContact C-N 3.29Å; Q186-E188 PolarHBondContact O-N 3.29Å; Q186-S189 WeakPolarHBondContact O-CB 3.5Å; Q186-S189 PolarHBondContact O-N 3.42Å; Q186-E190 PolarHBondContact NE2-OE1 3.49Å; Q186-E190 WeakPolarHBondContact O-CG 3.42Å; Q186-E190 PolarHBondContact O-N 3.07Å
187	L	97.1	Very high	97.5	Very high	69 Å²	69	101.1 Å²	101.1	36%	0.361	48%	0.483	S	S	.	.	H	α-helix	trans	-61.8	-36.9	179.7	-70.5	175.8	0	0	0	112.5	W183 M184 K191	W183-L187 HydrophobicContact CZ2-CD2 4.24Å; W183-L187 WeakPolarHBondContact O-CG 3.45Å; W183-L187 PolarHBondContact O-N 3.46Å; W183-L187 VanDerWaalsContact O-N 3.12Å; M184-L187 PolarHBondContact O-N 3.23Å; L187-K191 VanDerWaalsContact O-CB 3.3Å; L187-K191 WeakPolarHBondContact O-CB 3.49Å; L187-K191 PolarHBondContact O-N 2.93Å
188	E	97.8	Very high	97.6	Very high	119 Å²	119	99.9 Å²	99.9	56%	0.556	48%	0.477	S	S	*	.	H	α-helix	trans	-65.6	-43.4	174.7	-72.5	-179.4	161.1	0	0	112.2	M184 R185 Q186 K191 F192	M184-E188 WeakPolarHBondContact O-CG 3.38Å; M184-E188 PolarHBondContact O-N 3.46Å; R185-E188 PolarHBondContact O-N 3.5Å; Q186-E188 VanDerWaalsContact C-N 3.29Å; Q186-E188 PolarHBondContact O-N 3.29Å; E188-K191 PolarHBondContact O-N 3.12Å; E188-F192 PolarHBondContact O-N 3.35Å
189	S	98	Very high	97.6	Very high	66 Å²	66	100.7 Å²	100.7	46%	0.462	48%	0.476	S	S	.	.	H	α-helix	trans	-60.3	-49.1	174.8	-167.8	0	0	0	0	111.5	R185 Q186 K191 F192 D193	R185-S189 PolarHBondContact O-N 2.94Å; Q186-S189 WeakPolarHBondContact O-CB 3.5Å; Q186-S189 PolarHBondContact O-N 3.42Å; S189-K191 VanDerWaalsContact C-N 3.3Å; S189-K191 PolarHBondContact O-N 2.95Å; S189-F192 WeakPolarHBondContact O-CB 3.27Å; S189-F192 PolarHBondContact O-N 3.43Å; S189-F192 VanDerWaalsContact O-N 3.12Å; S189-D193 PolarHBondContact O-N 3.17Å
190	E	97.9	Very high	97.7	Very high	74 Å²	74	101.7 Å²	101.7	35%	0.346	48%	0.483	S	S	.	.	H	α-helix	trans	-60.8	-40.7	178.4	-71.4	177.1	-165.8	0	0	111.6	Q186 F192 D193 H194	Q186-E190 PolarHBondContact NE2-OE1 3.49Å; Q186-E190 WeakPolarHBondContact O-CG 3.42Å; Q186-E190 PolarHBondContact O-N 3.07Å; E190-F192 VanDerWaalsContact C-N 3.34Å; E190-F192 PolarHBondContact O-N 2.95Å; E190-D193 PolarHBondContact O-N 2.95Å; E190-H194 WeakPolarHBondContact O-CB 3.47Å; E190-H194 PolarHBondContact O-CD2 3.35Å; E190-H194 PolarHBondContact O-N 3.01Å
191	K	98.1	Very high	97.8	Very high	135 Å²	135	102.5 Å²	102.5	59%	0.587	49%	0.485	S	S	*	.	H	α-helix	trans	-61.2	-43.6	175.4	178.2	-172	169.5	-166.8	0	111.1	L187 E188 S189 H194 M195	L187-K191 VanDerWaalsContact O-CB 3.3Å; L187-K191 WeakPolarHBondContact O-CB 3.49Å; L187-K191 PolarHBondContact O-N 2.93Å; E188-K191 PolarHBondContact O-N 3.12Å; S189-K191 VanDerWaalsContact C-N 3.3Å; S189-K191 PolarHBondContact O-N 2.95Å; K191-H194 PolarHBondContact O-N 3.19Å; K191-M195 HydrophobicContact CG-SD 4.1Å; K191-M195 VanDerWaalsContact O-CG 3.27Å; K191-M195 WeakPolarHBondContact O-CG 3.47Å; K191-M195 PolarHBondContact O-N 3.36Å
192	F	98.3	Very high	97.8	Very high	119 Å²	119	105.5 Å²	105.5	52%	0.522	49%	0.49	S	S	.	.	H	α-helix	trans	-60.5	-50.2	177.6	178.5	-94.2	0	0	0	111.3	E188 S189 E190 H194 M195 E196	E188-F192 PolarHBondContact O-N 3.35Å; S189-F192 WeakPolarHBondContact O-CB 3.27Å; S189-F192 PolarHBondContact O-N 3.43Å; S189-F192 VanDerWaalsContact O-N 3.12Å; E190-F192 VanDerWaalsContact C-N 3.34Å; E190-F192 PolarHBondContact O-N 2.95Å; F192-H194 VanDerWaalsContact C-N 3.29Å; F192-H194 PolarHBondContact O-N 3.03Å; F192-M195 WeakPolarHBondContact O-CA 3.46Å; F192-M195 WeakPolarHBondContact O-CB 3.27Å; F192-M195 PolarHBondContact O-N 3.3Å; F192-E196 HydrophobicContact CD1-CG 4.24Å; F192-E196 HydrophobicContact CE1-CG 3.72Å; F192-E196 HydrophobicContact CE2-CG 4.19Å; F192-E196 HydrophobicContact CZ-CG 3.69Å; F192-E196 PolarHBondContact O-N 2.97Å
193	D	98.3	Very high	97.8	Very high	82 Å²	82	108 Å²	108	44%	0.439	49%	0.493	S	S	.	.	H	α-helix	trans	-59.5	-40.6	178.7	-68.4	-22	0	0	0	112.1	S189 E190 R197	S189-D193 PolarHBondContact O-N 3.17Å; E190-D193 PolarHBondContact O-N 2.95Å; D193-R197 VanDerWaalsContact O-CB 3.27Å; D193-R197 WeakPolarHBondContact O-CB 3.3Å; D193-R197 PolarHBondContact O-N 3.32Å
194	H	98.3	Very high	97.9	Very high	106 Å²	106	106.6 Å²	106.6	49%	0.491	49%	0.491	S	S	.	.	H	α-helix	trans	-64.4	-38.3	174.2	-75	-45.5	0	0	0	112.8	E190 K191 F192 R197 L198	E190-H194 WeakPolarHBondContact O-CB 3.47Å; E190-H194 PolarHBondContact O-CD2 3.35Å; E190-H194 PolarHBondContact O-N 3.01Å; K191-H194 PolarHBondContact O-N 3.19Å; F192-H194 VanDerWaalsContact C-N 3.29Å; F192-H194 PolarHBondContact O-N 3.03Å; H194-R197 PolarHBondContact CE1-NH1 3Å; H194-R197 PolarHBondContact ND1-NH1 3.42Å; H194-R197 VanDerWaalsContact ND1-NH1 3.17Å; H194-L198 WeakPolarHBondContact O-CB 3.48Å; H194-L198 PolarHBondContact O-N 3.15Å
195	M	98.1	Very high	97.9	Very high	94 Å²	94	104.1 Å²	104.1	46%	0.463	48%	0.483	S	S	.	.	H	α-helix	trans	-66.3	-45.3	176.8	-75.6	176.7	58.4	0	0	111.7	K191 F192 L198 K199	K191-M195 HydrophobicContact CG-SD 4.1Å; K191-M195 VanDerWaalsContact O-CG 3.27Å; K191-M195 WeakPolarHBondContact O-CG 3.47Å; K191-M195 PolarHBondContact O-N 3.36Å; F192-M195 WeakPolarHBondContact O-CA 3.46Å; F192-M195 WeakPolarHBondContact O-CB 3.27Å; F192-M195 PolarHBondContact O-N 3.3Å; M195-L198 PolarHBondContact O-N 3.04Å; M195-K199 WeakPolarHBondContact O-CG 3.31Å; M195-K199 PolarHBondContact O-N 3Å
196	E	98.1	Very high	97.9	Very high	66 Å²	66	98.8 Å²	98.8	31%	0.308	47%	0.47	S	S	.	.	H	α-helix	trans	-65.1	-43.5	177.1	-68	-49.7	117.4	0	0	111.6	F192 L198 K199 L200	F192-E196 HydrophobicContact CD1-CG 4.24Å; F192-E196 HydrophobicContact CE1-CG 3.72Å; F192-E196 HydrophobicContact CE2-CG 4.19Å; F192-E196 HydrophobicContact CZ-CG 3.69Å; F192-E196 PolarHBondContact O-N 2.97Å; E196-L198 VanDerWaalsContact C-N 3.3Å; E196-L198 PolarHBondContact O-N 2.93Å; E196-K199 WeakPolarHBondContact O-CB 3.45Å; E196-K199 PolarHBondContact O-N 3.37Å; E196-K199 VanDerWaalsContact O-N 3.15Å; E196-K199 WeakPolarHBondContact OE1-CE 3.27Å; E196-K199 IonicContact OE1-NZ 2.67Å; E196-K199 PolarHBondContact OE1-NZ 2.91Å; E196-K199 IonicContact OE2-NZ 3.74Å; E196-L200 PolarHBondContact O-N 3.13Å; E196-L200 VanDerWaalsContact O-N 3.08Å
197	R	98.2	Very high	97.9	Very high	127 Å²	127	101 Å²	101	48%	0.479	48%	0.475	S	S	.	.	H	α-helix	trans	-57.6	-43.6	173.5	-171	-176.6	-56.9	141.8	9.9	111.8	D193 H194 K199 L200 Q201	D193-R197 VanDerWaalsContact O-CB 3.27Å; D193-R197 WeakPolarHBondContact O-CB 3.3Å; D193-R197 PolarHBondContact O-N 3.32Å; H194-R197 PolarHBondContact CE1-NH1 3Å; H194-R197 PolarHBondContact ND1-NH1 3.42Å; H194-R197 VanDerWaalsContact ND1-NH1 3.17Å; R197-K199 VanDerWaalsContact C-N 3.34Å; R197-K199 PolarHBondContact O-N 3.47Å; R197-L200 PolarHBondContact O-N 2.94Å; R197-Q201 HydrophobicContact CG-CG 4.47Å; R197-Q201 WeakPolarHBondContact O-CB 3.48Å; R197-Q201 VanDerWaalsContact O-CG 3.31Å; R197-Q201 WeakPolarHBondContact O-CG 3.35Å; R197-Q201 PolarHBondContact O-N 3.31Å
198	L	98	Very high	97.9	Very high	85 Å²	85	102.3 Å²	102.3	45%	0.445	48%	0.482	S	S	.	.	H	α-helix	trans	-64.4	-37.8	178.6	-179.6	63.3	0	0	0	112	H194 M195 E196 Q201 K202	H194-L198 WeakPolarHBondContact O-CB 3.48Å; H194-L198 PolarHBondContact O-N 3.15Å; M195-L198 PolarHBondContact O-N 3.04Å; E196-L198 VanDerWaalsContact C-N 3.3Å; E196-L198 PolarHBondContact O-N 2.93Å; L198-Q201 PolarHBondContact O-N 2.92Å; L198-K202 HydrophobicContact CD1-CG 4.5Å; L198-K202 HydrophobicContact CG-CD 4.46Å; L198-K202 WeakPolarHBondContact O-CB 3.33Å; L198-K202 VanDerWaalsContact O-CG 3.3Å; L198-K202 WeakPolarHBondContact O-CG 3.25Å; L198-K202 PolarHBondContact O-N 2.8Å
199	K	97.9	Very high	97.9	Very high	117 Å²	117	104.6 Å²	104.6	51%	0.509	49%	0.485	S	S	.	.	H	α-helix	trans	-61	-47.4	174.8	-71.7	173.7	-176	170.5	0	111	M195 E196 R197 K202 Y203	M195-K199 WeakPolarHBondContact O-CG 3.31Å; M195-K199 PolarHBondContact O-N 3Å; E196-K199 WeakPolarHBondContact O-CB 3.45Å; E196-K199 PolarHBondContact O-N 3.37Å; E196-K199 VanDerWaalsContact O-N 3.15Å; E196-K199 WeakPolarHBondContact OE1-CE 3.27Å; E196-K199 IonicContact OE1-NZ 2.67Å; E196-K199 PolarHBondContact OE1-NZ 2.91Å; E196-K199 IonicContact OE2-NZ 3.74Å; R197-K199 VanDerWaalsContact C-N 3.34Å; R197-K199 PolarHBondContact O-N 3.47Å; K199-K202 PolarHBondContact O-N 3.22Å; K199-Y203 PolarHBondContact O-N 3.45Å; K199-Y203 VanDerWaalsContact O-N 3.15Å
200	L	97.8	Very high	97.7	Very high	114 Å²	114	107.5 Å²	107.5	60%	0.597	49%	0.489	S	S	*	.	H	α-helix	trans	-61.4	-47.9	177	-69.2	172.4	0	0	0	111.6	E196 R197 K202 Y203 E204	E196-L200 PolarHBondContact O-N 3.13Å; E196-L200 VanDerWaalsContact O-N 3.08Å; R197-L200 PolarHBondContact O-N 2.94Å; L200-K202 VanDerWaalsContact C-N 3.3Å; L200-K202 PolarHBondContact O-N 2.89Å; L200-Y203 WeakPolarHBondContact O-CB 3.4Å; L200-Y203 PolarHBondContact O-N 3.12Å; L200-E204 WeakPolarHBondContact O-CG 3.44Å; L200-E204 PolarHBondContact O-N 3.36Å
201	Q	98.1	Very high	97.6	Very high	94 Å²	94	111.9 Å²	111.9	44%	0.439	50%	0.503	S	S	.	.	H	α-helix	trans	-59.7	-39.2	178.1	-74.5	177.4	-23.2	0	0	112.5	R197 L198 Y203 E204 V205	R197-Q201 HydrophobicContact CG-CG 4.47Å; R197-Q201 WeakPolarHBondContact O-CB 3.48Å; R197-Q201 VanDerWaalsContact O-CG 3.31Å; R197-Q201 WeakPolarHBondContact O-CG 3.35Å; R197-Q201 PolarHBondContact O-N 3.31Å; L198-Q201 PolarHBondContact O-N 2.92Å; Q201-Y203 VanDerWaalsContact C-N 3.34Å; Q201-Y203 PolarHBondContact O-N 3.44Å; Q201-E204 PolarHBondContact O-N 2.87Å; Q201-V205 WeakPolarHBondContact O-CB 3.44Å; Q201-V205 VanDerWaalsContact O-CG2 3.27Å; Q201-V205 WeakPolarHBondContact O-CG2 3.4Å; Q201-V205 PolarHBondContact O-N 3.32Å
202	K	98.1	Very high	97.5	Very high	131 Å²	131	110.2 Å²	110.2	57%	0.57	50%	0.503	S	S	*	.	H	α-helix	trans	-61.6	-42.4	174.7	-77.9	175.2	177.5	-179	0	111.9	L198 K199 L200 T206	L198-K202 HydrophobicContact CD1-CG 4.5Å; L198-K202 HydrophobicContact CG-CD 4.46Å; L198-K202 WeakPolarHBondContact O-CB 3.33Å; L198-K202 VanDerWaalsContact O-CG 3.3Å; L198-K202 WeakPolarHBondContact O-CG 3.25Å; L198-K202 PolarHBondContact O-N 2.8Å; K199-K202 PolarHBondContact O-N 3.22Å; L200-K202 VanDerWaalsContact C-N 3.3Å; L200-K202 PolarHBondContact O-N 2.89Å; K202-T206 PolarHBondContact O-N 2.84Å; K202-T206 VanDerWaalsContact O-N 3.12Å; K202-T206 PolarHBondContact O-OG1 2.67Å
203	Y	97.8	Very high	97.2	Very high	155 Å²	155	109.9 Å²	109.9	61%	0.608	50%	0.504	S	S	*	.	H	α-helix	trans	-64	-47.4	175.4	175.3	-97.1	0	0	0	111.3	K199 L200 Q201 V205 T206 R207	K199-Y203 PolarHBondContact O-N 3.45Å; K199-Y203 VanDerWaalsContact O-N 3.15Å; L200-Y203 WeakPolarHBondContact O-CB 3.4Å; L200-Y203 PolarHBondContact O-N 3.12Å; Q201-Y203 VanDerWaalsContact C-N 3.34Å; Q201-Y203 PolarHBondContact O-N 3.44Å; Y203-V205 PolarHBondContact O-N 3.48Å; Y203-T206 WeakPolarHBondContact O-CB 3.44Å; Y203-T206 PolarHBondContact O-N 3.15Å; Y203-T206 VanDerWaalsContact O-N 3.13Å; Y203-R207 PolarHBondContact O-N 2.81Å
204	E	97.7	Very high	96.8	Very high	93 Å²	93	111.3 Å²	111.3	44%	0.435	51%	0.508	S	S	.	.	H	α-helix	trans	-59.5	-46.1	178.5	-72.7	179	166.5	0	0	112.4	L200 Q201 T206 R207 L208	L200-E204 WeakPolarHBondContact O-CG 3.44Å; L200-E204 PolarHBondContact O-N 3.36Å; Q201-E204 PolarHBondContact O-N 2.87Å; E204-T206 VanDerWaalsContact C-N 3.27Å; E204-T206 PolarHBondContact O-N 3.08Å; E204-R207 PolarHBondContact O-N 3.34Å; E204-L208 WeakPolarHBondContact O-CB 3.45Å; E204-L208 VanDerWaalsContact O-CG 3.25Å; E204-L208 WeakPolarHBondContact O-CG 3.44Å; E204-L208 PolarHBondContact O-N 2.98Å
205	V	98	Very high	96.3	Very high	65 Å²	65	111.6 Å²	111.6	39%	0.394	51%	0.512	S	S	.	.	H	α-helix	trans	-58.3	-42.8	175.4	167.9	0	0	0	0	110.7	Q201 Y203 L208 R209	Q201-V205 WeakPolarHBondContact O-CB 3.44Å; Q201-V205 VanDerWaalsContact O-CG2 3.27Å; Q201-V205 WeakPolarHBondContact O-CG2 3.4Å; Q201-V205 PolarHBondContact O-N 3.32Å; Y203-V205 PolarHBondContact O-N 3.48Å; V205-L208 PolarHBondContact O-N 3.49Å; V205-R209 HydrophobicContact CG1-CG 4.48Å; V205-R209 WeakPolarHBondContact O-CB 3.29Å; V205-R209 VanDerWaalsContact O-CG 3.25Å; V205-R209 WeakPolarHBondContact O-CG 3.27Å; V205-R209 PolarHBondContact O-N 3.07Å
206	T	97.4	Very high	95.7	Very high	70 Å²	70	110.1 Å²	110.1	43%	0.429	51%	0.511	S	S	.	.	H	α-helix	trans	-64	-45.1	178	-56.8	0	0	0	0	111.3	K202 Y203 E204 R209 K210	K202-T206 PolarHBondContact O-N 2.84Å; K202-T206 VanDerWaalsContact O-N 3.12Å; K202-T206 PolarHBondContact O-OG1 2.67Å; Y203-T206 WeakPolarHBondContact O-CB 3.44Å; Y203-T206 PolarHBondContact O-N 3.15Å; Y203-T206 VanDerWaalsContact O-N 3.13Å; E204-T206 VanDerWaalsContact C-N 3.27Å; E204-T206 PolarHBondContact O-N 3.08Å; T206-R209 PolarHBondContact O-N 2.68Å; T206-K210 PolarHBondContact O-N 3.37Å
207	R	97.3	Very high	94.9	Very high	140 Å²	140	112.1 Å²	112.1	53%	0.528	52%	0.519	S	S	.	.	H	α-helix	trans	-61.9	-45.1	176.5	-172	-178.2	71	177.7	-0.7	111.7	Y203 E204 K210 R211	Y203-R207 PolarHBondContact O-N 2.81Å; E204-R207 PolarHBondContact O-N 3.34Å; R207-K210 PolarHBondContact O-N 2.86Å; R207-R211 PolarHBondContact O-N 3.39Å
208	L	97.4	Very high	93.8	Very high	97 Å²	97	113.9 Å²	113.9	51%	0.508	53%	0.53	S	S	.	.	H	α-helix	trans	-64.5	-41	179	-73	171.8	0	0	0	111.6	E204 V205 K210 R211 V212	E204-L208 WeakPolarHBondContact O-CB 3.45Å; E204-L208 VanDerWaalsContact O-CG 3.25Å; E204-L208 WeakPolarHBondContact O-CG 3.44Å; E204-L208 PolarHBondContact O-N 2.98Å; V205-L208 PolarHBondContact O-N 3.49Å; L208-K210 PolarHBondContact O-N 2.94Å; L208-R211 PolarHBondContact O-N 3.32Å; L208-V212 VanDerWaalsContact O-CG2 3.32Å; L208-V212 WeakPolarHBondContact O-CG2 3.46Å; L208-V212 PolarHBondContact O-N 3.48Å
209	R	96.1	Very high	92.7	Very high	167 Å²	167	112.8 Å²	112.8	63%	0.63	53%	0.53	S	S	*	.	H	α-helix	trans	-57.6	-48.3	174.4	-76.7	173.6	-178.6	-177	0.9	111.7	V205 T206 R211 V212 E213	V205-R209 HydrophobicContact CG1-CG 4.48Å; V205-R209 WeakPolarHBondContact O-CB 3.29Å; V205-R209 VanDerWaalsContact O-CG 3.25Å; V205-R209 WeakPolarHBondContact O-CG 3.27Å; V205-R209 PolarHBondContact O-N 3.07Å; T206-R209 PolarHBondContact O-N 2.68Å; R209-R211 PolarHBondContact O-N 3.22Å; R209-V212 PolarHBondContact O-N 2.87Å; R209-E213 WeakPolarHBondContact O-CG 3.44Å; R209-E213 PolarHBondContact O-N 3.42Å
210	K	95.5	Very high	91.1	Very high	127 Å²	127	116.7 Å²	116.7	55%	0.552	55%	0.547	S	S	*	.	H	α-helix	trans	-59.4	-44.1	175.9	-70.3	-176.1	177.7	-174.9	0	112.3	T206 R207 L208 V212 E213 E214	T206-K210 PolarHBondContact O-N 3.37Å; R207-K210 PolarHBondContact O-N 2.86Å; L208-K210 PolarHBondContact O-N 2.94Å; K210-V212 PolarHBondContact O-N 3.46Å; K210-E213 WeakPolarHBondContact O-CB 3.32Å; K210-E213 PolarHBondContact O-N 3.25Å; K210-E214 WeakPolarHBondContact O-CG 3.45Å; K210-E214 PolarHBondContact O-N 3.03Å
211	R	95.6	Very high	89.3	Confident	166 Å²	166	120.1 Å²	120.1	63%	0.626	56%	0.557	S	S	*	*	H	α-helix	trans	-63.6	-39.9	177.8	-172.6	167.2	-179.6	150.3	-1.6	112.3	R207 L208 R209 E214 L215	R207-R211 PolarHBondContact O-N 3.39Å; L208-R211 PolarHBondContact O-N 3.32Å; R209-R211 PolarHBondContact O-N 3.22Å; R211-E214 PolarHBondContact O-N 2.95Å; R211-L215 HydrophobicContact CG-CD1 4.13Å; R211-L215 WeakPolarHBondContact O-CB 3.42Å; R211-L215 VanDerWaalsContact O-CG 3.31Å; R211-L215 WeakPolarHBondContact O-CG 3.47Å; R211-L215 PolarHBondContact O-N 3.41Å
212	V	94.6	Very high	87.4	Confident	99 Å²	99	116.5 Å²	116.5	60%	0.6	55%	0.545	S	S	*	.	H	α-helix	trans	-63	-44.3	174.3	169.6	0	0	0	0	110.6	L208 R209 K210 E214 L215 S216	L208-V212 VanDerWaalsContact O-CG2 3.32Å; L208-V212 WeakPolarHBondContact O-CG2 3.46Å; L208-V212 PolarHBondContact O-N 3.48Å; R209-V212 PolarHBondContact O-N 2.87Å; K210-V212 PolarHBondContact O-N 3.46Å; V212-E214 PolarHBondContact O-N 3.25Å; V212-L215 PolarHBondContact O-N 2.99Å; V212-S216 VanDerWaalsContact O-CB 3.27Å; V212-S216 WeakPolarHBondContact O-CB 3.48Å; V212-S216 PolarHBondContact O-N 3.36Å
213	E	91.9	Very high	85.4	Confident	113 Å²	113	112.5 Å²	112.5	53%	0.528	54%	0.536	S	S	.	.	H	α-helix	trans	-60.2	-44.6	176.1	-73.9	171.1	-164.9	0	0	111.9	R209 K210 S216 K217	R209-E213 WeakPolarHBondContact O-CG 3.44Å; R209-E213 PolarHBondContact O-N 3.42Å; K210-E213 WeakPolarHBondContact O-CB 3.32Å; K210-E213 PolarHBondContact O-N 3.25Å; E213-S216 PolarHBondContact O-N 3.18Å; E213-S216 PolarHBondContact O-OG 2.88Å; E213-K217 WeakPolarHBondContact O-CG 3.25Å; E213-K217 PolarHBondContact O-N 3.43Å
214	E	90.5	Very high	83.5	Confident	112 Å²	112	107.6 Å²	107.6	52%	0.523	53%	0.528	S	S	.	.	H	α-helix	trans	-60.4	-50.1	176	-74.3	169.7	-176.3	0	0	112.3	K210 R211 V212 S216 K217 F218	K210-E214 WeakPolarHBondContact O-CG 3.45Å; K210-E214 PolarHBondContact O-N 3.03Å; R211-E214 PolarHBondContact O-N 2.95Å; V212-E214 PolarHBondContact O-N 3.25Å; E214-S216 VanDerWaalsContact C-N 3.29Å; E214-S216 PolarHBondContact O-N 3.42Å; E214-K217 WeakPolarHBondContact O-CB 3.31Å; E214-K217 PolarHBondContact O-N 3.38Å; E214-F218 VanDerWaalsContact O-CD2 3.23Å; E214-F218 WeakPolarHBondContact O-CD2 3.33Å
215	L	89.1	Confident	81.6	Confident	111 Å²	111	106.5 Å²	106.5	58%	0.581	53%	0.534	S	S	*	.	H	α-helix	trans	-65	-34.3	179	-69.2	172.5	0	0	0	112	R211 V212 K217 F218 S219	R211-L215 HydrophobicContact CG-CD1 4.13Å; R211-L215 WeakPolarHBondContact O-CB 3.42Å; R211-L215 VanDerWaalsContact O-CG 3.31Å; R211-L215 WeakPolarHBondContact O-CG 3.47Å; R211-L215 PolarHBondContact O-N 3.41Å; V212-L215 PolarHBondContact O-N 2.99Å; L215-K217 PolarHBondContact O-N 3.48Å; L215-F218 PolarHBondContact O-N 3.38Å; L215-F218 VanDerWaalsContact O-N 3.11Å; L215-S219 PolarHBondContact O-N 3.07Å
216	S	84.6	Confident	79.8	Confident	64 Å²	64	110.8 Å²	110.8	45%	0.448	54%	0.544	S	S	.	.	H	α-helix	trans	-63.6	-26.8	177.5	79.1	0	0	0	0	113	V212 E213 E214 F218 S219	V212-S216 VanDerWaalsContact O-CB 3.27Å; V212-S216 WeakPolarHBondContact O-CB 3.48Å; V212-S216 PolarHBondContact O-N 3.36Å; E213-S216 PolarHBondContact O-N 3.18Å; E213-S216 PolarHBondContact O-OG 2.88Å; E214-S216 VanDerWaalsContact C-N 3.29Å; E214-S216 PolarHBondContact O-N 3.42Å; S216-F218 PolarHBondContact O-N 3.2Å; S216-S219 VanDerWaalsContact O-CB 3.29Å; S216-S219 WeakPolarHBondContact O-CB 3.42Å; S216-S219 PolarHBondContact O-N 3.22Å
217	K	80.6	Confident	77.9	Confident	107 Å²	107	118.5 Å²	118.5	47%	0.465	57%	0.565	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67	-24.9	176	-70.2	170	-173	174	0	112.9	E213 E214 L215	E213-K217 WeakPolarHBondContact O-CG 3.25Å; E213-K217 PolarHBondContact O-N 3.43Å; E214-K217 WeakPolarHBondContact O-CB 3.31Å; E214-K217 PolarHBondContact O-N 3.38Å; L215-K217 PolarHBondContact O-N 3.48Å
218	F	76.6	Confident	76	Confident	164 Å²	164	122.8 Å²	122.8	72%	0.719	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	-4.8	177.8	-58.3	-78.7	0	0	0	112.9	E214 L215 S216	E214-F218 VanDerWaalsContact O-CD2 3.23Å; E214-F218 WeakPolarHBondContact O-CD2 3.33Å; L215-F218 PolarHBondContact O-N 3.38Å; L215-F218 VanDerWaalsContact O-N 3.11Å; S216-F218 PolarHBondContact O-N 3.2Å
219	S	74.5	Confident	73.8	Confident	63 Å²	63	130.2 Å²	130.2	44%	0.441	61%	0.609	S	S	.	*	S	Bend	trans	-66.5	151.3	171.1	174.5	0	0	0	0	111.2	L215 S216 K221 G222 A223	L215-S219 PolarHBondContact O-N 3.07Å; S216-S219 VanDerWaalsContact O-CB 3.29Å; S216-S219 WeakPolarHBondContact O-CB 3.42Å; S216-S219 PolarHBondContact O-N 3.22Å; S219-K221 PolarHBondContact O-N 3.38Å; S219-G222 WeakPolarHBondContact O-CA 3.23Å; S219-G222 PolarHBondContact O-N 3.35Å; S219-A223 PolarHBondContact O-N 3.11Å; S219-A223 VanDerWaalsContact O-N 3.07Å
220	K	63.2	Low	72.6	Confident	199 Å²	199	128.4 Å²	128.4	87%	0.865	61%	0.608	S	S	*	*	H	α-helix	trans	-49.1	-29.6	-179.5	-72.5	-176.8	177.9	179.5	0	113.6	A224	K220-A224 PolarHBondContact O-N 3.33Å
221	K	60.9	Low	71.4	Confident	186 Å²	186	128.5 Å²	128.5	81%	0.809	61%	0.611	S	S	*	*	H	α-helix	trans	-74.7	-35.6	174.9	-70	-174.5	177.7	-178.5	0	113.7	S219	S219-K221 PolarHBondContact O-N 3.38Å
222	G	57.5	Low	70.1	Confident	18 Å²	18	126.4 Å²	126.4	19%	0.186	61%	0.61	C	S	.	*	H	α-helix	trans	-75	-34.9	176	0	0	0	0	0	113.1	S219 A225 R226	S219-G222 WeakPolarHBondContact O-CA 3.23Å; S219-G222 PolarHBondContact O-N 3.35Å; G222-A225 PolarHBondContact O-N 3.19Å; G222-R226 PolarHBondContact O-N 2.92Å
223	A	56.8	Low	68.7	Low	46 Å²	46	128 Å²	128	38%	0.38	61%	0.611	S	S	.	*	H	α-helix	trans	-65.4	-36.5	174.3	0	0	0	0	0	112.7	S219 R226 R227	S219-A223 PolarHBondContact O-N 3.11Å; S219-A223 VanDerWaalsContact O-N 3.07Å; A223-R226 PolarHBondContact O-N 3.27Å; A223-R227 PolarHBondContact O-N 3.28Å
224	A	57.3	Low	67.2	Low	53 Å²	53	128.9 Å²	128.9	44%	0.438	62%	0.616	S	S	.	*	H	α-helix	trans	-66.4	-33.6	175.4	0	0	0	0	0	113.1	K220	K220-A224 PolarHBondContact O-N 3.33Å
225	A	58.6	Low	65.7	Low	69 Å²	69	130.1 Å²	130.1	57%	0.57	62%	0.622	S	S	*	*	H	α-helix	trans	-71.6	-32.9	175.9	0	0	0	0	0	112.8	G222	G222-A225 PolarHBondContact O-N 3.19Å
226	R	58.8	Low	64	Low	156 Å²	156	131.4 Å²	131.4	59%	0.589	63%	0.625	S	S	*	*	H	α-helix	trans	-76.7	-26.4	176.5	-68.1	-172.8	-163.2	-142.7	5.4	114.1	G222 A223 R228	G222-R226 PolarHBondContact O-N 2.92Å; A223-R226 PolarHBondContact O-N 3.27Å; R226-R228 VanDerWaalsContact C-N 3.3Å
227	R	58.1	Low	62.4	Low	231 Å²	231	136.6 Å²	136.6	87%	0.872	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	-8.4	176.4	-84.7	-176	166.9	-175.6	-4.1	114.3	A223	A223-R227 PolarHBondContact O-N 3.28Å
228	R	58.6	Low	60.9	Low	230 Å²	230	139.1 Å²	139.1	87%	0.868	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.4	14.1	-179.8	-78.2	-175.4	171	176.2	-2.7	113.5	R226	R226-R228 VanDerWaalsContact C-N 3.3Å
229	K	49.8	Very low	59.5	Low	254 Å²	254	136.8 Å²	136.8	100%	1.104	65%	0.647	S	S	*	*			trans	-123.9	0	178.5	-139.8	-177.5	-172.8	-173.2	0	109.8

Retrieved 229 of 229 residues in 549.9 ms (Link to these results)

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