A0A5K4F6J2_SCHMA Loading...

Putative DNA-binding protein rfxank

AlphaFold DB , UniProt , Accession A0A5K4F6J2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 213 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	29.7	Very low	47.7	Very low	230 Å²	230	126.1 Å²	126.1	100%	1.133	66%	0.662	S	S	*	*				0	118.5	0	-69.8	179.2	178.3	0	0	106.7	F3	M1-F3 PolarHBondContact O-N 2.95Å
2	S	39.2	Very low	49.1	Very low	109 Å²	109	123.4 Å²	123.4	76%	0.762	64%	0.641	S	S	*	*			trans	-74.6	108.6	179.8	-172.9	0	0	0	0	108.2	R4	S2-R4 VanDerWaalsContact C-N 3.26Å; S2-R4 PolarHBondContact O-N 3.04Å
3	F	40.9	Very low	49.1	Very low	205 Å²	205	115.5 Å²	115.5	90%	0.899	60%	0.601	S	S	*	*			trans	-68.5	90.4	166.3	-72.7	-83.2	0	0	0	107.6	M1 S5	M1-F3 PolarHBondContact O-N 2.95Å; F3-S5 PolarHBondContact O-N 3.18Å
4	R	39.6	Very low	49.3	Very low	214 Å²	214	112.7 Å²	112.7	81%	0.808	60%	0.596	S	S	*	*			trans	-76.3	104.7	160.9	-75.9	-173.6	174	-174.4	-2.2	105.7	S2 I6	S2-R4 VanDerWaalsContact C-N 3.26Å; S2-R4 PolarHBondContact O-N 3.04Å; R4-I6 PolarHBondContact O-N 3.22Å; R4-I6 VanDerWaalsContact O-N 3.14Å
5	S	43.9	Very low	49.2	Very low	77 Å²	77	118.3 Å²	118.3	54%	0.538	61%	0.613	S	S	.	*			trans	-53.8	120.6	162.2	49.4	0	0	0	0	106.9	F3 V7	F3-S5 PolarHBondContact O-N 3.18Å; S5-V7 PolarHBondContact O-N 2.8Å
6	I	50.5	Low	49	Very low	168 Å²	168	116.4 Å²	116.4	86%	0.862	62%	0.62	S	S	*	*			trans	-79.7	69.3	178	-61.2	160.9	0	0	0	106.2	R4	R4-I6 PolarHBondContact O-N 3.22Å; R4-I6 VanDerWaalsContact O-N 3.14Å
7	V	53.7	Low	48.7	Very low	35 Å²	35	119.5 Å²	119.5	21%	0.212	63%	0.63	C	S	.	*	P	Polyproline II helix	trans	-84.4	121	162.4	-173.8	0	0	0	0	105.5	S5 Y135 A139	S5-V7 PolarHBondContact O-N 2.8Å; V7-Y135 HydrophobicContact CG1-CE2 3.8Å; V7-A139 HydrophobicContact CG2-CB 4.19Å
8	P	58.5	Low	48.4	Very low	98 Å²	98	124.3 Å²	124.3	64%	0.636	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-55.8	139	174.6	23.1	-31.4	0	0	0	108.9
9	P	53.5	Low	47.6	Very low	64 Å²	64	125.8 Å²	125.8	42%	0.416	65%	0.654	S	S	.	*	P	Polyproline II helix	trans	-54.1	140.7	174	20.8	-30	0	0	0	109.1	L13 F105	P9-L13 HydrophobicContact CB-CB 4.4Å; P9-F105 HydrophobicContact CB-CD2 3.98Å; P9-F105 HydrophobicContact CB-CE2 3.58Å; P9-F105 HydrophobicContact CB-CZ 4.15Å; P9-F105 HydrophobicContact CG-CE2 4.32Å
10	P	54.1	Low	47.2	Very low	16 Å²	16	131.9 Å²	131.9	10%	0.104	67%	0.668	C	S	.	*	P	Polyproline II helix	trans	-58.8	147	174.2	26.6	-35.9	0	0	0	110.7	F12 L13 E101	P10-F12 HydrophobicContact CB-CD1 3.88Å; P10-F12 HydrophobicContact CB-CE1 3.37Å; P10-F12 HydrophobicContact CB-CE2 4.19Å; P10-F12 HydrophobicContact CB-CZ 3.54Å; P10-F12 HydrophobicContact CG-CD1 4.4Å; P10-F12 HydrophobicContact CG-CD2 4.35Å; P10-F12 HydrophobicContact CG-CE1 3.77Å; P10-F12 HydrophobicContact CG-CE2 3.67Å; P10-F12 HydrophobicContact CG-CZ 3.34Å; P10-F12 PolarHBondContact O-N 2.97Å; P10-L13 HydrophobicContact CG-CD1 3.71Å; P10-L13 HydrophobicContact CG-CG 3.96Å; P10-L13 PolarHBondContact O-N 2.77Å; P10-E101 HydrophobicContact CB-CB 4.29Å; P10-E101 WeakPolarHBondContact CB-OE2 3.38Å; P10-E101 HydrophobicContact CG-CB 4.09Å
11	D	61.2	Low	46.9	Very low	171 Å²	171	131.4 Å²	131.4	91%	0.914	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55	-22.4	-168.6	-68.9	-28.3	0	0	0	114.5
12	F	63.8	Low	47.1	Very low	94 Å²	94	127.2 Å²	127.2	41%	0.412	67%	0.666	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79	-11.7	177.6	56.5	-100.5	0	0	0	114.3	P10 S14 L63 A98	P10-F12 HydrophobicContact CB-CD1 3.88Å; P10-F12 HydrophobicContact CB-CE1 3.37Å; P10-F12 HydrophobicContact CB-CE2 4.19Å; P10-F12 HydrophobicContact CB-CZ 3.54Å; P10-F12 HydrophobicContact CG-CD1 4.4Å; P10-F12 HydrophobicContact CG-CD2 4.35Å; P10-F12 HydrophobicContact CG-CE1 3.77Å; P10-F12 HydrophobicContact CG-CE2 3.67Å; P10-F12 HydrophobicContact CG-CZ 3.34Å; P10-F12 PolarHBondContact O-N 2.97Å; F12-S14 PolarHBondContact O-N 2.76Å; F12-L63 HydrophobicContact CD2-CD2 3.75Å; F12-L63 HydrophobicContact CE2-CD1 3.99Å; F12-L63 HydrophobicContact CE2-CD2 3.56Å; F12-L63 HydrophobicContact CE2-CG 4.29Å; F12-L63 HydrophobicContact CG-CD2 4.43Å; F12-L63 HydrophobicContact CZ-CD1 4.26Å; F12-L63 HydrophobicContact CZ-CD2 4.05Å; F12-A98 HydrophobicContact CE1-CB 4.09Å; F12-A98 HydrophobicContact CZ-CB 4.04Å
13	L	49.1	Very low	46.9	Very low	21 Å²	21	125.3 Å²	125.3	11%	0.11	66%	0.663	C	S	.	*			trans	-99.9	58.6	179.4	-61.8	-177.9	0	0	0	111.9	P9 P10 K15 L102 F105	P9-L13 HydrophobicContact CB-CB 4.4Å; P10-L13 HydrophobicContact CG-CD1 3.71Å; P10-L13 HydrophobicContact CG-CG 3.96Å; P10-L13 PolarHBondContact O-N 2.77Å; L13-K15 PolarHBondContact O-N 3Å; L13-L102 HydrophobicContact CD1-CD1 4.44Å; L13-L102 HydrophobicContact CD2-CD1 4.3Å; L13-F105 HydrophobicContact CD1-CD1 3.92Å; L13-F105 HydrophobicContact CD1-CE1 4.26Å; L13-F105 HydrophobicContact CD1-CG 4.32Å
14	S	52.6	Low	46.9	Very low	76 Å²	76	127.8 Å²	127.8	53%	0.531	67%	0.667	S	S	.	*			trans	-76	112.9	169.3	86.2	0	0	0	0	109.7	F12 A16	F12-S14 PolarHBondContact O-N 2.76Å; S14-A16 PolarHBondContact O-N 3.34Å
15	K	48.4	Very low	47.4	Very low	196 Å²	196	121.9 Å²	121.9	85%	0.852	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.1	3.8	177.8	-84.9	-178.8	176.6	176.2	0	114.5	L13	L13-K15 PolarHBondContact O-N 3Å
16	A	45.9	Very low	47.6	Very low	88 Å²	88	123.5 Å²	123.5	73%	0.727	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.3	-10.5	-164.7	0	0	0	0	0	115.4	S14	S14-A16 PolarHBondContact O-N 3.34Å
17	E	43.7	Very low	47.4	Very low	170 Å²	170	121.1 Å²	121.1	79%	0.794	66%	0.656	S	S	*	*	S	Bend	trans	-92.2	-10.8	-169.4	-68.1	-164.5	149.9	0	0	116.3	N19	E17-N19 PolarHBondContact O-N 3.21Å
18	F	42.7	Very low	47.4	Very low	205 Å²	205	128.5 Å²	128.5	90%	0.899	69%	0.685	S	S	*	*	S	Bend	trans	-101.5	60.8	177.5	-87.8	-85.4	0	0	0	113
19	N	33.6	Very low	47.1	Very low	153 Å²	153	129.7 Å²	129.7	82%	0.818	69%	0.685	S	S	*	*			trans	-163.1	77.9	163.2	-107.7	-30.4	0	0	0	112.8	E17	E17-N19 PolarHBondContact O-N 3.21Å
20	R	39.3	Very low	47.2	Very low	248 Å²	248	129.2 Å²	129.2	94%	0.936	68%	0.683	S	S	*	*			trans	-148.7	151.4	158.1	-78.1	-155	-170.5	-174.8	5.5	112.3
21	P	41.5	Very low	47.3	Very low	121 Å²	121	132.1 Å²	132.1	79%	0.786	70%	0.701	S	S	*	*				-108.4	158	-120.6	37.5	-35.1	0	0	0	115.2
22	C	33.3	Very low	46.8	Very low	143 Å²	143	129.5 Å²	129.5	97%	0.966	69%	0.686	S	S	*	*			trans	-70.6	121.2	168.3	-68.8	0	0	0	0	110.8
23	G	34.4	Very low	46.4	Very low	69 Å²	69	130 Å²	130	71%	0.711	69%	0.692	S	S	*	*			trans	140.1	92.3	157.7	0	0	0	0	0	115.3
24	R	41.2	Very low	46.9	Very low	256 Å²	256	131.9 Å²	131.9	97%	0.966	71%	0.705	S	S	*	*			trans	-165.4	140.8	136.6	-107	170.6	-170.7	-161	2.7	110.7
25	S	51.4	Low	46.7	Very low	91 Å²	91	132 Å²	132	64%	0.636	70%	0.7	S	S	*	*			trans	-59.9	153.4	-163.8	67	0	0	0	0	115	N27	S25-N27 PolarHBondContact O-N 3.3Å
26	P	46.3	Very low	47.3	Very low	110 Å²	110	128 Å²	128	71%	0.714	69%	0.691	S	S	*	*			trans	-71.1	97.1	-171.2	27.6	-33.7	0	0	0	112.5
27	N	46.6	Very low	47.6	Very low	119 Å²	119	131.1 Å²	131.1	64%	0.636	69%	0.691	S	S	*	*			trans	-70.6	149.3	164.5	-71.2	-17.8	0	0	0	109.6	S25 I29 S30	S25-N27 PolarHBondContact O-N 3.3Å; N27-I29 PolarHBondContact O-N 3.5Å; N27-S30 VanDerWaalsContact O-CB 3.28Å; N27-S30 WeakPolarHBondContact O-CB 3.5Å; N27-S30 PolarHBondContact O-N 2.94Å
28	K	53.7	Low	48.1	Very low	189 Å²	189	133.3 Å²	133.3	82%	0.822	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-44.8	-15.7	-177.6	-69	172.7	176.9	175.6	0	116.9	T31	K28-T31 PolarHBondContact O-OG1 3.01Å
29	I	53.6	Low	48.4	Very low	124 Å²	124	133.1 Å²	133.1	64%	0.636	69%	0.685	S	S	*	*	H	α-helix	trans	-69.9	-34.6	171.3	-59.1	173.9	0	0	0	111.2	N27 T31 L32 L33	N27-I29 PolarHBondContact O-N 3.5Å; I29-T31 VanDerWaalsContact C-N 3.33Å; I29-T31 PolarHBondContact O-N 2.92Å; I29-L32 PolarHBondContact O-N 3.43Å; I29-L33 HydrophobicContact CG2-CD1 4.07Å; I29-L33 PolarHBondContact O-N 3.4Å
30	S	55.6	Low	49	Very low	53 Å²	53	133 Å²	133	37%	0.371	68%	0.684	S	S	.	*	H	α-helix	trans	-60.2	-40.5	177.1	179.7	0	0	0	0	111.9	N27 L32 L33 T34	N27-S30 VanDerWaalsContact O-CB 3.28Å; N27-S30 WeakPolarHBondContact O-CB 3.5Å; N27-S30 PolarHBondContact O-N 2.94Å; S30-L32 VanDerWaalsContact C-N 3.33Å; S30-L32 PolarHBondContact O-N 3.19Å; S30-L33 PolarHBondContact O-N 2.75Å; S30-T34 PolarHBondContact O-N 3.49Å; S30-T34 PolarHBondContact O-OG1 3.27Å
31	T	55.1	Low	49.7	Very low	77 Å²	77	126.7 Å²	126.7	47%	0.472	67%	0.673	S	S	.	*	H	α-helix	trans	-67.1	-32.9	177.7	45.9	0	0	0	0	113.1	K28 I29 T34 N35	K28-T31 PolarHBondContact O-OG1 3.01Å; I29-T31 VanDerWaalsContact C-N 3.33Å; I29-T31 PolarHBondContact O-N 2.92Å; T31-T34 VanDerWaalsContact CA-OG1 3.31Å; T31-T34 WeakPolarHBondContact CA-OG1 3.28Å; T31-T34 PolarHBondContact O-OG1 2.89Å; T31-N35 WeakPolarHBondContact O-CB 3.31Å; T31-N35 PolarHBondContact O-N 3.38Å; T31-N35 PolarHBondContact O-ND2 3.36Å
32	L	50.7	Low	49.8	Very low	117 Å²	117	129.7 Å²	129.7	61%	0.613	68%	0.677	S	S	*	*	H	α-helix	trans	-73.7	-41.7	176	-69.6	176.1	0	0	0	111.2	I29 S30 T34 N35 V36	I29-L32 PolarHBondContact O-N 3.43Å; S30-L32 VanDerWaalsContact C-N 3.33Å; S30-L32 PolarHBondContact O-N 3.19Å; L32-T34 PolarHBondContact O-N 3.17Å; L32-N35 PolarHBondContact O-N 3.39Å; L32-V36 WeakPolarHBondContact O-CG2 3.43Å; L32-V36 PolarHBondContact O-N 2.8Å
33	L	56.1	Low	50.6	Low	104 Å²	104	127.9 Å²	127.9	55%	0.545	66%	0.662	S	S	.	*	H	α-helix	trans	-60.8	-44	174	-79.5	163.6	0	0	0	111.9	I29 S30 N35 V36 Q37	I29-L33 HydrophobicContact CG2-CD1 4.07Å; I29-L33 PolarHBondContact O-N 3.4Å; S30-L33 PolarHBondContact O-N 2.75Å; L33-N35 VanDerWaalsContact C-N 3.27Å; L33-N35 PolarHBondContact O-N 3.19Å; L33-V36 PolarHBondContact O-N 2.83Å; L33-Q37 WeakPolarHBondContact O-CB 3.32Å; L33-Q37 VanDerWaalsContact O-CG 3.32Å; L33-Q37 WeakPolarHBondContact O-CG 3.42Å; L33-Q37 PolarHBondContact O-N 2.73Å
34	T	58.9	Low	50.7	Low	60 Å²	60	132.1 Å²	132.1	37%	0.368	67%	0.667	S	S	.	*	H	α-helix	trans	-65	-30.8	176.7	47.5	0	0	0	0	113	S30 T31 L32 R38	S30-T34 PolarHBondContact O-N 3.49Å; S30-T34 PolarHBondContact O-OG1 3.27Å; T31-T34 VanDerWaalsContact CA-OG1 3.31Å; T31-T34 WeakPolarHBondContact CA-OG1 3.28Å; T31-T34 PolarHBondContact O-OG1 2.89Å; L32-T34 PolarHBondContact O-N 3.17Å; T34-R38 WeakPolarHBondContact O-CG 3.32Å; T34-R38 PolarHBondContact O-N 3.39Å
35	N	49.7	Very low	50.7	Low	80 Å²	80	123.8 Å²	123.8	43%	0.428	65%	0.653	S	S	.	*	H	α-helix	trans	-81	-33.9	178.9	-72.4	-15.8	0	0	0	112.6	T31 L32 L33 Q37 R38 R39	T31-N35 WeakPolarHBondContact O-CB 3.31Å; T31-N35 PolarHBondContact O-N 3.38Å; T31-N35 PolarHBondContact O-ND2 3.36Å; L32-N35 PolarHBondContact O-N 3.39Å; L33-N35 VanDerWaalsContact C-N 3.27Å; L33-N35 PolarHBondContact O-N 3.19Å; N35-Q37 VanDerWaalsContact C-N 3.34Å; N35-R38 PolarHBondContact O-N 2.64Å; N35-R39 PolarHBondContact O-N 2.86Å; N35-R39 VanDerWaalsContact O-N 3.17Å
36	V	59.9	Low	50.4	Low	110 Å²	110	124.9 Å²	124.9	67%	0.667	66%	0.658	S	S	*	*	H	α-helix	trans	-68.1	-35.5	171.1	171.8	0	0	0	0	110.7	L32 L33 R38 R39	L32-V36 WeakPolarHBondContact O-CG2 3.43Å; L32-V36 PolarHBondContact O-N 2.8Å; L33-V36 PolarHBondContact O-N 2.83Å; V36-R38 VanDerWaalsContact C-N 3.28Å; V36-R38 PolarHBondContact O-N 2.93Å; V36-R39 PolarHBondContact O-N 3.33Å
37	Q	52.5	Low	50	Low	155 Å²	155	125.5 Å²	125.5	72%	0.724	66%	0.66	S	S	*	*	H	α-helix	trans	-65.1	-27.6	171.3	-76.5	177.1	-28.5	0	0	113.4	L33 N35	L33-Q37 WeakPolarHBondContact O-CB 3.32Å; L33-Q37 VanDerWaalsContact O-CG 3.32Å; L33-Q37 WeakPolarHBondContact O-CG 3.42Å; L33-Q37 PolarHBondContact O-N 2.73Å; N35-Q37 VanDerWaalsContact C-N 3.34Å
38	R	53.1	Low	49.9	Very low	215 Å²	215	128.6 Å²	128.6	81%	0.811	67%	0.67	S	S	*	*	H	α-helix	trans	-86.2	-25.1	178.6	-78.1	-176.6	-179.3	176.2	0.8	114.4	T34 N35 V36	T34-R38 WeakPolarHBondContact O-CG 3.32Å; T34-R38 PolarHBondContact O-N 3.39Å; N35-R38 PolarHBondContact O-N 2.64Å; V36-R38 VanDerWaalsContact C-N 3.28Å; V36-R38 PolarHBondContact O-N 2.93Å
39	R	49	Very low	49.6	Very low	201 Å²	201	123.6 Å²	123.6	76%	0.758	66%	0.659	S	S	*	*	S	Bend	trans	-94.8	101.7	-177.7	-75.3	-178.8	177.2	163.6	-0.9	110.4	N35 V36	N35-R39 PolarHBondContact O-N 2.86Å; N35-R39 VanDerWaalsContact O-N 3.17Å; V36-R39 PolarHBondContact O-N 3.33Å
40	N	47.5	Very low	49.5	Very low	151 Å²	151	126.4 Å²	126.4	81%	0.807	67%	0.667	S	S	*	*	S	Bend	trans	92.7	13	150.4	-61.4	-2.8	0	0	0	120.6	Q42	N40-Q42 VanDerWaalsContact C-N 3.34Å; N40-Q42 PolarHBondContact O-N 3.18Å
41	V	53.3	Low	49.7	Very low	115 Å²	115	130.7 Å²	130.7	70%	0.697	69%	0.685	S	S	*	*			trans	-90.7	91.8	145.7	-158.8	0	0	0	0	105.2	T43	V41-T43 HydrophobicContact CB-CG2 3.94Å; V41-T43 HydrophobicContact CG1-CG2 3.4Å; V41-T43 PolarHBondContact O-N 3.09Å
42	Q	43.7	Very low	50.4	Low	184 Å²	184	129.2 Å²	129.2	86%	0.86	67%	0.674	S	S	*	*			trans	-57.6	78.5	144.2	-71.8	168.2	-1	0	0	104.8	N40 L44	N40-Q42 VanDerWaalsContact C-N 3.34Å; N40-Q42 PolarHBondContact O-N 3.18Å; Q42-L44 PolarHBondContact O-N 2.71Å
43	T	50	Low	52.1	Low	106 Å²	106	126.8 Å²	126.8	65%	0.65	67%	0.665	S	S	*	*			trans	-60.6	103.2	162.7	48.8	0	0	0	0	101.3	V41 A45	V41-T43 HydrophobicContact CB-CG2 3.94Å; V41-T43 HydrophobicContact CG1-CG2 3.4Å; V41-T43 PolarHBondContact O-N 3.09Å; T43-A45 PolarHBondContact O-N 3.3Å
44	L	36.9	Very low	53.6	Low	158 Å²	158	122.6 Å²	122.6	83%	0.827	64%	0.642	S	S	*	*			trans	-37.6	112.1	165	-70	160	0	0	0	104.5	Q42	Q42-L44 PolarHBondContact O-N 2.71Å
45	A	40.8	Very low	55.1	Low	81 Å²	81	121.8 Å²	121.8	67%	0.669	63%	0.634	S	S	*	*			trans	-46.2	121.8	174.3	0	0	0	0	0	104.3	T43 T47	T43-A45 PolarHBondContact O-N 3.3Å; A45-T47 PolarHBondContact O-N 2.72Å
46	P	46.4	Very low	57	Low	113 Å²	113	122 Å²	122	73%	0.734	63%	0.632	S	S	*	*			trans	-50.6	112.6	-170.3	16.9	-28.8	0	0	0	105.7	E48	P46-E48 PolarHBondContact O-N 2.95Å
47	T	37.5	Very low	58.5	Low	124 Å²	124	117.4 Å²	117.4	76%	0.761	60%	0.604	S	S	*	*			trans	-44.8	118.4	-177.1	42.8	0	0	0	0	105.7	A45 S49	A45-T47 PolarHBondContact O-N 2.72Å; T47-S49 PolarHBondContact O-N 3Å
48	E	43.5	Very low	60.4	Low	184 Å²	184	110 Å²	110	86%	0.86	57%	0.569	S	S	*	*			trans	0.9	91.2	177.2	-68.8	175	168.7	0	0	109.7	P46 K50	P46-E48 PolarHBondContact O-N 2.95Å; E48-K50 PolarHBondContact O-N 2.61Å
49	S	47.1	Very low	62.3	Low	84 Å²	84	100.6 Å²	100.6	59%	0.587	54%	0.537	S	S	*	.			trans	-49.3	100.8	179.5	48.2	0	0	0	0	105.2	T47 D51	T47-S49 PolarHBondContact O-N 3Å; S49-D51 PolarHBondContact O-N 3.31Å
50	K	51.8	Low	64.4	Low	182 Å²	182	95.6 Å²	95.6	79%	0.791	52%	0.522	S	S	*	.			trans	-51.7	111.2	162.3	-74.2	-177.5	178.3	178.9	0	100.8	E48 L52	E48-K50 PolarHBondContact O-N 2.61Å; K50-L52 PolarHBondContact O-N 3.3Å
51	D	59.8	Low	66.4	Low	143 Å²	143	89.4 Å²	89.4	77%	0.765	49%	0.494	S	S	*	.			trans	-61.3	89.1	-179.4	-71.1	-39.1	0	0	0	104.6	S49 T53	S49-D51 PolarHBondContact O-N 3.31Å; D51-T53 PolarHBondContact O-N 3.06Å
52	L	70.2	Confident	68.2	Low	46 Å²	46	87.8 Å²	87.8	24%	0.241	48%	0.479	C	S	.	.			trans	-62.4	118.4	-176.2	-76.6	171.5	0	0	0	103.3	K50 Q56 M57 E62	K50-L52 PolarHBondContact O-N 3.3Å; L52-Q56 HydrophobicContact CB-CB 4.32Å; L52-Q56 HydrophobicContact CD2-CB 4Å; L52-M57 HydrophobicContact CB-CG 3.75Å; L52-M57 VanDerWaalsContact O-CE 3.3Å; L52-M57 WeakPolarHBondContact O-CE 3.2Å; L52-E62 HydrophobicContact CD1-CG 4.36Å
53	T	86.1	Confident	70.5	Confident	67 Å²	67	80.9 Å²	80.9	41%	0.411	45%	0.448	S	S	.	.			trans	-58.3	153.9	176	63.1	0	0	0	0	108.4	D51 F55 Q56 M57	D51-T53 PolarHBondContact O-N 3.06Å; T53-F55 PolarHBondContact O-N 3.42Å; T53-F55 VanDerWaalsContact O-N 3.09Å; T53-Q56 VanDerWaalsContact N-OE1 3.1Å; T53-Q56 WeakPolarHBondContact O-CA 3.49Å; T53-Q56 WeakPolarHBondContact O-CB 3.49Å; T53-Q56 PolarHBondContact O-N 3.1Å; T53-Q56 VanDerWaalsContact OG1-CG 3.26Å; T53-Q56 WeakPolarHBondContact OG1-CG 3.16Å; T53-Q56 PolarHBondContact OG1-N 2.94Å; T53-M57 PolarHBondContact O-N 2.91Å
54	F	87.8	Confident	72.4	Confident	16 Å²	16	82.6 Å²	82.6	7%	0.07	45%	0.452	C	S	.	.	H	α-helix	trans	-51.4	-38.1	178.2	-170.5	-103.7	0	0	0	112.4	M57 A58 L66 E69 I70 F75 L77 P87 L103	F54-M57 HydrophobicContact CB-CE 4.3Å; F54-M57 HydrophobicContact CD2-CE 4.15Å; F54-M57 PolarHBondContact O-N 3.3Å; F54-A58 PolarHBondContact O-N 3.02Å; F54-A58 VanDerWaalsContact O-N 3.12Å; F54-L66 HydrophobicContact CD2-CD1 4.15Å; F54-L66 HydrophobicContact CE1-CD1 4.29Å; F54-L66 HydrophobicContact CE2-CD1 3.57Å; F54-L66 HydrophobicContact CZ-CD1 3.64Å; F54-E69 HydrophobicContact CD2-CB 4.12Å; F54-E69 HydrophobicContact CE2-CB 4.12Å; F54-I70 HydrophobicContact CE2-CD1 4.42Å; F54-I70 HydrophobicContact CE2-CG1 3.79Å; F54-I70 HydrophobicContact CZ-CD1 4.04Å; F54-I70 HydrophobicContact CZ-CG1 3.67Å; F54-F75 HydrophobicContact CB-CZ 4.2Å; F54-F75 AromaticContact CD1-CD1 3.86Å; F54-F75 HydrophobicContact CD1-CD1 3.86Å; F54-F75 AromaticContact CD1-CE1 3.42Å; F54-F75 HydrophobicContact CD1-CE1 3.42Å; F54-F75 VanDerWaalsContact CD1-CE1 3.42Å; F54-F75 AromaticContact CD1-CZ 3.86Å; F54-F75 HydrophobicContact CD1-CZ 3.86Å; F54-F75 AromaticContact CE1-CD1 3.62Å; F54-F75 HydrophobicContact CE1-CD1 3.62Å; F54-F75 AromaticContact CE1-CE1 3.63Å; F54-F75 HydrophobicContact CE1-CE1 3.63Å; F54-F75 HydrophobicContact CE1-CG 4.46Å; F54-F75 HydrophobicContact CE1-CZ 4.47Å; F54-F75 HydrophobicContact CE2-CD1 4.37Å; F54-F75 HydrophobicContact CE2-CG 4.46Å; F54-F75 HydrophobicContact CG-CD1 4.34Å; F54-F75 AromaticContact CG-CE1 3.98Å; F54-F75 HydrophobicContact CG-CE1 3.98Å; F54-F75 HydrophobicContact CG-CE2 4.41Å; F54-F75 HydrophobicContact CG-CZ 4.01Å; F54-F75 AromaticContact CZ-CD1 3.91Å; F54-F75 HydrophobicContact CZ-CD1 3.91Å; F54-F75 HydrophobicContact CZ-CE1 4.33Å; F54-F75 HydrophobicContact CZ-CG 4.39Å; F54-L77 HydrophobicContact CE1-CD2 3.93Å; F54-L77 HydrophobicContact CZ-CD2 3.66Å; F54-P87 HydrophobicContact CD1-CB 3.84Å; F54-P87 HydrophobicContact CD1-CG 3.39Å; F54-P87 HydrophobicContact CE1-CB 3.61Å; F54-P87 HydrophobicContact CE1-CG 3.4Å; F54-P87 VanDerWaalsContact CE1-CG 3.4Å; F54-L103 HydrophobicContact CE1-CD2 4.49Å; F54-L103 HydrophobicContact CZ-CD2 4.33Å
55	F	90.5	Very high	74.9	Confident	42 Å²	42	78.5 Å²	78.5	18%	0.184	43%	0.431	C	S	.	.	H	α-helix	trans	-63.3	-43.3	173.6	-51.4	-76.5	0	0	0	113.1	T53 A58 A59 D81 P87	T53-F55 PolarHBondContact O-N 3.42Å; T53-F55 VanDerWaalsContact O-N 3.09Å; F55-A58 PolarHBondContact O-N 3.35Å; F55-A59 WeakPolarHBondContact O-CB 3.3Å; F55-A59 PolarHBondContact O-N 2.91Å; F55-D81 HydrophobicContact CD1-CB 4.06Å; F55-D81 HydrophobicContact CD2-CB 4.18Å; F55-D81 HydrophobicContact CE1-CB 3.83Å; F55-D81 HydrophobicContact CE2-CB 3.97Å; F55-D81 HydrophobicContact CG-CB 4.22Å; F55-D81 HydrophobicContact CZ-CB 3.79Å; F55-P87 HydrophobicContact CD1-CG 3.81Å; F55-P87 HydrophobicContact CE1-CG 3.82Å
56	Q	90.4	Very high	77.2	Confident	86 Å²	86	74.6 Å²	74.6	40%	0.402	40%	0.399	S	S	.	.	H	α-helix	trans	-66.4	-37.3	176.2	-75.1	168.9	-14	0	0	112.4	L52 T53 A58 A59 Q60	L52-Q56 HydrophobicContact CB-CB 4.32Å; L52-Q56 HydrophobicContact CD2-CB 4Å; T53-Q56 VanDerWaalsContact N-OE1 3.1Å; T53-Q56 WeakPolarHBondContact O-CA 3.49Å; T53-Q56 WeakPolarHBondContact O-CB 3.49Å; T53-Q56 PolarHBondContact O-N 3.1Å; T53-Q56 VanDerWaalsContact OG1-CG 3.26Å; T53-Q56 WeakPolarHBondContact OG1-CG 3.16Å; T53-Q56 PolarHBondContact OG1-N 2.94Å; Q56-A58 VanDerWaalsContact C-N 3.34Å; Q56-A59 PolarHBondContact O-N 3.46Å; Q56-Q60 VanDerWaalsContact O-CB 3.3Å; Q56-Q60 WeakPolarHBondContact O-CB 3.41Å; Q56-Q60 VanDerWaalsContact O-CG 3.28Å; Q56-Q60 WeakPolarHBondContact O-CG 3.24Å; Q56-Q60 PolarHBondContact O-N 2.78Å
57	M	91.2	Very high	79.3	Confident	13 Å²	13	71.4 Å²	71.4	6%	0.064	37%	0.374	C	S	.	.	H	α-helix	trans	-61.3	-44.2	174.3	-69.6	-175.4	-85.9	0	0	111.2	L52 T53 F54 G61 E62 L65 L66 E69	L52-M57 HydrophobicContact CB-CG 3.75Å; L52-M57 VanDerWaalsContact O-CE 3.3Å; L52-M57 WeakPolarHBondContact O-CE 3.2Å; T53-M57 PolarHBondContact O-N 2.91Å; F54-M57 HydrophobicContact CB-CE 4.3Å; F54-M57 HydrophobicContact CD2-CE 4.15Å; F54-M57 PolarHBondContact O-N 3.3Å; M57-G61 PolarHBondContact O-N 3.23Å; M57-E62 HydrophobicContact CB-CB 4.36Å; M57-E62 PolarHBondContact O-N 2.78Å; M57-L65 HydrophobicContact CG-CB 4.4Å; M57-L65 HydrophobicContact SD-CB 3.56Å; M57-L65 VanDerWaalsContact SD-CB 3.56Å; M57-L65 HydrophobicContact SD-CD1 4.45Å; M57-L66 HydrophobicContact CB-CD1 4.3Å; M57-E69 HydrophobicContact CE-CB 4.48Å; M57-E69 HydrophobicContact CE-CG 3.78Å; M57-E69 HydrophobicContact SD-CG 4.22Å
58	A	92.5	Very high	81.8	Confident	0 Å²	0	73.7 Å²	73.7	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-66.6	-40.9	175.9	0	0	0	0	0	112.6	F54 F55 Q56 G61 L66 P87 A91 L103	F54-A58 PolarHBondContact O-N 3.02Å; F54-A58 VanDerWaalsContact O-N 3.12Å; F55-A58 PolarHBondContact O-N 3.35Å; Q56-A58 VanDerWaalsContact C-N 3.34Å; A58-G61 PolarHBondContact O-N 2.87Å; A58-L66 HydrophobicContact CB-CD1 4.16Å; A58-P87 HydrophobicContact CB-CB 3.93Å; A58-P87 VanDerWaalsContact CB-O 3.3Å; A58-P87 WeakPolarHBondContact CB-O 3.3Å; A58-A91 HydrophobicContact CB-CB 4.45Å; A58-L103 HydrophobicContact CB-CD1 4.28Å
59	A	92.9	Very high	83.8	Confident	17 Å²	17	67 Å²	67	14%	0.14	34%	0.337	C	S	.	.	H	α-helix	trans	-65.1	-39.6	177.3	0	0	0	0	0	113	F55 Q56 W90 N94 Q96	F55-A59 WeakPolarHBondContact O-CB 3.3Å; F55-A59 PolarHBondContact O-N 2.91Å; Q56-A59 PolarHBondContact O-N 3.46Å; A59-W90 HydrophobicContact CB-CB 4.11Å; A59-W90 HydrophobicContact CB-CE3 4.35Å; A59-N94 WeakPolarHBondContact O-CB 3.39Å; A59-Q96 WeakPolarHBondContact O-CG 3.44Å; A59-Q96 PolarHBondContact O-NE2 3.4Å
60	Q	92.4	Very high	85.8	Confident	95 Å²	95	63.5 Å²	63.5	44%	0.444	31%	0.312	S	S	.	.	H	α-helix	trans	-83.7	-15.7	-178.9	-68.2	172.9	17.7	0	0	113	Q56 E62 Q96	Q56-Q60 VanDerWaalsContact O-CB 3.3Å; Q56-Q60 WeakPolarHBondContact O-CB 3.41Å; Q56-Q60 VanDerWaalsContact O-CG 3.28Å; Q56-Q60 WeakPolarHBondContact O-CG 3.24Å; Q56-Q60 PolarHBondContact O-N 2.78Å; Q60-E62 HydrophobicContact CB-CG 4.14Å; Q60-Q96 VanDerWaalsContact C-NE2 3.28Å; Q60-Q96 PolarHBondContact O-NE2 3.09Å
61	G	90	Very high	87.4	Confident	21 Å²	21	60.2 Å²	60.2	22%	0.216	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.8	27.2	-178.6	0	0	0	0	0	113.6	M57 A58 L63	M57-G61 PolarHBondContact O-N 3.23Å; A58-G61 PolarHBondContact O-N 2.87Å; G61-L63 PolarHBondContact O-N 3.12Å
62	E	91.4	Very high	88.6	Confident	81 Å²	81	57.1 Å²	57.1	38%	0.379	29%	0.289	S	S	.	.			trans	-72.8	71.5	179.1	-70	-61.7	155	0	0	111.2	L52 M57 Q60 L64 L65 L66	L52-E62 HydrophobicContact CD1-CG 4.36Å; M57-E62 HydrophobicContact CB-CB 4.36Å; M57-E62 PolarHBondContact O-N 2.78Å; Q60-E62 HydrophobicContact CB-CG 4.14Å; E62-L64 VanDerWaalsContact C-N 3.35Å; E62-L64 PolarHBondContact O-N 2.95Å; E62-L65 HydrophobicContact CB-CB 4.27Å; E62-L65 HydrophobicContact CB-CD1 4.3Å; E62-L65 PolarHBondContact O-N 3.39Å; E62-L66 VanDerWaalsContact O-CB 3.32Å; E62-L66 WeakPolarHBondContact O-CB 3.47Å; E62-L66 PolarHBondContact O-N 3.46Å
63	L	90.9	Very high	88.8	Confident	40 Å²	40	63.2 Å²	63.2	21%	0.209	31%	0.309	C	S	.	.	H	α-helix	trans	-55.4	-44	-168.4	-173.8	71.6	0	0	0	113.6	F12 G61 L66 Q67 A98 L102	F12-L63 HydrophobicContact CD2-CD2 3.75Å; F12-L63 HydrophobicContact CE2-CD1 3.99Å; F12-L63 HydrophobicContact CE2-CD2 3.56Å; F12-L63 HydrophobicContact CE2-CG 4.29Å; F12-L63 HydrophobicContact CG-CD2 4.43Å; F12-L63 HydrophobicContact CZ-CD1 4.26Å; F12-L63 HydrophobicContact CZ-CD2 4.05Å; G61-L63 PolarHBondContact O-N 3.12Å; L63-L66 PolarHBondContact O-N 2.85Å; L63-Q67 VanDerWaalsContact O-CB 3.27Å; L63-Q67 WeakPolarHBondContact O-CB 3.44Å; L63-Q67 PolarHBondContact O-N 3.06Å; L63-A98 HydrophobicContact CD1-CB 4.31Å; L63-A98 HydrophobicContact CD2-CB 4.47Å; L63-L102 HydrophobicContact CD1-CB 3.8Å; L63-L102 HydrophobicContact CD1-CD1 3.41Å; L63-L102 VanDerWaalsContact CD1-CD1 3.41Å; L63-L102 HydrophobicContact CD1-CG 4.18Å; L63-L102 HydrophobicContact CG-CD1 4.12Å
64	L	89.9	Confident	88.3	Confident	141 Å²	141	67.2 Å²	67.2	74%	0.738	33%	0.328	S	S	*	.	H	α-helix	trans	-66.7	-41	-178.5	-66.9	176.4	0	0	0	111.9	E62 R68	E62-L64 VanDerWaalsContact C-N 3.35Å; E62-L64 PolarHBondContact O-N 2.95Å; L64-R68 VanDerWaalsContact O-CB 3.24Å; L64-R68 WeakPolarHBondContact O-CB 3.44Å; L64-R68 PolarHBondContact O-N 3.36Å
65	L	89.8	Confident	87.8	Confident	72 Å²	72	69.4 Å²	69.4	38%	0.377	34%	0.337	S	S	.	.	H	α-helix	trans	-71.6	-42.4	177.4	-63.7	179.8	0	0	0	110.6	M57 E62 R68 E69	M57-L65 HydrophobicContact CG-CB 4.4Å; M57-L65 HydrophobicContact SD-CB 3.56Å; M57-L65 VanDerWaalsContact SD-CB 3.56Å; M57-L65 HydrophobicContact SD-CD1 4.45Å; E62-L65 HydrophobicContact CB-CB 4.27Å; E62-L65 HydrophobicContact CB-CD1 4.3Å; E62-L65 PolarHBondContact O-N 3.39Å; L65-R68 PolarHBondContact O-N 2.86Å; L65-E69 WeakPolarHBondContact O-CG 3.32Å; L65-E69 PolarHBondContact O-N 2.88Å
66	L	89.6	Confident	87.5	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-58.5	-50.2	176.5	-169.6	69.7	0	0	0	111	F54 M57 A58 E62 L63 R68 E69 I70 A99 L102 L103	F54-L66 HydrophobicContact CD2-CD1 4.15Å; F54-L66 HydrophobicContact CE1-CD1 4.29Å; F54-L66 HydrophobicContact CE2-CD1 3.57Å; F54-L66 HydrophobicContact CZ-CD1 3.64Å; M57-L66 HydrophobicContact CB-CD1 4.3Å; A58-L66 HydrophobicContact CB-CD1 4.16Å; E62-L66 VanDerWaalsContact O-CB 3.32Å; E62-L66 WeakPolarHBondContact O-CB 3.47Å; E62-L66 PolarHBondContact O-N 3.46Å; L63-L66 PolarHBondContact O-N 2.85Å; L66-R68 PolarHBondContact O-N 3.29Å; L66-E69 PolarHBondContact O-N 3.17Å; L66-I70 HydrophobicContact CD1-CD1 4.46Å; L66-I70 HydrophobicContact CG-CD1 3.99Å; L66-I70 WeakPolarHBondContact O-CD1 3.24Å; L66-I70 WeakPolarHBondContact O-CG1 3.27Å; L66-I70 PolarHBondContact O-N 3.17Å; L66-A99 HydrophobicContact CD2-CB 3.99Å; L66-L102 HydrophobicContact CD2-CD2 4.16Å; L66-L102 HydrophobicContact CG-CD2 4.28Å; L66-L103 HydrophobicContact CD1-CD2 4.46Å; L66-L103 HydrophobicContact CD2-CD1 4.43Å; L66-L103 HydrophobicContact CD2-CD2 4.28Å; L66-L103 HydrophobicContact CD2-CG 4.09Å
67	Q	90.1	Very high	87.4	Confident	45 Å²	45	68.1 Å²	68.1	21%	0.21	34%	0.335	C	S	.	.	H	α-helix	trans	-59.1	-47.3	176.6	-173.4	175	-6.3	0	0	111.7	L63 E69 I70 E71 L102	L63-Q67 VanDerWaalsContact O-CB 3.27Å; L63-Q67 WeakPolarHBondContact O-CB 3.44Å; L63-Q67 PolarHBondContact O-N 3.06Å; Q67-E69 VanDerWaalsContact C-N 3.34Å; Q67-E69 PolarHBondContact O-N 3.26Å; Q67-I70 PolarHBondContact O-N 3.41Å; Q67-E71 HydrophobicContact CG-CG 4.36Å; Q67-E71 VanDerWaalsContact CG-OE1 3.24Å; Q67-E71 WeakPolarHBondContact CG-OE1 3.28Å; Q67-E71 PolarHBondContact NE2-OE1 3.49Å; Q67-E71 WeakPolarHBondContact O-CB 3.26Å; Q67-E71 WeakPolarHBondContact O-CG 3.45Å; Q67-E71 PolarHBondContact O-N 3.3Å; Q67-L102 HydrophobicContact CB-CD1 3.72Å; Q67-L102 HydrophobicContact CG-CD1 4.07Å
68	R	88.9	Confident	87.3	Confident	172 Å²	172	70.2 Å²	70.2	65%	0.649	35%	0.346	S	S	*	.	H	α-helix	trans	-60.1	-42.8	179.6	-179.9	-179.6	176.5	-178.9	-2	112	L64 L65 L66 S72	L64-R68 VanDerWaalsContact O-CB 3.24Å; L64-R68 WeakPolarHBondContact O-CB 3.44Å; L64-R68 PolarHBondContact O-N 3.36Å; L65-R68 PolarHBondContact O-N 2.86Å; L66-R68 PolarHBondContact O-N 3.29Å; R68-S72 WeakPolarHBondContact O-CB 3.32Å; R68-S72 PolarHBondContact O-N 2.86Å; R68-S72 PolarHBondContact O-OG 2.9Å
69	E	87	Confident	87.1	Confident	44 Å²	44	74 Å²	74	21%	0.206	37%	0.366	C	S	.	.	H	α-helix	trans	-69.2	-38.7	179.1	-72.7	-64	141.9	0	0	112	F54 M57 L65 L66 Q67 S72 R73	F54-E69 HydrophobicContact CD2-CB 4.12Å; F54-E69 HydrophobicContact CE2-CB 4.12Å; M57-E69 HydrophobicContact CE-CB 4.48Å; M57-E69 HydrophobicContact CE-CG 3.78Å; M57-E69 HydrophobicContact SD-CG 4.22Å; L65-E69 WeakPolarHBondContact O-CG 3.32Å; L65-E69 PolarHBondContact O-N 2.88Å; L66-E69 PolarHBondContact O-N 3.17Å; Q67-E69 VanDerWaalsContact C-N 3.34Å; Q67-E69 PolarHBondContact O-N 3.26Å; E69-S72 WeakPolarHBondContact CA-OG 3.47Å; E69-S72 PolarHBondContact O-OG 3.3Å; E69-R73 PolarHBondContact O-N 2.84Å; E69-R73 VanDerWaalsContact O-N 3.09Å; E69-R73 IonicContact OE1-NH2 3.74Å; E69-R73 WeakPolarHBondContact OE2-CD 3.25Å; E69-R73 IonicContact OE2-CZ 3.22Å; E69-R73 IonicContact OE2-NE 2.71Å; E69-R73 PolarHBondContact OE2-NE 3.04Å; E69-R73 IonicContact OE2-NH2 3.19Å; E69-R73 PolarHBondContact OE2-NH2 3.48Å
70	I	88.3	Confident	87	Confident	10 Å²	10	76.5 Å²	76.5	5%	0.051	38%	0.381	C	S	.	.	H	α-helix	trans	-63.4	-49	176	-67.1	168.3	0	0	0	110.9	F54 L66 Q67 N74 L77 L102 L103 Y106	F54-I70 HydrophobicContact CE2-CD1 4.42Å; F54-I70 HydrophobicContact CE2-CG1 3.79Å; F54-I70 HydrophobicContact CZ-CD1 4.04Å; F54-I70 HydrophobicContact CZ-CG1 3.67Å; L66-I70 HydrophobicContact CD1-CD1 4.46Å; L66-I70 HydrophobicContact CG-CD1 3.99Å; L66-I70 WeakPolarHBondContact O-CD1 3.24Å; L66-I70 WeakPolarHBondContact O-CG1 3.27Å; L66-I70 PolarHBondContact O-N 3.17Å; Q67-I70 PolarHBondContact O-N 3.41Å; I70-N74 PolarHBondContact O-N 3.14Å; I70-L77 HydrophobicContact CD1-CD2 3.95Å; I70-L77 HydrophobicContact CG1-CD2 3.87Å; I70-L102 HydrophobicContact CD1-CD2 3.39Å; I70-L103 HydrophobicContact CD1-CD2 3.98Å; I70-Y106 HydrophobicContact CD1-CD2 4.24Å; I70-Y106 HydrophobicContact CG2-CD1 3.66Å; I70-Y106 HydrophobicContact CG2-CD2 3.9Å; I70-Y106 HydrophobicContact CG2-CE1 4.06Å; I70-Y106 HydrophobicContact CG2-CE2 4.27Å; I70-Y106 HydrophobicContact CG2-CG 3.6Å
71	E	86.5	Confident	86.8	Confident	113 Å²	113	73.6 Å²	73.6	53%	0.528	37%	0.368	S	S	.	.	H	α-helix	trans	-69.5	-34.3	-178.6	-71.5	175.9	-173	0	0	112.8	Q67 Y106	Q67-E71 HydrophobicContact CG-CG 4.36Å; Q67-E71 VanDerWaalsContact CG-OE1 3.24Å; Q67-E71 WeakPolarHBondContact CG-OE1 3.28Å; Q67-E71 PolarHBondContact NE2-OE1 3.49Å; Q67-E71 WeakPolarHBondContact O-CB 3.26Å; Q67-E71 WeakPolarHBondContact O-CG 3.45Å; Q67-E71 PolarHBondContact O-N 3.3Å; E71-Y106 HydrophobicContact CG-CE1 4.45Å; E71-Y106 WeakPolarHBondContact CG-OH 3.3Å; E71-Y106 PolarHBondContact OE1-OH 3.4Å
72	S	84.5	Confident	86.7	Confident	78 Å²	78	80.8 Å²	80.8	55%	0.545	40%	0.402	S	S	.	.	H	α-helix	trans	-79.9	-37.8	-176.9	60.3	0	0	0	0	113.9	R68 E69	R68-S72 WeakPolarHBondContact O-CB 3.32Å; R68-S72 PolarHBondContact O-N 2.86Å; R68-S72 PolarHBondContact O-OG 2.9Å; E69-S72 WeakPolarHBondContact CA-OG 3.47Å; E69-S72 PolarHBondContact O-OG 3.3Å
73	R	74.6	Confident	86.2	Confident	174 Å²	174	82.2 Å²	82.2	66%	0.657	41%	0.408	S	S	*	.	H	α-helix	trans	-105.7	-3.6	-172.3	-58.9	-167.6	-162.9	-157.1	4.6	114.5	E69 F75	E69-R73 PolarHBondContact O-N 2.84Å; E69-R73 VanDerWaalsContact O-N 3.09Å; E69-R73 IonicContact OE1-NH2 3.74Å; E69-R73 WeakPolarHBondContact OE2-CD 3.25Å; E69-R73 IonicContact OE2-CZ 3.22Å; E69-R73 IonicContact OE2-NE 2.71Å; E69-R73 PolarHBondContact OE2-NE 3.04Å; E69-R73 IonicContact OE2-NH2 3.19Å; E69-R73 PolarHBondContact OE2-NH2 3.48Å; R73-F75 PolarHBondContact O-N 2.77Å
74	N	75	Confident	86.1	Confident	152 Å²	152	80.7 Å²	80.7	81%	0.813	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.8	51.7	-170.4	-162.6	83.4	0	0	0	110.5	I70	I70-N74 PolarHBondContact O-N 3.14Å
75	F	76.4	Confident	86.2	Confident	62 Å²	62	74.9 Å²	74.9	27%	0.272	37%	0.371	S	S	.	.			trans	-65.3	136.1	-170.1	-162.9	-90.7	0	0	0	111	F54 R73 L77	F54-F75 HydrophobicContact CB-CZ 4.2Å; F54-F75 AromaticContact CD1-CD1 3.86Å; F54-F75 HydrophobicContact CD1-CD1 3.86Å; F54-F75 AromaticContact CD1-CE1 3.42Å; F54-F75 HydrophobicContact CD1-CE1 3.42Å; F54-F75 VanDerWaalsContact CD1-CE1 3.42Å; F54-F75 AromaticContact CD1-CZ 3.86Å; F54-F75 HydrophobicContact CD1-CZ 3.86Å; F54-F75 AromaticContact CE1-CD1 3.62Å; F54-F75 HydrophobicContact CE1-CD1 3.62Å; F54-F75 AromaticContact CE1-CE1 3.63Å; F54-F75 HydrophobicContact CE1-CE1 3.63Å; F54-F75 HydrophobicContact CE1-CG 4.46Å; F54-F75 HydrophobicContact CE1-CZ 4.47Å; F54-F75 HydrophobicContact CE2-CD1 4.37Å; F54-F75 HydrophobicContact CE2-CG 4.46Å; F54-F75 HydrophobicContact CG-CD1 4.34Å; F54-F75 AromaticContact CG-CE1 3.98Å; F54-F75 HydrophobicContact CG-CE1 3.98Å; F54-F75 HydrophobicContact CG-CE2 4.41Å; F54-F75 HydrophobicContact CG-CZ 4.01Å; F54-F75 AromaticContact CZ-CD1 3.91Å; F54-F75 HydrophobicContact CZ-CD1 3.91Å; F54-F75 HydrophobicContact CZ-CE1 4.33Å; F54-F75 HydrophobicContact CZ-CG 4.39Å; R73-F75 PolarHBondContact O-N 2.77Å; F75-L77 HydrophobicContact CD1-CD2 4.24Å; F75-L77 PolarHBondContact O-N 3Å
76	N	85.4	Confident	86.3	Confident	91 Å²	91	71.7 Å²	71.7	49%	0.487	36%	0.355	S	S	.	.			trans	-78	109.5	170.4	-178.8	0.9	0	0	0	109.1	D78 I79	N76-D78 PolarHBondContact O-N 2.88Å; N76-D78 PolarHBondContact OD1-N 3.34Å; N76-D78 VanDerWaalsContact OD1-N 3.17Å; N76-I79 HydrophobicContact CB-CD1 3.78Å; N76-I79 HydrophobicContact CB-CG1 3.95Å
77	L	87.8	Confident	86.5	Confident	10 Å²	10	71.7 Å²	71.7	5%	0.052	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-14	-174	-55.9	179.7	0	0	0	113.8	F54 I70 F75 P87 L103 A108	F54-L77 HydrophobicContact CE1-CD2 3.93Å; F54-L77 HydrophobicContact CZ-CD2 3.66Å; I70-L77 HydrophobicContact CD1-CD2 3.95Å; I70-L77 HydrophobicContact CG1-CD2 3.87Å; F75-L77 HydrophobicContact CD1-CD2 4.24Å; F75-L77 PolarHBondContact O-N 3Å; L77-P87 WeakPolarHBondContact O-CD 3.47Å; L77-L103 HydrophobicContact CD1-CD2 4.19Å; L77-L103 WeakPolarHBondContact CD1-O 3.48Å; L77-L103 HydrophobicContact CD2-CD2 3.82Å; L77-L103 HydrophobicContact CG-CD2 4.48Å; L77-A108 HydrophobicContact CB-CB 3.9Å; L77-A108 HydrophobicContact CD1-CB 3.88Å
78	D	89.3	Confident	86.8	Confident	56 Å²	56	69.8 Å²	69.8	30%	0.299	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	4.1	-174.8	-66.1	-20.7	0	0	0	112.8	N76 P80 N109 L112	N76-D78 PolarHBondContact O-N 2.88Å; N76-D78 PolarHBondContact OD1-N 3.34Å; N76-D78 VanDerWaalsContact OD1-N 3.17Å; D78-P80 VanDerWaalsContact O-CD 3.32Å; D78-P80 WeakPolarHBondContact O-CD 3.35Å; D78-N109 WeakPolarHBondContact OD1-CB 3.34Å; D78-N109 PolarHBondContact OD1-N 3.24Å; D78-L112 HydrophobicContact CB-CD1 3.62Å
79	I	89.2	Confident	87.1	Confident	81 Å²	81	61.7 Å²	61.7	42%	0.415	32%	0.316	S	S	.	.			trans	-75.2	119.7	176.5	-59.4	173	0	0	0	109	N76	N76-I79 HydrophobicContact CB-CD1 3.78Å; N76-I79 HydrophobicContact CB-CG1 3.95Å
80	P	90.7	Very high	87.5	Confident	69 Å²	69	62.7 Å²	62.7	45%	0.448	32%	0.317	S	S	.	.			trans	-76.9	158.7	175.2	32	-34.4	0	0	0	112	D78 G84 F85	D78-P80 VanDerWaalsContact O-CD 3.32Å; D78-P80 WeakPolarHBondContact O-CD 3.35Å; P80-G84 VanDerWaalsContact CB-C 3.42Å; P80-G84 WeakPolarHBondContact CB-O 3.37Å; P80-F85 WeakPolarHBondContact CA-O 3.4Å
81	D	88.6	Confident	87.9	Confident	33 Å²	33	62.2 Å²	62.2	18%	0.176	32%	0.315	C	S	.	.			trans	-80.6	-171.2	165.8	70.5	8	0	0	0	112.1	F55 Q83 G84 F85 W90	F55-D81 HydrophobicContact CD1-CB 4.06Å; F55-D81 HydrophobicContact CD2-CB 4.18Å; F55-D81 HydrophobicContact CE1-CB 3.83Å; F55-D81 HydrophobicContact CE2-CB 3.97Å; F55-D81 HydrophobicContact CG-CB 4.22Å; F55-D81 HydrophobicContact CZ-CB 3.79Å; D81-Q83 PolarHBondContact O-N 3.46Å; D81-Q83 VanDerWaalsContact O-N 3.1Å; D81-Q83 WeakPolarHBondContact OD1-CA 3.33Å; D81-Q83 WeakPolarHBondContact OD1-CB 3.23Å; D81-Q83 PolarHBondContact OD1-N 3.01Å; D81-G84 PolarHBondContact O-N 3.01Å; D81-G84 PolarHBondContact OD1-N 2.8Å; D81-F85 PolarHBondContact N-O 3.34Å; D81-F85 PolarHBondContact OD1-N 3.03Å; D81-W90 PolarHBondContact OD2-NE1 2.96Å
82	N	86.4	Confident	88.4	Confident	173 Å²	173	56.9 Å²	56.9	93%	0.925	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-6.1	179.6	-62.6	-9.8	0	0	0	114.3
83	Q	81.2	Confident	88.9	Confident	110 Å²	110	53.3 Å²	53.3	51%	0.514	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.4	6	175.8	-58.6	-177.3	-23.9	0	0	111.8	D81 F85 D115	D81-Q83 PolarHBondContact O-N 3.46Å; D81-Q83 VanDerWaalsContact O-N 3.1Å; D81-Q83 WeakPolarHBondContact OD1-CA 3.33Å; D81-Q83 WeakPolarHBondContact OD1-CB 3.23Å; D81-Q83 PolarHBondContact OD1-N 3.01Å; Q83-F85 HydrophobicContact CB-CD2 4.13Å; Q83-F85 WeakPolarHBondContact O-CD2 3.26Å; Q83-F85 PolarHBondContact O-N 3.41Å; Q83-D115 VanDerWaalsContact O-CG 3.29Å
84	G	88.4	Confident	89.9	Confident	8 Å²	8	48.5 Å²	48.5	8%	0.082	25%	0.253	C	S	.	.	S	Bend	trans	79.9	0.6	-172.8	0	0	0	0	0	113.5	P80 D81 T86 D115	P80-G84 VanDerWaalsContact CB-C 3.42Å; P80-G84 WeakPolarHBondContact CB-O 3.37Å; D81-G84 PolarHBondContact O-N 3.01Å; D81-G84 PolarHBondContact OD1-N 2.8Å; G84-T86 PolarHBondContact O-N 2.89Å; G84-D115 VanDerWaalsContact CA-OD1 3.25Å; G84-D115 WeakPolarHBondContact CA-OD1 3.34Å; G84-D115 PolarHBondContact N-OD2 3.14Å
85	F	92.2	Very high	90.9	Very high	20 Å²	20	42.3 Å²	42.3	9%	0.088	23%	0.225	C	C	.	.			trans	-84.7	122.2	-172.8	-85.8	-123.4	0	0	0	111.1	P80 D81 Q83 L89 W90 L123	P80-F85 WeakPolarHBondContact CA-O 3.4Å; D81-F85 PolarHBondContact N-O 3.34Å; D81-F85 PolarHBondContact OD1-N 3.03Å; Q83-F85 HydrophobicContact CB-CD2 4.13Å; Q83-F85 WeakPolarHBondContact O-CD2 3.26Å; Q83-F85 PolarHBondContact O-N 3.41Å; F85-L89 HydrophobicContact CB-CB 4.42Å; F85-L89 HydrophobicContact CD1-CB 3.73Å; F85-L89 HydrophobicContact CE1-CB 4.31Å; F85-L89 HydrophobicContact CG-CB 4.26Å; F85-L89 HydrophobicContact CG-CD1 4.49Å; F85-W90 HydrophobicContact CB-CG 4.47Å; F85-W90 HydrophobicContact CB-CZ2 4.34Å; F85-W90 VanDerWaalsContact CB-NE1 3.29Å; F85-W90 HydrophobicContact CD1-CD2 4.27Å; F85-W90 HydrophobicContact CD1-CZ2 4.48Å; F85-W90 HydrophobicContact CG-CZ2 4.49Å; F85-L123 HydrophobicContact CD1-CD1 4.42Å; F85-L123 HydrophobicContact CE1-CD1 3.63Å; F85-L123 HydrophobicContact CE1-CD2 4.26Å; F85-L123 HydrophobicContact CZ-CD1 4.19Å; F85-L123 HydrophobicContact CZ-CD2 4.31Å
86	T	93.4	Very high	91.8	Very high	5 Å²	5	42.3 Å²	42.3	3%	0.031	23%	0.226	C	C	.	.			trans	-75.5	159.9	168.3	69.7	0	0	0	0	110.3	G84 L88 L89 W90 L112	G84-T86 PolarHBondContact O-N 2.89Å; T86-L88 PolarHBondContact O-N 3.35Å; T86-L88 VanDerWaalsContact O-N 3.16Å; T86-L89 WeakPolarHBondContact O-CB 3.37Å; T86-L89 PolarHBondContact O-N 3.36Å; T86-L89 WeakPolarHBondContact OG1-CG 3.33Å; T86-L89 PolarHBondContact OG1-N 3.48Å; T86-W90 PolarHBondContact O-N 2.93Å; T86-W90 VanDerWaalsContact O-N 3.14Å; T86-L112 HydrophobicContact CG2-CB 4.27Å; T86-L112 HydrophobicContact CG2-CD1 3.91Å
87	P	93.2	Very high	92.3	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-53.9	-34.2	174	-26.1	37.3	0	0	0	112.5	F54 F55 A58 L77 W90 A91 L103	F54-P87 HydrophobicContact CD1-CB 3.84Å; F54-P87 HydrophobicContact CD1-CG 3.39Å; F54-P87 HydrophobicContact CE1-CB 3.61Å; F54-P87 HydrophobicContact CE1-CG 3.4Å; F54-P87 VanDerWaalsContact CE1-CG 3.4Å; F55-P87 HydrophobicContact CD1-CG 3.81Å; F55-P87 HydrophobicContact CE1-CG 3.82Å; A58-P87 HydrophobicContact CB-CB 3.93Å; A58-P87 VanDerWaalsContact CB-O 3.3Å; A58-P87 WeakPolarHBondContact CB-O 3.3Å; L77-P87 WeakPolarHBondContact O-CD 3.47Å; P87-W90 PolarHBondContact O-N 2.99Å; P87-A91 PolarHBondContact O-N 3.18Å; P87-L103 HydrophobicContact CB-CD1 4.28Å; P87-L103 HydrophobicContact CB-CD2 4.4Å
88	L	95.3	Very high	92.6	Very high	5 Å²	5	43.3 Å²	43.3	3%	0.026	23%	0.233	C	C	.	.	H	α-helix	trans	-65.6	-43.2	175.4	-175.5	66.1	0	0	0	111.9	T86 W90 A91 C92 V100 L103 V104 A108 I110	T86-L88 PolarHBondContact O-N 3.35Å; T86-L88 VanDerWaalsContact O-N 3.16Å; L88-W90 VanDerWaalsContact C-N 3.33Å; L88-W90 PolarHBondContact O-N 3.13Å; L88-A91 PolarHBondContact O-N 2.93Å; L88-C92 WeakPolarHBondContact O-CB 3.35Å; L88-C92 PolarHBondContact O-N 3.36Å; L88-C92 PolarHBondContact O-SG 3.02Å; L88-V100 HydrophobicContact CD1-CB 4.34Å; L88-V100 HydrophobicContact CD1-CG1 3.94Å; L88-V100 HydrophobicContact CD1-CG2 4.39Å; L88-L103 HydrophobicContact CB-CD1 4.3Å; L88-L103 HydrophobicContact CD1-CB 4.03Å; L88-L103 HydrophobicContact CD1-CD1 4.25Å; L88-V104 HydrophobicContact CD1-CG2 3.99Å; L88-V104 HydrophobicContact CD2-CG2 4.43Å; L88-A108 HydrophobicContact CB-CB 4.44Å; L88-A108 HydrophobicContact CD2-CB 4.22Å; L88-I110 HydrophobicContact CD2-CG2 4.2Å
89	L	95.8	Very high	92.9	Very high	2 Å²	2	40.8 Å²	40.8	1%	0.01	22%	0.219	C	C	.	.	H	α-helix	trans	-61.9	-42	177.2	-67	176.7	0	0	0	111.6	F85 T86 C92 A93 G114 E118 L123	F85-L89 HydrophobicContact CB-CB 4.42Å; F85-L89 HydrophobicContact CD1-CB 3.73Å; F85-L89 HydrophobicContact CE1-CB 4.31Å; F85-L89 HydrophobicContact CG-CB 4.26Å; F85-L89 HydrophobicContact CG-CD1 4.49Å; T86-L89 WeakPolarHBondContact O-CB 3.37Å; T86-L89 PolarHBondContact O-N 3.36Å; T86-L89 WeakPolarHBondContact OG1-CG 3.33Å; T86-L89 PolarHBondContact OG1-N 3.48Å; L89-C92 PolarHBondContact O-N 3.5Å; L89-A93 WeakPolarHBondContact O-CB 3.18Å; L89-A93 PolarHBondContact O-N 3.23Å; L89-G114 VanDerWaalsContact CD1-N 3.29Å; L89-E118 WeakPolarHBondContact CD2-O 3.34Å; L89-L123 HydrophobicContact CB-CD1 4Å; L89-L123 HydrophobicContact CD2-CD1 3.92Å
90	W	95.4	Very high	93.2	Very high	65 Å²	65	36.9 Å²	36.9	25%	0.246	20%	0.199	C	C	.	.	H	α-helix	trans	-61.3	-43.8	173.9	-80.1	112.3	0	0	0	113	A59 D81 F85 T86 P87 L88 N94	A59-W90 HydrophobicContact CB-CB 4.11Å; A59-W90 HydrophobicContact CB-CE3 4.35Å; D81-W90 PolarHBondContact OD2-NE1 2.96Å; F85-W90 HydrophobicContact CB-CG 4.47Å; F85-W90 HydrophobicContact CB-CZ2 4.34Å; F85-W90 VanDerWaalsContact CB-NE1 3.29Å; F85-W90 HydrophobicContact CD1-CD2 4.27Å; F85-W90 HydrophobicContact CD1-CZ2 4.48Å; F85-W90 HydrophobicContact CG-CZ2 4.49Å; T86-W90 PolarHBondContact O-N 2.93Å; T86-W90 VanDerWaalsContact O-N 3.14Å; P87-W90 PolarHBondContact O-N 2.99Å; L88-W90 VanDerWaalsContact C-N 3.33Å; L88-W90 PolarHBondContact O-N 3.13Å; W90-N94 PolarHBondContact O-N 3.35Å; W90-N94 VanDerWaalsContact O-N 3.13Å; W90-N94 PolarHBondContact O-ND2 3.5Å
91	A	96.1	Very high	93.4	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-63.9	-42.6	176.5	0	0	0	0	0	111.6	A58 P87 L88 N94 G95 Q96 A99 V100 L103	A58-A91 HydrophobicContact CB-CB 4.45Å; P87-A91 PolarHBondContact O-N 3.18Å; L88-A91 PolarHBondContact O-N 2.93Å; A91-N94 PolarHBondContact O-N 3.27Å; A91-G95 PolarHBondContact O-N 2.91Å; A91-G95 VanDerWaalsContact O-N 3.08Å; A91-Q96 HydrophobicContact CB-CB 4.32Å; A91-Q96 PolarHBondContact O-N 3.16Å; A91-A99 HydrophobicContact CB-CB 4.05Å; A91-V100 HydrophobicContact CB-CG2 3.67Å; A91-L103 HydrophobicContact CB-CD1 4.18Å
92	C	96.9	Very high	93.6	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-64.3	-44.7	177.1	-70.9	0	0	0	0	112.4	L88 L89 N94 G95 H129 V132	L88-C92 WeakPolarHBondContact O-CB 3.35Å; L88-C92 PolarHBondContact O-N 3.36Å; L88-C92 PolarHBondContact O-SG 3.02Å; L89-C92 PolarHBondContact O-N 3.5Å; C92-N94 VanDerWaalsContact C-N 3.27Å; C92-N94 PolarHBondContact O-N 2.9Å; C92-G95 PolarHBondContact O-N 3.01Å; C92-H129 PolarHBondContact O-CD2 3.15Å; C92-V132 HydrophobicContact CB-CG1 4.27Å
93	A	95.5	Very high	94	Very high	4 Å²	4	25 Å²	25	3%	0.033	13%	0.131	C	C	.	.	H	α-helix	trans	-62.5	-34.8	177.6	0	0	0	0	0	112.4	L89 L123 R127 H129	L89-A93 WeakPolarHBondContact O-CB 3.18Å; L89-A93 PolarHBondContact O-N 3.23Å; A93-L123 HydrophobicContact CB-CB 4.22Å; A93-L123 HydrophobicContact CB-CD1 4.29Å; A93-R127 WeakPolarHBondContact O-CD 3.44Å; A93-H129 PolarHBondContact O-CD2 3.42Å; A93-H129 PolarHBondContact O-NE2 2.95Å
94	N	95.9	Very high	94.6	Very high	72 Å²	72	20.3 Å²	20.3	39%	0.385	11%	0.11	S	C	.	.	H	α-helix	trans	-90.1	-0.7	179.5	-71	-73.5	0	0	0	113.9	A59 W90 A91 C92 Q96	A59-N94 WeakPolarHBondContact O-CB 3.39Å; W90-N94 PolarHBondContact O-N 3.35Å; W90-N94 VanDerWaalsContact O-N 3.13Å; W90-N94 PolarHBondContact O-ND2 3.5Å; A91-N94 PolarHBondContact O-N 3.27Å; C92-N94 VanDerWaalsContact C-N 3.27Å; C92-N94 PolarHBondContact O-N 2.9Å; N94-Q96 VanDerWaalsContact C-N 3.29Å; N94-Q96 HydrophobicContact CB-CG 3.95Å; N94-Q96 PolarHBondContact O-N 3.25Å
95	G	95.3	Very high	94.7	Very high	23 Å²	23	23.1 Å²	23.1	24%	0.237	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.3	19.8	178.2	0	0	0	0	0	113.7	A91 C92 K97 H129	A91-G95 PolarHBondContact O-N 2.91Å; A91-G95 VanDerWaalsContact O-N 3.08Å; C92-G95 PolarHBondContact O-N 3.01Å; G95-K97 VanDerWaalsContact C-N 3.29Å; G95-K97 PolarHBondContact O-N 2.88Å; G95-H129 WeakPolarHBondContact CA-CD2 3.36Å; G95-H129 PolarHBondContact N-CD2 3.34Å; G95-H129 VanDerWaalsContact N-CD2 3.31Å; G95-H129 PolarHBondContact N-NE2 2.89Å
96	Q	96.4	Very high	94.7	Very high	62 Å²	62	26 Å²	26	29%	0.29	13%	0.131	S	C	.	.			trans	-79.9	73.9	-174.9	-61.1	-65.7	-1.9	0	0	111.2	A59 Q60 A91 N94 A98 A99 V100	A59-Q96 WeakPolarHBondContact O-CG 3.44Å; A59-Q96 PolarHBondContact O-NE2 3.4Å; Q60-Q96 VanDerWaalsContact C-NE2 3.28Å; Q60-Q96 PolarHBondContact O-NE2 3.09Å; A91-Q96 HydrophobicContact CB-CB 4.32Å; A91-Q96 PolarHBondContact O-N 3.16Å; N94-Q96 VanDerWaalsContact C-N 3.29Å; N94-Q96 HydrophobicContact CB-CG 3.95Å; N94-Q96 PolarHBondContact O-N 3.25Å; Q96-A98 VanDerWaalsContact C-N 3.33Å; Q96-A98 PolarHBondContact O-N 3.46Å; Q96-A99 HydrophobicContact CB-CB 3.85Å; Q96-A99 WeakPolarHBondContact O-CB 3.43Å; Q96-A99 PolarHBondContact O-N 3.25Å; Q96-V100 WeakPolarHBondContact O-CG2 3.45Å; Q96-V100 PolarHBondContact O-N 3.37Å
97	K	95.1	Very high	94.5	Very high	85 Å²	85	28.3 Å²	28.3	37%	0.37	16%	0.156	S	C	.	.	H	α-helix	trans	-49.2	-49.5	-176.1	-171.2	-160.7	-175.1	-170	0	113.2	G95 A99 V100 E101 D131 V132	G95-K97 VanDerWaalsContact C-N 3.29Å; G95-K97 PolarHBondContact O-N 2.88Å; K97-A99 VanDerWaalsContact C-N 3.31Å; K97-A99 PolarHBondContact O-N 2.94Å; K97-V100 WeakPolarHBondContact O-CB 3.22Å; K97-V100 PolarHBondContact O-N 3Å; K97-E101 WeakPolarHBondContact CE-OE1 3.21Å; K97-E101 HydrophobicContact CG-CG 4.48Å; K97-E101 IonicContact NZ-OE1 3.73Å; K97-E101 WeakPolarHBondContact O-CG 3.46Å; K97-E101 PolarHBondContact O-N 3.47Å; K97-D131 HydrophobicContact CD-CB 3.95Å; K97-D131 HydrophobicContact CG-CB 4.38Å; K97-V132 HydrophobicContact CB-CG2 4.22Å
98	A	94.5	Very high	94.5	Very high	37 Å²	37	28.7 Å²	28.7	31%	0.306	16%	0.159	S	C	.	.	H	α-helix	trans	-64.1	-35.3	-178.7	0	0	0	0	0	112.7	F12 L63 Q96 L102	F12-A98 HydrophobicContact CE1-CB 4.09Å; F12-A98 HydrophobicContact CZ-CB 4.04Å; L63-A98 HydrophobicContact CD1-CB 4.31Å; L63-A98 HydrophobicContact CD2-CB 4.47Å; Q96-A98 VanDerWaalsContact C-N 3.33Å; Q96-A98 PolarHBondContact O-N 3.46Å; A98-L102 WeakPolarHBondContact O-CB 3.44Å; A98-L102 PolarHBondContact O-N 2.87Å
99	A	95.2	Very high	94.3	Very high	2 Å²	2	31.1 Å²	31.1	2%	0.017	17%	0.172	C	C	.	.	H	α-helix	trans	-70.4	-41.1	175.2	0	0	0	0	0	111.4	L66 A91 Q96 K97 L102 L103	L66-A99 HydrophobicContact CD2-CB 3.99Å; A91-A99 HydrophobicContact CB-CB 4.05Å; Q96-A99 HydrophobicContact CB-CB 3.85Å; Q96-A99 WeakPolarHBondContact O-CB 3.43Å; Q96-A99 PolarHBondContact O-N 3.25Å; K97-A99 VanDerWaalsContact C-N 3.31Å; K97-A99 PolarHBondContact O-N 2.94Å; A99-L102 PolarHBondContact O-N 3.21Å; A99-L103 WeakPolarHBondContact O-CB 3.42Å; A99-L103 VanDerWaalsContact O-CG 3.23Å; A99-L103 WeakPolarHBondContact O-CG 3.49Å; A99-L103 PolarHBondContact O-N 2.91Å
100	V	96.1	Very high	94.2	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-58.9	-48.8	173	174.3	0	0	0	0	110.4	L88 A91 Q96 K97 L102 L103 V104 V132 Y135 L136	L88-V100 HydrophobicContact CD1-CB 4.34Å; L88-V100 HydrophobicContact CD1-CG1 3.94Å; L88-V100 HydrophobicContact CD1-CG2 4.39Å; A91-V100 HydrophobicContact CB-CG2 3.67Å; Q96-V100 WeakPolarHBondContact O-CG2 3.45Å; Q96-V100 PolarHBondContact O-N 3.37Å; K97-V100 WeakPolarHBondContact O-CB 3.22Å; K97-V100 PolarHBondContact O-N 3Å; V100-L102 VanDerWaalsContact C-N 3.34Å; V100-L102 PolarHBondContact O-N 2.86Å; V100-L103 PolarHBondContact O-N 3.37Å; V100-V104 HydrophobicContact CG1-CG2 4.43Å; V100-V104 WeakPolarHBondContact O-CB 3.38Å; V100-V104 VanDerWaalsContact O-CG2 3.3Å; V100-V104 WeakPolarHBondContact O-CG2 3.3Å; V100-V104 PolarHBondContact O-N 3.03Å; V100-V132 HydrophobicContact CG2-CG1 4.16Å; V100-Y135 HydrophobicContact CG1-CD1 3.76Å; V100-Y135 HydrophobicContact CG1-CE1 4.01Å; V100-L136 HydrophobicContact CG1-CD2 4.09Å
101	E	94.7	Very high	94.1	Very high	25 Å²	25	33.5 Å²	33.5	12%	0.117	19%	0.188	C	C	.	.	H	α-helix	trans	-58.4	-45.1	177.9	-73.2	176.8	166.6	0	0	112.1	P10 K97 F105 Y135	P10-E101 HydrophobicContact CB-CB 4.29Å; P10-E101 WeakPolarHBondContact CB-OE2 3.38Å; P10-E101 HydrophobicContact CG-CB 4.09Å; K97-E101 WeakPolarHBondContact CE-OE1 3.21Å; K97-E101 HydrophobicContact CG-CG 4.48Å; K97-E101 IonicContact NZ-OE1 3.73Å; K97-E101 WeakPolarHBondContact O-CG 3.46Å; K97-E101 PolarHBondContact O-N 3.47Å; E101-F105 WeakPolarHBondContact O-CB 3.37Å; E101-F105 PolarHBondContact O-N 3.22Å; E101-Y135 HydrophobicContact CB-CE1 4.46Å; E101-Y135 HydrophobicContact CB-CE2 4.38Å; E101-Y135 HydrophobicContact CG-CD1 4.19Å; E101-Y135 HydrophobicContact CG-CD2 3.74Å; E101-Y135 HydrophobicContact CG-CE1 3.98Å; E101-Y135 HydrophobicContact CG-CE2 3.54Å; E101-Y135 HydrophobicContact CG-CG 4.06Å
102	L	93.5	Very high	93.9	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-65.9	-45.8	179.2	-171.5	144.5	0	0	0	111.7	L13 L63 L66 Q67 I70 A98 A99 V100 V104 F105 Y106	L13-L102 HydrophobicContact CD1-CD1 4.44Å; L13-L102 HydrophobicContact CD2-CD1 4.3Å; L63-L102 HydrophobicContact CD1-CB 3.8Å; L63-L102 HydrophobicContact CD1-CD1 3.41Å; L63-L102 VanDerWaalsContact CD1-CD1 3.41Å; L63-L102 HydrophobicContact CD1-CG 4.18Å; L63-L102 HydrophobicContact CG-CD1 4.12Å; L66-L102 HydrophobicContact CD2-CD2 4.16Å; L66-L102 HydrophobicContact CG-CD2 4.28Å; Q67-L102 HydrophobicContact CB-CD1 3.72Å; Q67-L102 HydrophobicContact CG-CD1 4.07Å; I70-L102 HydrophobicContact CD1-CD2 3.39Å; A98-L102 WeakPolarHBondContact O-CB 3.44Å; A98-L102 PolarHBondContact O-N 2.87Å; A99-L102 PolarHBondContact O-N 3.21Å; V100-L102 VanDerWaalsContact C-N 3.34Å; V100-L102 PolarHBondContact O-N 2.86Å; L102-V104 PolarHBondContact O-N 3.31Å; L102-F105 WeakPolarHBondContact O-CB 2.86Å; L102-F105 PolarHBondContact O-N 3.25Å; L102-Y106 HydrophobicContact CD1-CE2 4.4Å; L102-Y106 HydrophobicContact CD2-CD2 3.58Å; L102-Y106 HydrophobicContact CD2-CE2 3.82Å; L102-Y106 HydrophobicContact CG-CD2 3.91Å; L102-Y106 HydrophobicContact CG-CE2 3.92Å; L102-Y106 VanDerWaalsContact O-CD2 3.26Å; L102-Y106 WeakPolarHBondContact O-CD2 3.01Å; L102-Y106 PolarHBondContact O-N 2.86Å
103	L	94.1	Very high	93.7	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-61.9	-45.5	179.2	-72.9	168.6	0	0	0	111.5	F54 A58 L66 I70 L77 P87 L88 A91 A99 V100 F105 Y106 G107 A108	F54-L103 HydrophobicContact CE1-CD2 4.49Å; F54-L103 HydrophobicContact CZ-CD2 4.33Å; A58-L103 HydrophobicContact CB-CD1 4.28Å; L66-L103 HydrophobicContact CD1-CD2 4.46Å; L66-L103 HydrophobicContact CD2-CD1 4.43Å; L66-L103 HydrophobicContact CD2-CD2 4.28Å; L66-L103 HydrophobicContact CD2-CG 4.09Å; I70-L103 HydrophobicContact CD1-CD2 3.98Å; L77-L103 HydrophobicContact CD1-CD2 4.19Å; L77-L103 WeakPolarHBondContact CD1-O 3.48Å; L77-L103 HydrophobicContact CD2-CD2 3.82Å; L77-L103 HydrophobicContact CG-CD2 4.48Å; P87-L103 HydrophobicContact CB-CD1 4.28Å; P87-L103 HydrophobicContact CB-CD2 4.4Å; L88-L103 HydrophobicContact CB-CD1 4.3Å; L88-L103 HydrophobicContact CD1-CB 4.03Å; L88-L103 HydrophobicContact CD1-CD1 4.25Å; A91-L103 HydrophobicContact CB-CD1 4.18Å; A99-L103 WeakPolarHBondContact O-CB 3.42Å; A99-L103 VanDerWaalsContact O-CG 3.23Å; A99-L103 WeakPolarHBondContact O-CG 3.49Å; A99-L103 PolarHBondContact O-N 2.91Å; V100-L103 PolarHBondContact O-N 3.37Å; L103-F105 VanDerWaalsContact C-N 3.34Å; L103-F105 PolarHBondContact O-N 3.08Å; L103-Y106 CarbonylContact O-C 3.59Å; L103-Y106 PolarHBondContact O-N 3.37Å; L103-G107 PolarHBondContact O-N 3.36Å; L103-A108 HydrophobicContact CB-CB 3.92Å; L103-A108 VanDerWaalsContact O-CB 3.22Å; L103-A108 WeakPolarHBondContact O-CB 3.45Å; L103-A108 PolarHBondContact O-N 2.93Å
104	V	93.6	Very high	93.5	Very high	11 Å²	11	38.8 Å²	38.8	7%	0.067	22%	0.222	C	C	.	.	H	α-helix	trans	-65.1	-39	176.9	173.7	0	0	0	0	111.1	L88 V100 L102 Y106 G107 I110 Y135 A139	L88-V104 HydrophobicContact CD1-CG2 3.99Å; L88-V104 HydrophobicContact CD2-CG2 4.43Å; V100-V104 HydrophobicContact CG1-CG2 4.43Å; V100-V104 WeakPolarHBondContact O-CB 3.38Å; V100-V104 VanDerWaalsContact O-CG2 3.3Å; V100-V104 WeakPolarHBondContact O-CG2 3.3Å; V100-V104 PolarHBondContact O-N 3.03Å; L102-V104 PolarHBondContact O-N 3.31Å; V104-Y106 VanDerWaalsContact C-N 3.27Å; V104-Y106 PolarHBondContact O-N 3.13Å; V104-G107 PolarHBondContact O-N 3.47Å; V104-I110 HydrophobicContact CG1-CG2 4.3Å; V104-I110 HydrophobicContact CG2-CG2 3.64Å; V104-Y135 HydrophobicContact CB-CE1 4.04Å; V104-Y135 HydrophobicContact CG1-CE1 4.25Å; V104-Y135 HydrophobicContact CG2-CE1 4.06Å; V104-A139 HydrophobicContact CG1-CB 4.39Å
105	F	91.5	Very high	93.2	Very high	67 Å²	67	40.1 Å²	40.1	29%	0.294	23%	0.228	S	C	.	.	H	α-helix	trans	-59.9	-36.9	174.7	176.7	-101.3	0	0	0	112.7	P9 L13 E101 L102 L103 G107	P9-F105 HydrophobicContact CB-CD2 3.98Å; P9-F105 HydrophobicContact CB-CE2 3.58Å; P9-F105 HydrophobicContact CB-CZ 4.15Å; P9-F105 HydrophobicContact CG-CE2 4.32Å; L13-F105 HydrophobicContact CD1-CD1 3.92Å; L13-F105 HydrophobicContact CD1-CE1 4.26Å; L13-F105 HydrophobicContact CD1-CG 4.32Å; E101-F105 WeakPolarHBondContact O-CB 3.37Å; E101-F105 PolarHBondContact O-N 3.22Å; L102-F105 WeakPolarHBondContact O-CB 2.86Å; L102-F105 PolarHBondContact O-N 3.25Å; L103-F105 VanDerWaalsContact C-N 3.34Å; L103-F105 PolarHBondContact O-N 3.08Å; F105-G107 VanDerWaalsContact C-N 3.27Å; F105-G107 PolarHBondContact O-N 2.99Å
106	Y	90.4	Very high	92.9	Very high	80 Å²	80	43.2 Å²	43.2	31%	0.314	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	1.9	175	-79.5	-72.5	0	0	0	114.3	I70 E71 L102 L103 V104	I70-Y106 HydrophobicContact CD1-CD2 4.24Å; I70-Y106 HydrophobicContact CG2-CD1 3.66Å; I70-Y106 HydrophobicContact CG2-CD2 3.9Å; I70-Y106 HydrophobicContact CG2-CE1 4.06Å; I70-Y106 HydrophobicContact CG2-CE2 4.27Å; I70-Y106 HydrophobicContact CG2-CG 3.6Å; E71-Y106 HydrophobicContact CG-CE1 4.45Å; E71-Y106 WeakPolarHBondContact CG-OH 3.3Å; E71-Y106 PolarHBondContact OE1-OH 3.4Å; L102-Y106 HydrophobicContact CD1-CE2 4.4Å; L102-Y106 HydrophobicContact CD2-CD2 3.58Å; L102-Y106 HydrophobicContact CD2-CE2 3.82Å; L102-Y106 HydrophobicContact CG-CD2 3.91Å; L102-Y106 HydrophobicContact CG-CE2 3.92Å; L102-Y106 VanDerWaalsContact O-CD2 3.26Å; L102-Y106 WeakPolarHBondContact O-CD2 3.01Å; L102-Y106 PolarHBondContact O-N 2.86Å; L103-Y106 CarbonylContact O-C 3.59Å; L103-Y106 PolarHBondContact O-N 3.37Å; V104-Y106 VanDerWaalsContact C-N 3.27Å; V104-Y106 PolarHBondContact O-N 3.13Å
107	G	89.9	Confident	92.7	Very high	55 Å²	55	40.9 Å²	40.9	57%	0.567	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	95.3	20.9	172.2	0	0	0	0	0	115.4	L103 V104 F105	L103-G107 PolarHBondContact O-N 3.36Å; V104-G107 PolarHBondContact O-N 3.47Å; F105-G107 VanDerWaalsContact C-N 3.27Å; F105-G107 PolarHBondContact O-N 2.99Å
108	A	92.5	Very high	92.5	Very high	7 Å²	7	39.4 Å²	39.4	6%	0.058	23%	0.226	C	C	.	.			trans	-59.5	137.5	170.5	0	0	0	0	0	110.9	L77 L88 L103 I110	L77-A108 HydrophobicContact CB-CB 3.9Å; L77-A108 HydrophobicContact CD1-CB 3.88Å; L88-A108 HydrophobicContact CB-CB 4.44Å; L88-A108 HydrophobicContact CD2-CB 4.22Å; L103-A108 HydrophobicContact CB-CB 3.92Å; L103-A108 VanDerWaalsContact O-CB 3.22Å; L103-A108 WeakPolarHBondContact O-CB 3.45Å; L103-A108 PolarHBondContact O-N 2.93Å; A108-I110 PolarHBondContact O-N 2.9Å
109	N	93.1	Very high	92.5	Very high	56 Å²	56	37.9 Å²	37.9	30%	0.299	21%	0.214	S	C	.	.			trans	-78.9	116	-177.9	-175.4	-1.6	0	0	0	111.8	D78 I111 L112	D78-N109 WeakPolarHBondContact OD1-CB 3.34Å; D78-N109 PolarHBondContact OD1-N 3.24Å; N109-I111 VanDerWaalsContact C-N 3.32Å; N109-I111 PolarHBondContact O-N 3.46Å; N109-I111 WeakPolarHBondContact OD1-CG1 3.29Å; N109-I111 PolarHBondContact OD1-N 3.25Å; N109-I111 VanDerWaalsContact OD1-N 3.13Å; N109-L112 HydrophobicContact CB-CD1 3.78Å; N109-L112 HydrophobicContact CB-CG 3.79Å
110	I	93.4	Very high	92.5	Very high	28 Å²	28	37.9 Å²	37.9	14%	0.144	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-19.9	-176.7	64.4	-179	0	0	0	114.6	L88 V104 A108 L136 A139 C141	L88-I110 HydrophobicContact CD2-CG2 4.2Å; V104-I110 HydrophobicContact CG1-CG2 4.3Å; V104-I110 HydrophobicContact CG2-CG2 3.64Å; A108-I110 PolarHBondContact O-N 2.9Å; I110-L136 HydrophobicContact CG2-CD2 4.46Å; I110-A139 HydrophobicContact CD1-CB 4.5Å; I110-C141 HydrophobicContact CD1-CB 3.96Å
111	I	92.4	Very high	92.5	Very high	90 Å²	90	38 Å²	38	46%	0.462	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-2.5	-177.2	60.1	157.3	0	0	0	113.5	N109 P142 L145	N109-I111 VanDerWaalsContact C-N 3.32Å; N109-I111 PolarHBondContact O-N 3.46Å; N109-I111 WeakPolarHBondContact OD1-CG1 3.29Å; N109-I111 PolarHBondContact OD1-N 3.25Å; N109-I111 VanDerWaalsContact OD1-N 3.13Å; I111-P142 HydrophobicContact CG2-CG 4.3Å; I111-L145 HydrophobicContact CG2-CD1 4.41Å
112	L	92.9	Very high	92.6	Very high	52 Å²	52	37 Å²	37	27%	0.272	21%	0.21	S	C	.	.			trans	-66.1	139.4	176.3	-66.6	177.6	0	0	0	110.4	D78 T86 N109	D78-L112 HydrophobicContact CB-CD1 3.62Å; T86-L112 HydrophobicContact CG2-CB 4.27Å; T86-L112 HydrophobicContact CG2-CD1 3.91Å; N109-L112 HydrophobicContact CB-CD1 3.78Å; N109-L112 HydrophobicContact CB-CG 3.79Å
113	S	92.6	Very high	92.7	Very high	58 Å²	58	37.4 Å²	37.4	41%	0.406	21%	0.212	S	C	.	.	B	Isolated β-bridge	trans	-113.3	153.3	176.5	55.6	0	0	0	0	110.9	G117 E118	S113-G117 VanDerWaalsContact CB-C 3.47Å; S113-E118 WeakPolarHBondContact CA-O 3.47Å
114	G	90.5	Very high	92.9	Very high	5 Å²	5	37.4 Å²	37.4	5%	0.052	21%	0.212	C	C	.	.			trans	-70.3	-177	167.2	0	0	0	0	0	112.3	L89 N116 G117 E118	L89-G114 VanDerWaalsContact CD1-N 3.29Å; G114-N116 PolarHBondContact O-N 3.13Å; G114-N116 VanDerWaalsContact O-N 3.13Å; G114-G117 PolarHBondContact O-N 3.3Å; G114-E118 PolarHBondContact N-O 2.92Å
115	D	89.7	Confident	93	Very high	99 Å²	99	36.9 Å²	36.9	53%	0.529	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-28.6	-176.5	-72.8	-16.1	0	0	0	113.4	Q83 G84	Q83-D115 VanDerWaalsContact O-CG 3.29Å; G84-D115 VanDerWaalsContact CA-OD1 3.25Å; G84-D115 WeakPolarHBondContact CA-OD1 3.34Å; G84-D115 PolarHBondContact N-OD2 3.14Å
116	N	89.5	Confident	93.2	Very high	89 Å²	89	35.6 Å²	35.6	48%	0.476	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	15.4	178	-48.4	-54.8	0	0	0	113.6	G114 E118 E148	G114-N116 PolarHBondContact O-N 3.13Å; G114-N116 VanDerWaalsContact O-N 3.13Å; N116-E118 VanDerWaalsContact C-N 3.26Å; N116-E118 HydrophobicContact CB-CG 4.18Å; N116-E118 PolarHBondContact ND2-OE2 3.11Å; N116-E118 PolarHBondContact O-N 2.89Å; N116-E148 WeakPolarHBondContact O-CG 3.43Å; N116-E148 PolarHBondContact O-N 2.94Å; N116-E148 VanDerWaalsContact O-N 3.11Å
117	G	90.9	Very high	93.4	Very high	12 Å²	12	39.2 Å²	39.2	12%	0.124	22%	0.221	C	C	.	.	S	Bend	trans	76.6	10	-173.8	0	0	0	0	0	114.1	S113 G114 T119	S113-G117 VanDerWaalsContact CB-C 3.47Å; G114-G117 PolarHBondContact O-N 3.3Å; G117-T119 PolarHBondContact O-N 3.4Å; G117-T119 VanDerWaalsContact O-N 3.08Å
118	E	91.9	Very high	93.7	Very high	54 Å²	54	37.9 Å²	37.9	25%	0.252	21%	0.208	S	C	.	.			trans	-71.2	103.6	-178.6	-68.3	169	107.5	0	0	111.4	L89 S113 G114 N116 L123	L89-E118 WeakPolarHBondContact CD2-O 3.34Å; S113-E118 WeakPolarHBondContact CA-O 3.47Å; G114-E118 PolarHBondContact N-O 2.92Å; N116-E118 VanDerWaalsContact C-N 3.26Å; N116-E118 HydrophobicContact CB-CG 4.18Å; N116-E118 PolarHBondContact ND2-OE2 3.11Å; N116-E118 PolarHBondContact O-N 2.89Å; E118-L123 HydrophobicContact CB-CD1 4.43Å; E118-L123 HydrophobicContact CB-CD2 4.12Å; E118-L123 HydrophobicContact CB-CG 4.18Å; E118-L123 HydrophobicContact CG-CD2 4.44Å
119	T	94.9	Very high	93.9	Very high	6 Å²	6	40.1 Å²	40.1	4%	0.037	22%	0.217	C	C	.	.	B	Isolated β-bridge	trans	-82.7	161.9	173.5	65	0	0	0	0	111.6	G117 L121 L122 L123 L145	G117-T119 PolarHBondContact O-N 3.4Å; G117-T119 VanDerWaalsContact O-N 3.08Å; T119-L121 PolarHBondContact O-N 3.08Å; T119-L122 PolarHBondContact O-N 3.05Å; T119-L122 VanDerWaalsContact O-N 3.09Å; T119-L122 WeakPolarHBondContact OG1-CG 3.12Å; T119-L123 PolarHBondContact O-N 3.47Å; T119-L145 HydrophobicContact CG2-CB 4.12Å; T119-L145 HydrophobicContact CG2-CD1 3.97Å
120	G	95	Very high	94.1	Very high	2 Å²	2	41 Å²	41	2%	0.021	22%	0.218	C	C	.	.	H	α-helix	trans	-57.9	-33.8	179.4	0	0	0	0	0	112.9	A124	G120-A124 VanDerWaalsContact O-CB 3.29Å; G120-A124 WeakPolarHBondContact O-CB 3.32Å; G120-A124 PolarHBondContact O-N 3.09Å
121	L	96.6	Very high	94.2	Very high	1 Å²	1	44 Å²	44	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-66.9	-44.5	176.8	-171.1	68.1	0	0	0	111.6	T119 A124 A125 V133 L136 L137 A153 L169	T119-L121 PolarHBondContact O-N 3.08Å; L121-A124 PolarHBondContact O-N 3.18Å; L121-A125 WeakPolarHBondContact O-CB 3.37Å; L121-A125 PolarHBondContact O-N 3.04Å; L121-V133 HydrophobicContact CD1-CB 4.42Å; L121-V133 HydrophobicContact CD1-CG1 3.76Å; L121-L136 HydrophobicContact CB-CD1 4.41Å; L121-L136 HydrophobicContact CD1-CB 4.3Å; L121-L136 HydrophobicContact CD1-CD1 4.41Å; L121-L137 HydrophobicContact CD1-CD2 4.21Å; L121-L137 HydrophobicContact CD1-CG 4.2Å; L121-L137 HydrophobicContact CD2-CD2 4.25Å; L121-A153 HydrophobicContact CD2-CB 4.09Å; L121-A153 HydrophobicContact CG-CB 3.95Å; L121-L169 HydrophobicContact CD2-CD2 4.48Å
122	L	95.9	Very high	94.5	Very high	5 Å²	5	39.8 Å²	39.8	3%	0.026	21%	0.213	C	C	.	.	H	α-helix	trans	-61.7	-48.2	177.7	-66.3	171.3	0	0	0	111.3	T119 A124 A125 S126 D147 N151 A153 F156	T119-L122 PolarHBondContact O-N 3.05Å; T119-L122 VanDerWaalsContact O-N 3.09Å; T119-L122 WeakPolarHBondContact OG1-CG 3.12Å; L122-A124 PolarHBondContact O-N 3.37Å; L122-A125 PolarHBondContact O-N 3.38Å; L122-S126 VanDerWaalsContact O-CB 3.27Å; L122-S126 WeakPolarHBondContact O-CB 3.37Å; L122-S126 PolarHBondContact O-N 3.14Å; L122-D147 HydrophobicContact CD1-CB 4.01Å; L122-N151 WeakPolarHBondContact CD2-O 3.46Å; L122-A153 HydrophobicContact CD2-CB 4.09Å; L122-F156 HydrophobicContact CD2-CD2 3.81Å; L122-F156 HydrophobicContact CD2-CE2 3.96Å
123	L	95.9	Very high	94.7	Very high	9 Å²	9	37.3 Å²	37.3	5%	0.047	20%	0.2	C	C	.	.	H	α-helix	trans	-61.3	-45.1	179.4	-68.5	169.9	0	0	0	111.9	F85 L89 A93 E118 T119 R127	F85-L123 HydrophobicContact CD1-CD1 4.42Å; F85-L123 HydrophobicContact CE1-CD1 3.63Å; F85-L123 HydrophobicContact CE1-CD2 4.26Å; F85-L123 HydrophobicContact CZ-CD1 4.19Å; F85-L123 HydrophobicContact CZ-CD2 4.31Å; L89-L123 HydrophobicContact CB-CD1 4Å; L89-L123 HydrophobicContact CD2-CD1 3.92Å; A93-L123 HydrophobicContact CB-CB 4.22Å; A93-L123 HydrophobicContact CB-CD1 4.29Å; E118-L123 HydrophobicContact CB-CD1 4.43Å; E118-L123 HydrophobicContact CB-CD2 4.12Å; E118-L123 HydrophobicContact CB-CG 4.18Å; E118-L123 HydrophobicContact CG-CD2 4.44Å; T119-L123 PolarHBondContact O-N 3.47Å; L123-R127 WeakPolarHBondContact O-CB 3.38Å; L123-R127 WeakPolarHBondContact O-CG 3.44Å; L123-R127 PolarHBondContact O-N 3.22Å
124	A	96.9	Very high	94.9	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-66.7	-43.5	178.5	0	0	0	0	0	112	G120 L121 L122 R127 G128 H129 V132 V133	G120-A124 VanDerWaalsContact O-CB 3.29Å; G120-A124 WeakPolarHBondContact O-CB 3.32Å; G120-A124 PolarHBondContact O-N 3.09Å; L121-A124 PolarHBondContact O-N 3.18Å; L122-A124 PolarHBondContact O-N 3.37Å; A124-R127 PolarHBondContact O-N 3.14Å; A124-G128 PolarHBondContact O-N 3.03Å; A124-H129 HydrophobicContact CB-CB 4.27Å; A124-H129 PolarHBondContact O-N 3.14Å; A124-V132 HydrophobicContact CB-CB 4.09Å; A124-V132 HydrophobicContact CB-CG1 3.72Å; A124-V133 HydrophobicContact CB-CG2 3.72Å
125	A	96.7	Very high	95.2	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-66.8	-43	179.2	0	0	0	0	0	112.5	L121 L122 R127 G128 V133 A153 N162 I165	L121-A125 WeakPolarHBondContact O-CB 3.37Å; L121-A125 PolarHBondContact O-N 3.04Å; L122-A125 PolarHBondContact O-N 3.38Å; A125-R127 PolarHBondContact O-N 2.95Å; A125-G128 PolarHBondContact O-N 3.31Å; A125-V133 HydrophobicContact CB-CG2 4.26Å; A125-A153 HydrophobicContact CB-CB 3.88Å; A125-N162 PolarHBondContact O-ND2 2.93Å; A125-I165 HydrophobicContact CB-CG2 4.12Å
126	S	95	Very high	95.5	Very high	40 Å²	40	32.4 Å²	32.4	28%	0.28	17%	0.166	S	C	.	.	H	α-helix	trans	-63.4	-28.9	176.9	-176.4	0	0	0	0	112.7	L122 N160	L122-S126 VanDerWaalsContact O-CB 3.27Å; L122-S126 WeakPolarHBondContact O-CB 3.37Å; L122-S126 PolarHBondContact O-N 3.14Å; S126-N160 PolarHBondContact O-ND2 2.87Å
127	R	95.3	Very high	95.8	Very high	155 Å²	155	28.6 Å²	28.6	59%	0.585	15%	0.146	S	C	*	.	H	α-helix	trans	-98.9	-3.3	-178.2	-66.4	176.8	179.5	-101	2.3	114	A93 L123 A124 A125	A93-R127 WeakPolarHBondContact O-CD 3.44Å; L123-R127 WeakPolarHBondContact O-CB 3.38Å; L123-R127 WeakPolarHBondContact O-CG 3.44Å; L123-R127 PolarHBondContact O-N 3.22Å; A124-R127 PolarHBondContact O-N 3.14Å; A125-R127 PolarHBondContact O-N 2.95Å
128	G	95.6	Very high	96	Very high	28 Å²	28	35 Å²	35	29%	0.289	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.5	17.4	175.9	0	0	0	0	0	115	A124 A125 F130 N162	A124-G128 PolarHBondContact O-N 3.03Å; A125-G128 PolarHBondContact O-N 3.31Å; G128-F130 VanDerWaalsContact C-N 3.34Å; G128-F130 PolarHBondContact O-N 3.41Å; G128-N162 VanDerWaalsContact CA-ND2 3.35Å; G128-N162 WeakPolarHBondContact CA-ND2 3.3Å
129	H	97.5	Very high	96.1	Very high	53 Å²	53	33 Å²	33	25%	0.245	16%	0.163	C	C	.	.			trans	-81.8	74.2	-176.4	-61.4	-46	0	0	0	112	C92 A93 G95 A124 D131 V132 V133	C92-H129 PolarHBondContact O-CD2 3.15Å; A93-H129 PolarHBondContact O-CD2 3.42Å; A93-H129 PolarHBondContact O-NE2 2.95Å; G95-H129 WeakPolarHBondContact CA-CD2 3.36Å; G95-H129 PolarHBondContact N-CD2 3.34Å; G95-H129 VanDerWaalsContact N-CD2 3.31Å; G95-H129 PolarHBondContact N-NE2 2.89Å; A124-H129 HydrophobicContact CB-CB 4.27Å; A124-H129 PolarHBondContact O-N 3.14Å; H129-D131 VanDerWaalsContact C-N 3.34Å; H129-D131 PolarHBondContact O-N 3.01Å; H129-V132 HydrophobicContact CB-CB 4.12Å; H129-V132 HydrophobicContact CB-CG2 4.2Å; H129-V132 PolarHBondContact O-N 3.19Å; H129-V132 VanDerWaalsContact O-N 3.13Å; H129-V133 WeakPolarHBondContact O-CG2 3.47Å; H129-V133 PolarHBondContact O-N 2.85Å; H129-V133 VanDerWaalsContact O-N 3.09Å
130	F	97.2	Very high	96	Very high	74 Å²	74	35.3 Å²	35.3	33%	0.325	19%	0.188	S	C	.	.	H	α-helix	trans	-50.5	-47.3	-175.1	178.3	-92.1	0	0	0	113.8	G128 V132 V133 L134 A164 I165 L168	G128-F130 VanDerWaalsContact C-N 3.34Å; G128-F130 PolarHBondContact O-N 3.41Å; F130-V132 VanDerWaalsContact C-N 3.29Å; F130-V132 PolarHBondContact O-N 3.17Å; F130-V133 PolarHBondContact O-N 3.44Å; F130-L134 HydrophobicContact CE1-CD2 4.11Å; F130-L134 WeakPolarHBondContact O-CB 3.32Å; F130-L134 PolarHBondContact O-N 2.98Å; F130-A164 HydrophobicContact CD2-CB 4.02Å; F130-A164 HydrophobicContact CE2-CB 4.19Å; F130-I165 HydrophobicContact CB-CG1 4.26Å; F130-I165 HydrophobicContact CD2-CG1 4.06Å; F130-L168 HydrophobicContact CD2-CD2 4.27Å; F130-L168 HydrophobicContact CE2-CB 4.18Å; F130-L168 HydrophobicContact CE2-CD1 3.74Å; F130-L168 HydrophobicContact CE2-CD2 3.95Å; F130-L168 HydrophobicContact CE2-CG 4.21Å; F130-L168 HydrophobicContact CZ-CD1 3.78Å; F130-L168 HydrophobicContact CZ-CD2 4.4Å
131	D	96.5	Very high	95.8	Very high	92 Å²	92	35.6 Å²	35.6	49%	0.492	19%	0.189	S	C	.	.	H	α-helix	trans	-65.4	-33.1	-176.5	-67	-40.3	0	0	0	113	K97 H129 Y135	K97-D131 HydrophobicContact CD-CB 3.95Å; K97-D131 HydrophobicContact CG-CB 4.38Å; H129-D131 VanDerWaalsContact C-N 3.34Å; H129-D131 PolarHBondContact O-N 3.01Å; D131-Y135 WeakPolarHBondContact O-CB 3.1Å; D131-Y135 PolarHBondContact O-N 3.25Å; D131-Y135 VanDerWaalsContact O-N 3.08Å
132	V	97.5	Very high	95.8	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.006	21%	0.209	C	C	.	.	H	α-helix	trans	-71.9	-45.8	176.1	175.8	0	0	0	0	110.2	C92 K97 V100 A124 H129 F130 L134 Y135 L136	C92-V132 HydrophobicContact CB-CG1 4.27Å; K97-V132 HydrophobicContact CB-CG2 4.22Å; V100-V132 HydrophobicContact CG2-CG1 4.16Å; A124-V132 HydrophobicContact CB-CB 4.09Å; A124-V132 HydrophobicContact CB-CG1 3.72Å; H129-V132 HydrophobicContact CB-CB 4.12Å; H129-V132 HydrophobicContact CB-CG2 4.2Å; H129-V132 PolarHBondContact O-N 3.19Å; H129-V132 VanDerWaalsContact O-N 3.13Å; F130-V132 VanDerWaalsContact C-N 3.29Å; F130-V132 PolarHBondContact O-N 3.17Å; V132-L134 VanDerWaalsContact C-N 3.32Å; V132-L134 PolarHBondContact O-N 3.34Å; V132-Y135 PolarHBondContact O-N 2.75Å; V132-L136 HydrophobicContact CG1-CD1 3.95Å; V132-L136 HydrophobicContact CG1-CG 4.29Å; V132-L136 WeakPolarHBondContact O-CG 3.44Å; V132-L136 PolarHBondContact O-N 2.92Å
133	V	97.5	Very high	95.7	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-56.7	-48.6	175.7	178.2	0	0	0	0	110.2	L121 A124 A125 H129 F130 Y135 L136 L137 I165 L168 L169	L121-V133 HydrophobicContact CD1-CB 4.42Å; L121-V133 HydrophobicContact CD1-CG1 3.76Å; A124-V133 HydrophobicContact CB-CG2 3.72Å; A125-V133 HydrophobicContact CB-CG2 4.26Å; H129-V133 WeakPolarHBondContact O-CG2 3.47Å; H129-V133 PolarHBondContact O-N 2.85Å; H129-V133 VanDerWaalsContact O-N 3.09Å; F130-V133 PolarHBondContact O-N 3.44Å; V133-Y135 VanDerWaalsContact C-N 3.32Å; V133-Y135 PolarHBondContact O-N 2.91Å; V133-L136 PolarHBondContact O-N 3.38Å; V133-L137 HydrophobicContact CG1-CD1 3.91Å; V133-L137 HydrophobicContact CG1-CG 4.42Å; V133-L137 VanDerWaalsContact O-CG 3.32Å; V133-L137 WeakPolarHBondContact O-CG 3.24Å; V133-L137 PolarHBondContact O-N 3.08Å; V133-I165 HydrophobicContact CG1-CG2 4.3Å; V133-I165 HydrophobicContact CG2-CD1 4.35Å; V133-I165 HydrophobicContact CG2-CG2 4.39Å; V133-L168 HydrophobicContact CB-CD2 4.23Å; V133-L168 HydrophobicContact CG1-CD2 3.75Å; V133-L169 HydrophobicContact CG1-CD2 4.19Å
134	L	96.9	Very high	95.6	Very high	37 Å²	37	42.4 Å²	42.4	19%	0.194	23%	0.23	C	C	.	.	H	α-helix	trans	-57.3	-44.2	177.6	176.3	59	0	0	0	112.4	F130 V132 K138 L168 W172	F130-L134 HydrophobicContact CE1-CD2 4.11Å; F130-L134 WeakPolarHBondContact O-CB 3.32Å; F130-L134 PolarHBondContact O-N 2.98Å; V132-L134 VanDerWaalsContact C-N 3.32Å; V132-L134 PolarHBondContact O-N 3.34Å; L134-K138 HydrophobicContact CD1-CD 4.21Å; L134-K138 HydrophobicContact CD1-CG 4.44Å; L134-K138 HydrophobicContact CG-CD 4.38Å; L134-K138 WeakPolarHBondContact O-CB 3.48Å; L134-K138 WeakPolarHBondContact O-CG 3.33Å; L134-K138 PolarHBondContact O-N 2.91Å; L134-K138 VanDerWaalsContact O-N 3.11Å; L134-L168 HydrophobicContact CB-CD2 4.07Å; L134-L168 HydrophobicContact CD1-CD1 4.16Å; L134-W172 HydrophobicContact CD1-CH2 3.22Å; L134-W172 HydrophobicContact CD1-CZ2 3.66Å; L134-W172 HydrophobicContact CD1-CZ3 4.32Å
135	Y	96.3	Very high	95.5	Very high	22 Å²	22	44.4 Å²	44.4	9%	0.086	24%	0.241	C	C	.	.	H	α-helix	trans	-66.3	-46.3	178.6	179.3	-98.8	0	0	0	112	V7 V100 E101 V104 D131 V132 V133 L137 K138 A139	V7-Y135 HydrophobicContact CG1-CE2 3.8Å; V100-Y135 HydrophobicContact CG1-CD1 3.76Å; V100-Y135 HydrophobicContact CG1-CE1 4.01Å; E101-Y135 HydrophobicContact CB-CE1 4.46Å; E101-Y135 HydrophobicContact CB-CE2 4.38Å; E101-Y135 HydrophobicContact CG-CD1 4.19Å; E101-Y135 HydrophobicContact CG-CD2 3.74Å; E101-Y135 HydrophobicContact CG-CE1 3.98Å; E101-Y135 HydrophobicContact CG-CE2 3.54Å; E101-Y135 HydrophobicContact CG-CG 4.06Å; V104-Y135 HydrophobicContact CB-CE1 4.04Å; V104-Y135 HydrophobicContact CG1-CE1 4.25Å; V104-Y135 HydrophobicContact CG2-CE1 4.06Å; D131-Y135 WeakPolarHBondContact O-CB 3.1Å; D131-Y135 PolarHBondContact O-N 3.25Å; D131-Y135 VanDerWaalsContact O-N 3.08Å; V132-Y135 PolarHBondContact O-N 2.75Å; V133-Y135 VanDerWaalsContact C-N 3.32Å; V133-Y135 PolarHBondContact O-N 2.91Å; Y135-L137 VanDerWaalsContact C-N 3.34Å; Y135-L137 PolarHBondContact O-N 3.42Å; Y135-K138 CarbonylContact O-C 3.57Å; Y135-K138 PolarHBondContact O-N 3.47Å; Y135-A139 WeakPolarHBondContact O-CB 3.49Å; Y135-A139 PolarHBondContact O-N 3.3Å
136	L	96	Very high	95.4	Very high	1 Å²	1	47 Å²	47	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-59.7	-43.8	179.3	-70.6	173	0	0	0	111.8	V100 I110 L121 V132 V133 A139 G140 C141	V100-L136 HydrophobicContact CG1-CD2 4.09Å; I110-L136 HydrophobicContact CG2-CD2 4.46Å; L121-L136 HydrophobicContact CB-CD1 4.41Å; L121-L136 HydrophobicContact CD1-CB 4.3Å; L121-L136 HydrophobicContact CD1-CD1 4.41Å; V132-L136 HydrophobicContact CG1-CD1 3.95Å; V132-L136 HydrophobicContact CG1-CG 4.29Å; V132-L136 WeakPolarHBondContact O-CG 3.44Å; V132-L136 PolarHBondContact O-N 2.92Å; V133-L136 PolarHBondContact O-N 3.38Å; L136-A139 PolarHBondContact O-N 3.2Å; L136-G140 PolarHBondContact O-N 3.09Å; L136-C141 HydrophobicContact CB-CB 4.15Å; L136-C141 WeakPolarHBondContact O-CB 3.36Å; L136-C141 PolarHBondContact O-N 2.86Å
137	L	96	Very high	95.3	Very high	9 Å²	9	46 Å²	46	5%	0.047	25%	0.251	C	S	.	.	H	α-helix	trans	-63.3	-41.5	176.3	-67.9	171.8	0	0	0	111.7	L121 V133 Y135 A139 G140 V143 L168 L169 W172	L121-L137 HydrophobicContact CD1-CD2 4.21Å; L121-L137 HydrophobicContact CD1-CG 4.2Å; L121-L137 HydrophobicContact CD2-CD2 4.25Å; V133-L137 HydrophobicContact CG1-CD1 3.91Å; V133-L137 HydrophobicContact CG1-CG 4.42Å; V133-L137 VanDerWaalsContact O-CG 3.32Å; V133-L137 WeakPolarHBondContact O-CG 3.24Å; V133-L137 PolarHBondContact O-N 3.08Å; Y135-L137 VanDerWaalsContact C-N 3.34Å; Y135-L137 PolarHBondContact O-N 3.42Å; L137-A139 VanDerWaalsContact C-N 3.29Å; L137-A139 PolarHBondContact O-N 3.27Å; L137-G140 PolarHBondContact O-N 3.31Å; L137-G140 VanDerWaalsContact O-N 3.14Å; L137-V143 HydrophobicContact CD2-CB 4.06Å; L137-V143 HydrophobicContact CD2-CG2 4.05Å; L137-L168 HydrophobicContact CD1-CD2 4.01Å; L137-L168 HydrophobicContact CD1-CG 4.21Å; L137-L169 HydrophobicContact CD1-CD2 4.23Å; L137-W172 HydrophobicContact CB-CD2 4.11Å; L137-W172 HydrophobicContact CB-CG 4.17Å; L137-W172 HydrophobicContact CB-CZ2 4.12Å; L137-W172 HydrophobicContact CD1-CB 4.29Å; L137-W172 HydrophobicContact CD1-CD2 3.7Å; L137-W172 HydrophobicContact CD1-CE3 4.05Å; L137-W172 HydrophobicContact CD1-CG 3.91Å; L137-W172 HydrophobicContact CD2-CB 4.41Å; L137-W172 HydrophobicContact CD2-CG 4.31Å; L137-W172 HydrophobicContact CG-CD2 4.44Å; L137-W172 HydrophobicContact CG-CG 4.36Å
138	K	95.7	Very high	95.2	Very high	146 Å²	146	45.3 Å²	45.3	64%	0.635	25%	0.254	S	S	*	.	H	α-helix	trans	-65.9	-30.4	174	-76.2	178.2	175	177.2	0	113.3	L134 Y135 G140 W172	L134-K138 HydrophobicContact CD1-CD 4.21Å; L134-K138 HydrophobicContact CD1-CG 4.44Å; L134-K138 HydrophobicContact CG-CD 4.38Å; L134-K138 WeakPolarHBondContact O-CB 3.48Å; L134-K138 WeakPolarHBondContact O-CG 3.33Å; L134-K138 PolarHBondContact O-N 2.91Å; L134-K138 VanDerWaalsContact O-N 3.11Å; Y135-K138 CarbonylContact O-C 3.57Å; Y135-K138 PolarHBondContact O-N 3.47Å; K138-G140 PolarHBondContact O-N 3.36Å; K138-W172 HydrophobicContact CG-CZ2 4.3Å
139	A	93.2	Very high	95.1	Very high	11 Å²	11	48.6 Å²	48.6	9%	0.091	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-3.1	175.2	0	0	0	0	0	113.1	V7 V104 I110 Y135 L136 L137	V7-A139 HydrophobicContact CG2-CB 4.19Å; V104-A139 HydrophobicContact CG1-CB 4.39Å; I110-A139 HydrophobicContact CD1-CB 4.5Å; Y135-A139 WeakPolarHBondContact O-CB 3.49Å; Y135-A139 PolarHBondContact O-N 3.3Å; L136-A139 PolarHBondContact O-N 3.2Å; L137-A139 VanDerWaalsContact C-N 3.29Å; L137-A139 PolarHBondContact O-N 3.27Å
140	G	92	Very high	95	Very high	55 Å²	55	48.9 Å²	48.9	57%	0.567	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.3	20.6	178.8	0	0	0	0	0	114	L136 L137 K138	L136-G140 PolarHBondContact O-N 3.09Å; L137-G140 PolarHBondContact O-N 3.31Å; L137-G140 VanDerWaalsContact O-N 3.14Å; K138-G140 PolarHBondContact O-N 3.36Å
141	C	92.7	Very high	94.9	Very high	8 Å²	8	46 Å²	46	5%	0.054	26%	0.259	C	S	.	.			trans	-63.8	128.1	172	-168.3	0	0	0	0	109.8	I110 L136 V143	I110-C141 HydrophobicContact CD1-CB 3.96Å; L136-C141 HydrophobicContact CB-CB 4.15Å; L136-C141 WeakPolarHBondContact O-CB 3.36Å; L136-C141 PolarHBondContact O-N 2.86Å; C141-V143 PolarHBondContact O-N 3.38Å
142	P	94.9	Very high	94.9	Very high	64 Å²	64	41.9 Å²	41.9	42%	0.416	24%	0.238	S	C	.	.			trans	-58.7	134	173.2	-19.1	29.3	0	0	0	111.1	I111 L145	I111-P142 HydrophobicContact CG2-CG 4.3Å; P142-L145 HydrophobicContact CB-CD1 4.46Å; P142-L145 HydrophobicContact CB-CD2 4.15Å; P142-L145 HydrophobicContact CB-CG 4.02Å; P142-L145 HydrophobicContact CG-CD1 4.49Å; P142-L145 HydrophobicContact CG-CD2 4.35Å; P142-L145 HydrophobicContact CG-CG 4.45Å; P142-L145 WeakPolarHBondContact O-CG 3.4Å
143	V	95.4	Very high	94.9	Very high	19 Å²	19	41.9 Å²	41.9	12%	0.115	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-30.5	-174.3	65.7	0	0	0	0	112.9	L137 C141 L145 L169 A174	L137-V143 HydrophobicContact CD2-CB 4.06Å; L137-V143 HydrophobicContact CD2-CG2 4.05Å; C141-V143 PolarHBondContact O-N 3.38Å; V143-L145 VanDerWaalsContact C-N 3.34Å; V143-L145 PolarHBondContact O-N 3.33Å; V143-L169 HydrophobicContact CG2-CB 4.45Å; V143-L169 HydrophobicContact CG2-CD2 3.74Å; V143-A174 HydrophobicContact CG2-CB 3.68Å
144	D	93.5	Very high	94.8	Very high	76 Å²	76	42 Å²	42	41%	0.406	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	21.6	-174.1	-57.3	-50.6	0	0	0	113.8	A174 D175	D144-A174 WeakPolarHBondContact OD1-CA 3.37Å; D144-D175 PolarHBondContact OD1-N 2.9Å
145	L	94	Very high	94.8	Very high	42 Å²	42	40.2 Å²	40.2	22%	0.22	23%	0.229	C	C	.	.			trans	-62.9	140.2	170.5	-63.2	175.6	0	0	0	109.8	I111 T119 P142 V143	I111-L145 HydrophobicContact CG2-CD1 4.41Å; T119-L145 HydrophobicContact CG2-CB 4.12Å; T119-L145 HydrophobicContact CG2-CD1 3.97Å; P142-L145 HydrophobicContact CB-CD1 4.46Å; P142-L145 HydrophobicContact CB-CD2 4.15Å; P142-L145 HydrophobicContact CB-CG 4.02Å; P142-L145 HydrophobicContact CG-CD1 4.49Å; P142-L145 HydrophobicContact CG-CD2 4.35Å; P142-L145 HydrophobicContact CG-CG 4.45Å; P142-L145 WeakPolarHBondContact O-CG 3.4Å; V143-L145 VanDerWaalsContact C-N 3.34Å; V143-L145 PolarHBondContact O-N 3.33Å
146	S	94.2	Very high	94.8	Very high	54 Å²	54	41.3 Å²	41.3	38%	0.378	23%	0.234	S	C	.	.	B	Isolated β-bridge	trans	-128.5	156	-178.8	56.3	0	0	0	0	112.3	N151	S146-N151 VanDerWaalsContact CA-O 3.24Å; S146-N151 WeakPolarHBondContact CA-O 3.46Å
147	D	94.1	Very high	94.9	Very high	20 Å²	20	41.3 Å²	41.3	11%	0.107	23%	0.234	C	C	.	.			trans	-77	-177.7	170.8	68	7.1	0	0	0	111.5	L122 L149 C150 N151 F156	L122-D147 HydrophobicContact CD1-CB 4.01Å; D147-L149 PolarHBondContact O-N 3.06Å; D147-L149 VanDerWaalsContact O-N 3.14Å; D147-L149 VanDerWaalsContact OD1-C 3.3Å; D147-L149 WeakPolarHBondContact OD1-CA 3.39Å; D147-L149 WeakPolarHBondContact OD1-CB 3.22Å; D147-L149 PolarHBondContact OD1-N 3.35Å; D147-C150 PolarHBondContact O-N 3.13Å; D147-C150 PolarHBondContact OD1-N 3.26Å; D147-C150 VanDerWaalsContact OD1-N 3.14Å; D147-N151 PolarHBondContact N-O 3.38Å; D147-N151 VanDerWaalsContact N-O 3.15Å; D147-N151 WeakPolarHBondContact OD1-CB 3.46Å; D147-N151 PolarHBondContact OD1-N 2.96Å; D147-N151 PolarHBondContact OD1-ND2 3Å; D147-N151 WeakPolarHBondContact OD2-CB 3.27Å; D147-N151 PolarHBondContact OD2-ND2 2.85Å; D147-F156 WeakPolarHBondContact OD2-CZ 3.39Å
148	E	93.2	Very high	94.9	Very high	140 Å²	140	40.9 Å²	40.9	65%	0.654	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-20.7	176.6	-75.5	-174.3	157.6	0	0	114.3	N116 C150	N116-E148 WeakPolarHBondContact O-CG 3.43Å; N116-E148 PolarHBondContact O-N 2.94Å; N116-E148 VanDerWaalsContact O-N 3.11Å; E148-C150 VanDerWaalsContact C-N 3.3Å
149	L	93.2	Very high	94.9	Very high	97 Å²	97	38.2 Å²	38.2	51%	0.508	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	11.5	176	-62.7	178.3	0	0	0	112.1	D147 N151 N180 A181	D147-L149 PolarHBondContact O-N 3.06Å; D147-L149 VanDerWaalsContact O-N 3.14Å; D147-L149 VanDerWaalsContact OD1-C 3.3Å; D147-L149 WeakPolarHBondContact OD1-CA 3.39Å; D147-L149 WeakPolarHBondContact OD1-CB 3.22Å; D147-L149 PolarHBondContact OD1-N 3.35Å; L149-N151 VanDerWaalsContact CB-ND2 3.33Å; L149-N151 WeakPolarHBondContact CB-ND2 3.35Å; L149-N151 PolarHBondContact O-N 2.98Å; L149-N180 WeakPolarHBondContact O-CB 3.32Å; L149-A181 WeakPolarHBondContact O-CB 3.47Å; L149-A181 PolarHBondContact O-N 3.01Å
150	C	94.7	Very high	95	Very high	59 Å²	59	40.5 Å²	40.5	40%	0.399	23%	0.229	S	C	.	.			trans	59.2	23.2	-175.1	-61.3	0	0	0	0	113.8	D147 E148	D147-C150 PolarHBondContact O-N 3.13Å; D147-C150 PolarHBondContact OD1-N 3.26Å; D147-C150 VanDerWaalsContact OD1-N 3.14Å; E148-C150 VanDerWaalsContact C-N 3.3Å
151	N	95.7	Very high	95.1	Very high	12 Å²	12	41 Å²	41	6%	0.064	22%	0.219	C	C	.	.			trans	-79.5	125.8	174.5	-56.4	-55.9	0	0	0	110.2	L122 S146 D147 L149 M155 F156 N180	L122-N151 WeakPolarHBondContact CD2-O 3.46Å; S146-N151 VanDerWaalsContact CA-O 3.24Å; S146-N151 WeakPolarHBondContact CA-O 3.46Å; D147-N151 PolarHBondContact N-O 3.38Å; D147-N151 VanDerWaalsContact N-O 3.15Å; D147-N151 WeakPolarHBondContact OD1-CB 3.46Å; D147-N151 PolarHBondContact OD1-N 2.96Å; D147-N151 PolarHBondContact OD1-ND2 3Å; D147-N151 WeakPolarHBondContact OD2-CB 3.27Å; D147-N151 PolarHBondContact OD2-ND2 2.85Å; L149-N151 VanDerWaalsContact CB-ND2 3.33Å; L149-N151 WeakPolarHBondContact CB-ND2 3.35Å; L149-N151 PolarHBondContact O-N 2.98Å; N151-M155 HydrophobicContact CB-SD 4.31Å; N151-F156 HydrophobicContact CB-CD2 4.28Å; N151-F156 HydrophobicContact CB-CE2 3.55Å; N151-F156 HydrophobicContact CB-CZ 3.76Å; N151-N180 VanDerWaalsContact OD1-CB 3.3Å; N151-N180 WeakPolarHBondContact OD1-CB 3.41Å; N151-N180 PolarHBondContact OD1-ND2 3.15Å
152	T	96.5	Very high	95.3	Very high	7 Å²	7	42.8 Å²	42.8	4%	0.043	23%	0.228	C	C	.	.	B	Isolated β-bridge	trans	-90.7	166.3	177.2	63.8	0	0	0	0	111.9	L154 M155 F156	T152-L154 PolarHBondContact O-N 2.95Å; T152-M155 WeakPolarHBondContact O-CB 3.33Å; T152-M155 PolarHBondContact O-N 3.43Å; T152-F156 WeakPolarHBondContact O-CD2 3.45Å; T152-F156 PolarHBondContact O-N 3.17Å
153	A	96.5	Very high	95.3	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-58.6	-32.4	176.4	0	0	0	0	0	111.8	L121 L122 A125 F156 A157 L169	L121-A153 HydrophobicContact CD2-CB 4.09Å; L121-A153 HydrophobicContact CG-CB 3.95Å; L122-A153 HydrophobicContact CD2-CB 4.09Å; A125-A153 HydrophobicContact CB-CB 3.88Å; A153-F156 PolarHBondContact O-N 3Å; A153-A157 VanDerWaalsContact O-CB 3.3Å; A153-A157 WeakPolarHBondContact O-CB 3.42Å; A153-A157 PolarHBondContact O-N 2.97Å; A153-L169 VanDerWaalsContact C-CD1 3.49Å; A153-L169 HydrophobicContact CB-CD1 3.88Å; A153-L169 HydrophobicContact CB-CD2 4.1Å
154	L	97.1	Very high	95.4	Very high	2 Å²	2	43 Å²	43	1%	0.01	24%	0.237	C	C	.	.	H	α-helix	trans	-65.9	-40.8	177.2	-175	64.1	0	0	0	111.3	T152 A157 A158 V166 L169 L170 A174 I176 A186	T152-L154 PolarHBondContact O-N 2.95Å; L154-A157 PolarHBondContact O-N 3.06Å; L154-A158 WeakPolarHBondContact O-CB 3.39Å; L154-A158 PolarHBondContact O-N 3.22Å; L154-V166 HydrophobicContact CD1-CB 4.47Å; L154-V166 HydrophobicContact CD1-CG1 3.99Å; L154-L169 HydrophobicContact CB-CD1 4.29Å; L154-L169 HydrophobicContact CD1-CB 4.16Å; L154-L169 HydrophobicContact CD1-CD1 4.44Å; L154-L170 HydrophobicContact CD1-CD2 4.08Å; L154-L170 HydrophobicContact CD1-CG 4.17Å; L154-L170 HydrophobicContact CD2-CD2 3.92Å; L154-A174 HydrophobicContact CB-CB 4.4Å; L154-A174 HydrophobicContact CD2-CB 4.13Å; L154-I176 HydrophobicContact CD2-CG1 4.25Å; L154-A186 HydrophobicContact CB-CB 4.43Å; L154-A186 HydrophobicContact CD2-CB 3.94Å; L154-A186 HydrophobicContact CG-CB 3.72Å
155	M	97	Very high	95.6	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-63.8	-46	176.7	-65.1	174.1	-174.7	0	0	111.8	N151 T152 A158 Y159 S178 N180 W184 A186 F189	N151-M155 HydrophobicContact CB-SD 4.31Å; T152-M155 WeakPolarHBondContact O-CB 3.33Å; T152-M155 PolarHBondContact O-N 3.43Å; M155-A158 PolarHBondContact O-N 3.43Å; M155-Y159 WeakPolarHBondContact O-CB 3.35Å; M155-Y159 PolarHBondContact O-N 3.11Å; M155-S178 WeakPolarHBondContact CE-O 3.47Å; M155-N180 HydrophobicContact CE-CB 4.17Å; M155-N180 HydrophobicContact SD-CB 3.84Å; M155-W184 WeakPolarHBondContact CE-O 3.23Å; M155-A186 HydrophobicContact CG-CB 4.07Å; M155-F189 HydrophobicContact CB-CD2 3.99Å; M155-F189 HydrophobicContact CB-CE2 4.14Å; M155-F189 HydrophobicContact CB-CG 4.38Å; M155-F189 HydrophobicContact CG-CD2 4.11Å; M155-F189 HydrophobicContact CG-CE2 4.24Å; M155-F189 HydrophobicContact SD-CD2 4.42Å; M155-F189 HydrophobicContact SD-CE2 3.99Å
156	F	95.9	Very high	95.8	Very high	46 Å²	46	37.6 Å²	37.6	20%	0.202	21%	0.208	C	C	.	.	H	α-helix	trans	-64.9	-41.3	176.5	-74.7	-64.5	0	0	0	112.8	L122 D147 N151 T152 A153 A158 Y159 N160	L122-F156 HydrophobicContact CD2-CD2 3.81Å; L122-F156 HydrophobicContact CD2-CE2 3.96Å; D147-F156 WeakPolarHBondContact OD2-CZ 3.39Å; N151-F156 HydrophobicContact CB-CD2 4.28Å; N151-F156 HydrophobicContact CB-CE2 3.55Å; N151-F156 HydrophobicContact CB-CZ 3.76Å; T152-F156 WeakPolarHBondContact O-CD2 3.45Å; T152-F156 PolarHBondContact O-N 3.17Å; A153-F156 PolarHBondContact O-N 3Å; F156-A158 VanDerWaalsContact C-N 3.35Å; F156-Y159 PolarHBondContact O-N 2.83Å; F156-N160 PolarHBondContact O-N 3.11Å; F156-N160 PolarHBondContact O-ND2 2.95Å
157	A	96.6	Very high	95.9	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-64.2	-41.4	176.4	0	0	0	0	0	111.6	A153 L154 N160 N161 N162 I165 V166 L169	A153-A157 VanDerWaalsContact O-CB 3.3Å; A153-A157 WeakPolarHBondContact O-CB 3.42Å; A153-A157 PolarHBondContact O-N 2.97Å; L154-A157 PolarHBondContact O-N 3.06Å; A157-N160 PolarHBondContact O-N 2.92Å; A157-N161 PolarHBondContact O-N 3.37Å; A157-N162 HydrophobicContact CB-CB 4.49Å; A157-N162 PolarHBondContact O-N 2.94Å; A157-I165 HydrophobicContact CB-CB 4.16Å; A157-I165 HydrophobicContact CB-CG2 3.69Å; A157-V166 HydrophobicContact CB-CG2 3.74Å; A157-L169 HydrophobicContact CB-CD1 4.1Å
158	A	96.6	Very high	96	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-65.9	-43.5	176.8	0	0	0	0	0	112.2	L154 M155 F156 N160 N161 V166 A186 A190 S195 I202	L154-A158 WeakPolarHBondContact O-CB 3.39Å; L154-A158 PolarHBondContact O-N 3.22Å; M155-A158 PolarHBondContact O-N 3.43Å; F156-A158 VanDerWaalsContact C-N 3.35Å; A158-N160 PolarHBondContact O-N 3.5Å; A158-N161 PolarHBondContact O-N 2.9Å; A158-V166 HydrophobicContact CB-CG2 4.44Å; A158-A186 HydrophobicContact CB-CB 4.33Å; A158-A186 WeakPolarHBondContact CB-O 3.44Å; A158-A190 HydrophobicContact CB-CB 4.25Å; A158-S195 WeakPolarHBondContact O-CB 3.18Å; A158-S195 PolarHBondContact O-OG 3.28Å; A158-I202 HydrophobicContact CB-CD1 3.9Å
159	Y	95.6	Very high	96.2	Very high	91 Å²	91	30.2 Å²	30.2	36%	0.357	17%	0.173	S	C	.	.	H	α-helix	trans	-58.6	-46.8	175.1	-176.5	-99.5	0	0	0	111.4	M155 F156 N161 F189 R193 S195	M155-Y159 WeakPolarHBondContact O-CB 3.35Å; M155-Y159 PolarHBondContact O-N 3.11Å; F156-Y159 PolarHBondContact O-N 2.83Å; Y159-N161 PolarHBondContact O-N 3.19Å; Y159-F189 AromaticContact CD2-CD1 3.75Å; Y159-F189 HydrophobicContact CD2-CD1 3.75Å; Y159-F189 HydrophobicContact CD2-CE1 4.5Å; Y159-F189 HydrophobicContact CG-CD1 4.17Å; Y159-R193 HydrophobicContact CD2-CB 3.95Å; Y159-R193 HydrophobicContact CD2-CG 4.25Å; Y159-R193 VanDerWaalsContact CE1-NH1 3.32Å; Y159-R193 HydrophobicContact CE2-CB 4.1Å; Y159-R193 HydrophobicContact CE2-CG 4.22Å; Y159-R193 VanDerWaalsContact CZ-NH1 3.28Å; Y159-R193 WeakPolarHBondContact O-CG 3.47Å; Y159-R193 PolarHBondContact OH-NH1 3.47Å; Y159-S195 PolarHBondContact O-OG 3.05Å; Y159-S195 VanDerWaalsContact O-OG 3.1Å
160	N	95.3	Very high	96.3	Very high	58 Å²	58	26 Å²	26	31%	0.31	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	4.4	-178.8	-67.4	-58.8	0	0	0	114.4	S126 F156 A157 A158 N162	S126-N160 PolarHBondContact O-ND2 2.87Å; F156-N160 PolarHBondContact O-N 3.11Å; F156-N160 PolarHBondContact O-ND2 2.95Å; A157-N160 PolarHBondContact O-N 2.92Å; A158-N160 PolarHBondContact O-N 3.5Å; N160-N162 PolarHBondContact O-N 3.24Å
161	N	95.1	Very high	96.3	Very high	66 Å²	66	28.8 Å²	28.8	35%	0.353	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.5	31.9	-176.5	-162.6	37	0	0	0	114.3	A157 A158 Y159 A163 S195 A197 S198	A157-N161 PolarHBondContact O-N 3.37Å; A158-N161 PolarHBondContact O-N 2.9Å; Y159-N161 PolarHBondContact O-N 3.19Å; N161-A163 VanDerWaalsContact C-N 3.27Å; N161-A163 PolarHBondContact O-N 3.46Å; N161-S195 WeakPolarHBondContact CB-OG 3.48Å; N161-S195 VanDerWaalsContact OD1-C 3.29Å; N161-S195 WeakPolarHBondContact OD1-CA 3.46Å; N161-S195 WeakPolarHBondContact OD1-CB 3.23Å; N161-S195 PolarHBondContact OD1-O 3.43Å; N161-A197 PolarHBondContact OD1-N 3.45Å; N161-S198 VanDerWaalsContact CA-OG 3.3Å; N161-S198 WeakPolarHBondContact CA-OG 3.49Å; N161-S198 PolarHBondContact OD1-N 2.92Å; N161-S198 PolarHBondContact OD1-OG 3.15Å
162	N	96	Very high	96.3	Very high	45 Å²	45	33 Å²	33	24%	0.241	18%	0.177	C	C	.	.			trans	-81.3	71.4	179.5	-72	-30.3	0	0	0	110.8	A125 G128 A157 N160 A164 I165 V166	A125-N162 PolarHBondContact O-ND2 2.93Å; G128-N162 VanDerWaalsContact CA-ND2 3.35Å; G128-N162 WeakPolarHBondContact CA-ND2 3.3Å; A157-N162 HydrophobicContact CB-CB 4.49Å; A157-N162 PolarHBondContact O-N 2.94Å; N160-N162 PolarHBondContact O-N 3.24Å; N162-A164 PolarHBondContact O-N 2.96Å; N162-A164 VanDerWaalsContact O-N 3.12Å; N162-I165 HydrophobicContact CB-CB 4.11Å; N162-I165 HydrophobicContact CB-CD1 4.17Å; N162-I165 HydrophobicContact CB-CG1 4.34Å; N162-I165 PolarHBondContact O-N 3.46Å; N162-V166 WeakPolarHBondContact O-CG2 3.4Å; N162-V166 PolarHBondContact O-N 3.22Å
163	A	95.6	Very high	96.2	Very high	28 Å²	28	35.1 Å²	35.1	23%	0.231	20%	0.2	C	C	.	.	H	α-helix	trans	-51.5	-37.9	-174.8	0	0	0	0	0	114.3	N161 V166 S167 A197 I201	N161-A163 VanDerWaalsContact C-N 3.27Å; N161-A163 PolarHBondContact O-N 3.46Å; A163-V166 PolarHBondContact O-N 2.92Å; A163-S167 PolarHBondContact O-N 3.33Å; A163-A197 HydrophobicContact CB-CB 3.97Å; A163-I201 HydrophobicContact CB-CD1 3.66Å; A163-I201 WeakPolarHBondContact O-CD1 3.47Å
164	A	97	Very high	96.1	Very high	61 Å²	61	35.6 Å²	35.6	50%	0.504	20%	0.204	S	C	.	.	H	α-helix	trans	-65.2	-42.8	177.1	0	0	0	0	0	112.3	F130 N162 L168	F130-A164 HydrophobicContact CD2-CB 4.02Å; F130-A164 HydrophobicContact CE2-CB 4.19Å; N162-A164 PolarHBondContact O-N 2.96Å; N162-A164 VanDerWaalsContact O-N 3.12Å; A164-L168 WeakPolarHBondContact O-CB 3.36Å; A164-L168 PolarHBondContact O-N 3.2Å
165	I	97.8	Very high	95.9	Very high	3 Å²	3	38.7 Å²	38.7	2%	0.015	22%	0.221	C	C	.	.	H	α-helix	trans	-71.8	-37.8	177.8	-63.9	178.2	0	0	0	110.5	A125 F130 V133 A157 N162 L168 L169	A125-I165 HydrophobicContact CB-CG2 4.12Å; F130-I165 HydrophobicContact CB-CG1 4.26Å; F130-I165 HydrophobicContact CD2-CG1 4.06Å; V133-I165 HydrophobicContact CG1-CG2 4.3Å; V133-I165 HydrophobicContact CG2-CD1 4.35Å; V133-I165 HydrophobicContact CG2-CG2 4.39Å; A157-I165 HydrophobicContact CB-CB 4.16Å; A157-I165 HydrophobicContact CB-CG2 3.69Å; N162-I165 HydrophobicContact CB-CB 4.11Å; N162-I165 HydrophobicContact CB-CD1 4.17Å; N162-I165 HydrophobicContact CB-CG1 4.34Å; N162-I165 PolarHBondContact O-N 3.46Å; I165-L168 WeakPolarHBondContact O-CB 3.29Å; I165-L168 PolarHBondContact O-N 3.1Å; I165-L169 HydrophobicContact CG2-CD1 3.77Å; I165-L169 HydrophobicContact CG2-CG 4.14Å; I165-L169 VanDerWaalsContact O-CG 3.29Å; I165-L169 WeakPolarHBondContact O-CG 3.39Å; I165-L169 PolarHBondContact O-N 3.44Å
166	V	97.4	Very high	95.8	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-58.4	-51.3	173.6	171.9	0	0	0	0	110.3	L154 A157 A158 N162 A163 L168 L169 L170 I201 I202	L154-V166 HydrophobicContact CD1-CB 4.47Å; L154-V166 HydrophobicContact CD1-CG1 3.99Å; A157-V166 HydrophobicContact CB-CG2 3.74Å; A158-V166 HydrophobicContact CB-CG2 4.44Å; N162-V166 WeakPolarHBondContact O-CG2 3.4Å; N162-V166 PolarHBondContact O-N 3.22Å; A163-V166 PolarHBondContact O-N 2.92Å; V166-L168 VanDerWaalsContact C-N 3.28Å; V166-L168 PolarHBondContact O-N 3.19Å; V166-L169 PolarHBondContact O-N 2.73Å; V166-L170 HydrophobicContact CG1-CD1 3.99Å; V166-L170 HydrophobicContact CG1-CG 4.49Å; V166-L170 VanDerWaalsContact O-CG 3.23Å; V166-L170 WeakPolarHBondContact O-CG 3.3Å; V166-L170 PolarHBondContact O-N 3.38Å; V166-I201 HydrophobicContact CG1-CB 4.42Å; V166-I201 HydrophobicContact CG1-CG2 3.98Å; V166-I202 HydrophobicContact CG1-CD1 4.24Å; V166-I202 HydrophobicContact CG1-CG1 3.83Å
167	S	96.4	Very high	95.6	Very high	46 Å²	46	42.4 Å²	42.4	32%	0.322	25%	0.247	S	C	.	.	H	α-helix	trans	-57.2	-44.6	176.1	-166.1	0	0	0	0	111.4	A163 L170 D171	A163-S167 PolarHBondContact O-N 3.33Å; S167-L170 PolarHBondContact O-N 3.46Å; S167-D171 WeakPolarHBondContact O-CB 3.19Å; S167-D171 PolarHBondContact O-N 3.47Å
168	L	97	Very high	95.4	Very high	14 Å²	14	43.3 Å²	43.3	7%	0.073	25%	0.253	C	S	.	.	H	α-helix	trans	-57.9	-52.5	177.9	-160.5	80.5	0	0	0	111.5	F130 V133 L134 L137 A164 I165 V166 L170 D171 W172	F130-L168 HydrophobicContact CD2-CD2 4.27Å; F130-L168 HydrophobicContact CE2-CB 4.18Å; F130-L168 HydrophobicContact CE2-CD1 3.74Å; F130-L168 HydrophobicContact CE2-CD2 3.95Å; F130-L168 HydrophobicContact CE2-CG 4.21Å; F130-L168 HydrophobicContact CZ-CD1 3.78Å; F130-L168 HydrophobicContact CZ-CD2 4.4Å; V133-L168 HydrophobicContact CB-CD2 4.23Å; V133-L168 HydrophobicContact CG1-CD2 3.75Å; L134-L168 HydrophobicContact CB-CD2 4.07Å; L134-L168 HydrophobicContact CD1-CD1 4.16Å; L137-L168 HydrophobicContact CD1-CD2 4.01Å; L137-L168 HydrophobicContact CD1-CG 4.21Å; A164-L168 WeakPolarHBondContact O-CB 3.36Å; A164-L168 PolarHBondContact O-N 3.2Å; I165-L168 WeakPolarHBondContact O-CB 3.29Å; I165-L168 PolarHBondContact O-N 3.1Å; V166-L168 VanDerWaalsContact C-N 3.28Å; V166-L168 PolarHBondContact O-N 3.19Å; L168-L170 VanDerWaalsContact C-N 3.29Å; L168-L170 PolarHBondContact O-N 2.83Å; L168-D171 PolarHBondContact O-N 3.18Å; L168-W172 HydrophobicContact CB-CZ3 4.4Å; L168-W172 HydrophobicContact CD1-CE3 4.04Å; L168-W172 HydrophobicContact CD1-CH2 3.56Å; L168-W172 HydrophobicContact CD1-CZ3 3.08Å; L168-W172 HydrophobicContact CD2-CZ3 4.36Å; L168-W172 HydrophobicContact CG-CE3 3.81Å; L168-W172 HydrophobicContact CG-CH2 3.99Å; L168-W172 HydrophobicContact CG-CZ3 3.34Å; L168-W172 PolarHBondContact O-N 3.12Å; L168-W172 VanDerWaalsContact O-N 3.15Å
169	L	97.2	Very high	95.4	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-61.4	-39.6	-178.7	-68.5	168.9	0	0	0	111.6	L121 V133 L137 V143 A153 L154 A157 I165 V166 W172 G173 A174	L121-L169 HydrophobicContact CD2-CD2 4.48Å; V133-L169 HydrophobicContact CG1-CD2 4.19Å; L137-L169 HydrophobicContact CD1-CD2 4.23Å; V143-L169 HydrophobicContact CG2-CB 4.45Å; V143-L169 HydrophobicContact CG2-CD2 3.74Å; A153-L169 VanDerWaalsContact C-CD1 3.49Å; A153-L169 HydrophobicContact CB-CD1 3.88Å; A153-L169 HydrophobicContact CB-CD2 4.1Å; L154-L169 HydrophobicContact CB-CD1 4.29Å; L154-L169 HydrophobicContact CD1-CB 4.16Å; L154-L169 HydrophobicContact CD1-CD1 4.44Å; A157-L169 HydrophobicContact CB-CD1 4.1Å; I165-L169 HydrophobicContact CG2-CD1 3.77Å; I165-L169 HydrophobicContact CG2-CG 4.14Å; I165-L169 VanDerWaalsContact O-CG 3.29Å; I165-L169 WeakPolarHBondContact O-CG 3.39Å; I165-L169 PolarHBondContact O-N 3.44Å; V166-L169 PolarHBondContact O-N 2.73Å; L169-W172 CarbonylContact O-C 3.59Å; L169-W172 PolarHBondContact O-N 3.37Å; L169-G173 PolarHBondContact O-N 2.98Å; L169-A174 HydrophobicContact CB-CB 3.96Å; L169-A174 WeakPolarHBondContact O-CB 3.38Å; L169-A174 PolarHBondContact O-N 2.83Å
170	L	95.8	Very high	95.3	Very high	9 Å²	9	44.3 Å²	44.3	5%	0.047	26%	0.263	C	S	.	.	H	α-helix	trans	-65.3	-40.5	175.8	-65.1	175.9	0	0	0	112.6	L154 V166 S167 L168 W172 G173 I176 I201 H205	L154-L170 HydrophobicContact CD1-CD2 4.08Å; L154-L170 HydrophobicContact CD1-CG 4.17Å; L154-L170 HydrophobicContact CD2-CD2 3.92Å; V166-L170 HydrophobicContact CG1-CD1 3.99Å; V166-L170 HydrophobicContact CG1-CG 4.49Å; V166-L170 VanDerWaalsContact O-CG 3.23Å; V166-L170 WeakPolarHBondContact O-CG 3.3Å; V166-L170 PolarHBondContact O-N 3.38Å; S167-L170 PolarHBondContact O-N 3.46Å; L168-L170 VanDerWaalsContact C-N 3.29Å; L168-L170 PolarHBondContact O-N 2.83Å; L170-W172 PolarHBondContact O-N 2.97Å; L170-G173 PolarHBondContact O-N 3.28Å; L170-I176 HydrophobicContact CD2-CD1 3.58Å; L170-I176 HydrophobicContact CD2-CG1 3.4Å; L170-I176 VanDerWaalsContact CD2-CG1 3.4Å; L170-I201 HydrophobicContact CD1-CG2 3.82Å; L170-H205 HydrophobicContact CD1-CB 4.09Å
171	D	94.4	Very high	95.3	Very high	117 Å²	117	44.9 Å²	44.9	63%	0.626	28%	0.276	S	S	*	.	H	α-helix	trans	-64.2	-26.7	177	-68.1	-24.3	0	0	0	111.9	S167 L168 G173	S167-D171 WeakPolarHBondContact O-CB 3.19Å; S167-D171 PolarHBondContact O-N 3.47Å; L168-D171 PolarHBondContact O-N 3.18Å; D171-G173 VanDerWaalsContact C-N 3.35Å
172	W	95.7	Very high	95.2	Very high	100 Å²	100	46.2 Å²	46.2	38%	0.379	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	4	172.8	-90.5	-94.2	0	0	0	114.2	L134 L137 K138 L168 L169 L170	L134-W172 HydrophobicContact CD1-CH2 3.22Å; L134-W172 HydrophobicContact CD1-CZ2 3.66Å; L134-W172 HydrophobicContact CD1-CZ3 4.32Å; L137-W172 HydrophobicContact CB-CD2 4.11Å; L137-W172 HydrophobicContact CB-CG 4.17Å; L137-W172 HydrophobicContact CB-CZ2 4.12Å; L137-W172 HydrophobicContact CD1-CB 4.29Å; L137-W172 HydrophobicContact CD1-CD2 3.7Å; L137-W172 HydrophobicContact CD1-CE3 4.05Å; L137-W172 HydrophobicContact CD1-CG 3.91Å; L137-W172 HydrophobicContact CD2-CB 4.41Å; L137-W172 HydrophobicContact CD2-CG 4.31Å; L137-W172 HydrophobicContact CG-CD2 4.44Å; L137-W172 HydrophobicContact CG-CG 4.36Å; K138-W172 HydrophobicContact CG-CZ2 4.3Å; L168-W172 HydrophobicContact CB-CZ3 4.4Å; L168-W172 HydrophobicContact CD1-CE3 4.04Å; L168-W172 HydrophobicContact CD1-CH2 3.56Å; L168-W172 HydrophobicContact CD1-CZ3 3.08Å; L168-W172 HydrophobicContact CD2-CZ3 4.36Å; L168-W172 HydrophobicContact CG-CE3 3.81Å; L168-W172 HydrophobicContact CG-CH2 3.99Å; L168-W172 HydrophobicContact CG-CZ3 3.34Å; L168-W172 PolarHBondContact O-N 3.12Å; L168-W172 VanDerWaalsContact O-N 3.15Å; L169-W172 CarbonylContact O-C 3.59Å; L169-W172 PolarHBondContact O-N 3.37Å; L170-W172 PolarHBondContact O-N 2.97Å
173	G	93.6	Very high	95.1	Very high	52 Å²	52	46.1 Å²	46.1	54%	0.536	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	85	28.1	174.6	0	0	0	0	0	115.2	L169 L170 D171 D175	L169-G173 PolarHBondContact O-N 2.98Å; L170-G173 PolarHBondContact O-N 3.28Å; D171-G173 VanDerWaalsContact C-N 3.35Å; G173-D175 PolarHBondContact O-N 3.32Å
174	A	95.1	Very high	95.1	Very high	10 Å²	10	48.5 Å²	48.5	8%	0.083	30%	0.296	C	S	.	.			trans	-55.4	135	172.2	0	0	0	0	0	112.1	V143 D144 L154 L169 I176	V143-A174 HydrophobicContact CG2-CB 3.68Å; D144-A174 WeakPolarHBondContact OD1-CA 3.37Å; L154-A174 HydrophobicContact CB-CB 4.4Å; L154-A174 HydrophobicContact CD2-CB 4.13Å; L169-A174 HydrophobicContact CB-CB 3.96Å; L169-A174 WeakPolarHBondContact O-CB 3.38Å; L169-A174 PolarHBondContact O-N 2.83Å; A174-I176 PolarHBondContact O-N 3.18Å
175	D	94.1	Very high	95.1	Very high	66 Å²	66	47.1 Å²	47.1	35%	0.353	28%	0.281	S	S	.	.			trans	-72.6	109	178.7	-178.3	15	0	0	0	111.6	D144 G173 T177 S178	D144-D175 PolarHBondContact OD1-N 2.9Å; G173-D175 PolarHBondContact O-N 3.32Å; D175-T177 VanDerWaalsContact C-N 3.26Å; D175-T177 PolarHBondContact O-N 3.34Å; D175-T177 WeakPolarHBondContact OD1-CA 3.3Å; D175-T177 WeakPolarHBondContact OD1-CB 3.42Å; D175-T177 PolarHBondContact OD1-N 3.27Å; D175-T177 PolarHBondContact OD1-OG1 3.3Å; D175-T177 PolarHBondContact OD2-OG1 3.05Å; D175-S178 WeakPolarHBondContact O-CB 3.5Å; D175-S178 PolarHBondContact O-OG 3.15Å; D175-S178 PolarHBondContact OD2-N 2.83Å
176	I	93	Very high	95	Very high	15 Å²	15	47 Å²	47	8%	0.077	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-25.3	178.1	-53	170.5	0	0	0	111.5	L154 L170 A174 S178 I202 H205 I206 L209	L154-I176 HydrophobicContact CD2-CG1 4.25Å; L170-I176 HydrophobicContact CD2-CD1 3.58Å; L170-I176 HydrophobicContact CD2-CG1 3.4Å; L170-I176 VanDerWaalsContact CD2-CG1 3.4Å; A174-I176 PolarHBondContact O-N 3.18Å; I176-S178 VanDerWaalsContact C-N 3.32Å; I176-I202 HydrophobicContact CG2-CG2 3.93Å; I176-H205 HydrophobicContact CD1-CB 4.27Å; I176-H205 WeakPolarHBondContact CD1-CD2 3.13Å; I176-I206 HydrophobicContact CG2-CD1 3.99Å; I176-I206 HydrophobicContact CG2-CG1 3.93Å; I176-L209 HydrophobicContact CD1-CD1 4.13Å
177	T	91.8	Very high	94.9	Very high	110 Å²	110	48.7 Å²	48.7	68%	0.675	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-5.9	-176.6	69.8	0	0	0	0	113.2	D175 I179	D175-T177 VanDerWaalsContact C-N 3.26Å; D175-T177 PolarHBondContact O-N 3.34Å; D175-T177 WeakPolarHBondContact OD1-CA 3.3Å; D175-T177 WeakPolarHBondContact OD1-CB 3.42Å; D175-T177 PolarHBondContact OD1-N 3.27Å; D175-T177 PolarHBondContact OD1-OG1 3.3Å; D175-T177 PolarHBondContact OD2-OG1 3.05Å; T177-I179 PolarHBondContact O-N 3.3Å
178	S	93.5	Very high	94.9	Very high	18 Å²	18	49.3 Å²	49.3	13%	0.126	29%	0.289	C	S	.	.			trans	-56.1	134.2	175	59.4	0	0	0	0	111.1	M155 D175 I176 T185	M155-S178 WeakPolarHBondContact CE-O 3.47Å; D175-S178 WeakPolarHBondContact O-CB 3.5Å; D175-S178 PolarHBondContact O-OG 3.15Å; D175-S178 PolarHBondContact OD2-N 2.83Å; I176-S178 VanDerWaalsContact C-N 3.32Å; S178-T185 WeakPolarHBondContact O-CA 3.34Å
179	I	95.4	Very high	94.7	Very high	106 Å²	106	49.9 Å²	49.9	54%	0.544	29%	0.291	S	S	.	.			trans	-114.8	139.3	175.2	56.2	171	0	0	0	109.7	T177 W184 T185	T177-I179 PolarHBondContact O-N 3.3Å; I179-W184 WeakPolarHBondContact CA-O 3.49Å; I179-T185 HydrophobicContact CG2-CG2 3.76Å
180	N	94.5	Very high	94.7	Very high	7 Å²	7	49.9 Å²	49.9	4%	0.037	29%	0.291	C	S	.	.			trans	-80.1	-178.1	174.6	82.5	-18.5	0	0	0	111.2	L149 N151 M155 D182 G183 W184 F189	L149-N180 WeakPolarHBondContact O-CB 3.32Å; N151-N180 VanDerWaalsContact OD1-CB 3.3Å; N151-N180 WeakPolarHBondContact OD1-CB 3.41Å; N151-N180 PolarHBondContact OD1-ND2 3.15Å; M155-N180 HydrophobicContact CE-CB 4.17Å; M155-N180 HydrophobicContact SD-CB 3.84Å; N180-D182 PolarHBondContact O-N 3.44Å; N180-D182 WeakPolarHBondContact OD1-CA 3.44Å; N180-D182 WeakPolarHBondContact OD1-CB 3.36Å; N180-D182 PolarHBondContact OD1-N 2.98Å; N180-G183 PolarHBondContact O-N 3Å; N180-G183 PolarHBondContact OD1-N 3.1Å; N180-G183 VanDerWaalsContact OD1-N 3.11Å; N180-W184 PolarHBondContact N-O 3.14Å; N180-W184 WeakPolarHBondContact OD1-CB 3.19Å; N180-W184 PolarHBondContact OD1-N 3.36Å; N180-F189 WeakPolarHBondContact ND2-CZ 3.12Å
181	A	94.6	Very high	94.7	Very high	69 Å²	69	53.6 Å²	53.6	57%	0.57	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-25.3	178.7	0	0	0	0	0	113.7	L149 G183	L149-A181 WeakPolarHBondContact O-CB 3.47Å; L149-A181 PolarHBondContact O-N 3.01Å; A181-G183 VanDerWaalsContact C-N 3.33Å
182	D	93.4	Very high	94.6	Very high	95 Å²	95	56.2 Å²	56.2	51%	0.508	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-0.5	176.4	-58.4	-54	0	0	0	113.2	N180 W184	N180-D182 PolarHBondContact O-N 3.44Å; N180-D182 WeakPolarHBondContact OD1-CA 3.44Å; N180-D182 WeakPolarHBondContact OD1-CB 3.36Å; N180-D182 PolarHBondContact OD1-N 2.98Å; D182-W184 HydrophobicContact CB-CD2 3.75Å; D182-W184 HydrophobicContact CB-CE3 3.76Å; D182-W184 HydrophobicContact CB-CG 4.34Å; D182-W184 HydrophobicContact CB-CH2 3.97Å; D182-W184 HydrophobicContact CB-CZ2 3.98Å; D182-W184 HydrophobicContact CB-CZ3 3.86Å; D182-W184 WeakPolarHBondContact OD2-CZ3 3.48Å
183	G	94.5	Very high	94.5	Very high	42 Å²	42	58 Å²	58	43%	0.433	32%	0.318	S	S	.	.	S	Bend	trans	78.7	20.4	-177.2	0	0	0	0	0	114.4	N180 A181	N180-G183 PolarHBondContact O-N 3Å; N180-G183 PolarHBondContact OD1-N 3.1Å; N180-G183 VanDerWaalsContact OD1-N 3.11Å; A181-G183 VanDerWaalsContact C-N 3.33Å
184	W	95.9	Very high	94.5	Very high	79 Å²	79	57.8 Å²	57.8	30%	0.299	32%	0.315	S	S	.	.			trans	-97.8	137.1	-179.9	-60.4	-26.9	0	0	0	112.3	M155 I179 N180 D182 D188 F189	M155-W184 WeakPolarHBondContact CE-O 3.23Å; I179-W184 WeakPolarHBondContact CA-O 3.49Å; N180-W184 PolarHBondContact N-O 3.14Å; N180-W184 WeakPolarHBondContact OD1-CB 3.19Å; N180-W184 PolarHBondContact OD1-N 3.36Å; D182-W184 HydrophobicContact CB-CD2 3.75Å; D182-W184 HydrophobicContact CB-CE3 3.76Å; D182-W184 HydrophobicContact CB-CG 4.34Å; D182-W184 HydrophobicContact CB-CH2 3.97Å; D182-W184 HydrophobicContact CB-CZ2 3.98Å; D182-W184 HydrophobicContact CB-CZ3 3.86Å; D182-W184 WeakPolarHBondContact OD2-CZ3 3.48Å; W184-D188 HydrophobicContact CB-CB 4.03Å; W184-D188 HydrophobicContact CG-CB 4.39Å; W184-F189 HydrophobicContact CB-CD2 4.05Å; W184-F189 HydrophobicContact CB-CE2 3.73Å; W184-F189 HydrophobicContact CE3-CE2 4.15Å; W184-F189 AromaticContact CE3-CZ 3.93Å; W184-F189 HydrophobicContact CE3-CZ 3.93Å
185	T	95.9	Very high	94.5	Very high	32 Å²	32	57.5 Å²	57.5	20%	0.196	31%	0.312	C	S	.	.			trans	-90.3	167	171.5	65.7	0	0	0	0	111.5	S178 I179 L187 D188 F189	S178-T185 WeakPolarHBondContact O-CA 3.34Å; I179-T185 HydrophobicContact CG2-CG2 3.76Å; T185-L187 PolarHBondContact O-N 2.92Å; T185-L187 VanDerWaalsContact O-N 3.15Å; T185-L187 PolarHBondContact OG1-N 3.19Å; T185-D188 WeakPolarHBondContact CB-OD2 3.46Å; T185-D188 PolarHBondContact N-OD2 3.49Å; T185-D188 WeakPolarHBondContact O-CB 3.5Å; T185-D188 PolarHBondContact O-N 2.86Å; T185-D188 PolarHBondContact OG1-N 3.29Å; T185-D188 PolarHBondContact OG1-OD2 2.91Å; T185-F189 WeakPolarHBondContact O-CD2 3.42Å; T185-F189 PolarHBondContact O-N 3.4Å; T185-F189 VanDerWaalsContact O-N 3.14Å
186	A	95.1	Very high	94.6	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-56.2	-30.8	172.4	0	0	0	0	0	113.3	L154 M155 A158 A190 I202	L154-A186 HydrophobicContact CB-CB 4.43Å; L154-A186 HydrophobicContact CD2-CB 3.94Å; L154-A186 HydrophobicContact CG-CB 3.72Å; M155-A186 HydrophobicContact CG-CB 4.07Å; A158-A186 HydrophobicContact CB-CB 4.33Å; A158-A186 WeakPolarHBondContact CB-O 3.44Å; A186-A190 PolarHBondContact O-N 3.39Å; A186-A190 VanDerWaalsContact O-N 3.1Å; A186-I202 HydrophobicContact CB-CD1 4.27Å
187	L	95.4	Very high	94.7	Very high	35 Å²	35	65.5 Å²	65.5	18%	0.183	35%	0.346	C	S	.	.	H	α-helix	trans	-67.7	-41.9	174.6	-177.8	59.8	0	0	0	111.6	T185 F189 A190 I191 Q199 I202 E203 I206	T185-L187 PolarHBondContact O-N 2.92Å; T185-L187 VanDerWaalsContact O-N 3.15Å; T185-L187 PolarHBondContact OG1-N 3.19Å; L187-F189 VanDerWaalsContact C-N 3.32Å; L187-F189 PolarHBondContact O-N 3.12Å; L187-A190 WeakPolarHBondContact O-CB 3.14Å; L187-A190 PolarHBondContact O-N 3.49Å; L187-A190 VanDerWaalsContact O-N 3.15Å; L187-I191 HydrophobicContact CD1-CD1 4.1Å; L187-I191 HydrophobicContact CD1-CG1 4.28Å; L187-I191 HydrophobicContact CG-CD1 3.88Å; L187-I191 HydrophobicContact CG-CG1 4.46Å; L187-I191 WeakPolarHBondContact O-CG1 3.41Å; L187-I191 PolarHBondContact O-N 2.93Å; L187-Q199 HydrophobicContact CD1-CG 3.99Å; L187-I202 HydrophobicContact CB-CG2 4.1Å; L187-I202 HydrophobicContact CD1-CG2 4.16Å; L187-E203 HydrophobicContact CD1-CG 4.01Å; L187-I206 HydrophobicContact CD2-CD1 4.16Å
188	D	96.1	Very high	94.9	Very high	59 Å²	59	60.2 Å²	60.2	32%	0.316	31%	0.314	S	S	.	.	H	α-helix	trans	-61.6	-41.8	176.9	-62.5	-56.6	0	0	0	111.4	W184 T185 A190 I191 R192	W184-D188 HydrophobicContact CB-CB 4.03Å; W184-D188 HydrophobicContact CG-CB 4.39Å; T185-D188 WeakPolarHBondContact CB-OD2 3.46Å; T185-D188 PolarHBondContact N-OD2 3.49Å; T185-D188 WeakPolarHBondContact O-CB 3.5Å; T185-D188 PolarHBondContact O-N 2.86Å; T185-D188 PolarHBondContact OG1-N 3.29Å; T185-D188 PolarHBondContact OG1-OD2 2.91Å; D188-A190 PolarHBondContact O-N 3.16Å; D188-I191 PolarHBondContact O-N 3.19Å; D188-R192 WeakPolarHBondContact O-CB 3.43Å; D188-R192 VanDerWaalsContact O-CG 3.23Å; D188-R192 WeakPolarHBondContact O-CG 3.45Å; D188-R192 PolarHBondContact O-N 3.2Å
189	F	94.8	Very high	95	Very high	26 Å²	26	61.7 Å²	61.7	11%	0.114	32%	0.319	C	S	.	.	H	α-helix	trans	-59.7	-44.8	173.1	-84.2	-90.8	0	0	0	111.9	M155 Y159 N180 W184 T185 L187 R193	M155-F189 HydrophobicContact CB-CD2 3.99Å; M155-F189 HydrophobicContact CB-CE2 4.14Å; M155-F189 HydrophobicContact CB-CG 4.38Å; M155-F189 HydrophobicContact CG-CD2 4.11Å; M155-F189 HydrophobicContact CG-CE2 4.24Å; M155-F189 HydrophobicContact SD-CD2 4.42Å; M155-F189 HydrophobicContact SD-CE2 3.99Å; Y159-F189 AromaticContact CD2-CD1 3.75Å; Y159-F189 HydrophobicContact CD2-CD1 3.75Å; Y159-F189 HydrophobicContact CD2-CE1 4.5Å; Y159-F189 HydrophobicContact CG-CD1 4.17Å; N180-F189 WeakPolarHBondContact ND2-CZ 3.12Å; W184-F189 HydrophobicContact CB-CD2 4.05Å; W184-F189 HydrophobicContact CB-CE2 3.73Å; W184-F189 HydrophobicContact CE3-CE2 4.15Å; W184-F189 AromaticContact CE3-CZ 3.93Å; W184-F189 HydrophobicContact CE3-CZ 3.93Å; T185-F189 WeakPolarHBondContact O-CD2 3.42Å; T185-F189 PolarHBondContact O-N 3.4Å; T185-F189 VanDerWaalsContact O-N 3.14Å; L187-F189 VanDerWaalsContact C-N 3.32Å; L187-F189 PolarHBondContact O-N 3.12Å; F189-R193 PolarHBondContact O-N 2.95Å
190	A	95.4	Very high	95.1	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-62.8	-44.2	177.9	0	0	0	0	0	112.3	A158 A186 L187 D188 G194 S195 Q199 I202	A158-A190 HydrophobicContact CB-CB 4.25Å; A186-A190 PolarHBondContact O-N 3.39Å; A186-A190 VanDerWaalsContact O-N 3.1Å; L187-A190 WeakPolarHBondContact O-CB 3.14Å; L187-A190 PolarHBondContact O-N 3.49Å; L187-A190 VanDerWaalsContact O-N 3.15Å; D188-A190 PolarHBondContact O-N 3.16Å; A190-G194 PolarHBondContact O-N 2.84Å; A190-G194 VanDerWaalsContact O-N 3.1Å; A190-S195 PolarHBondContact O-N 3.1Å; A190-Q199 HydrophobicContact CB-CB 4.06Å; A190-I202 HydrophobicContact CB-CD1 4.46Å
191	I	95.6	Very high	95.1	Very high	87 Å²	87	67.7 Å²	67.7	45%	0.446	34%	0.337	S	S	.	.	H	α-helix	trans	-66	-49.5	180	-68	169.2	0	0	0	110.5	L187 D188 R193 G194 Q199	L187-I191 HydrophobicContact CD1-CD1 4.1Å; L187-I191 HydrophobicContact CD1-CG1 4.28Å; L187-I191 HydrophobicContact CG-CD1 3.88Å; L187-I191 HydrophobicContact CG-CG1 4.46Å; L187-I191 WeakPolarHBondContact O-CG1 3.41Å; L187-I191 PolarHBondContact O-N 2.93Å; D188-I191 PolarHBondContact O-N 3.19Å; I191-R193 VanDerWaalsContact C-N 3.28Å; I191-R193 PolarHBondContact O-N 3.08Å; I191-G194 PolarHBondContact O-N 2.87Å; I191-G194 VanDerWaalsContact O-N 3.08Å; I191-Q199 HydrophobicContact CG1-CG 4.37Å
192	R	94.2	Very high	95.1	Very high	173 Å²	173	64.4 Å²	64.4	65%	0.653	31%	0.31	S	S	*	.	H	α-helix	trans	-59.9	-37.2	-177.6	-75	175.8	68	103.4	0.3	112.7	D188	D188-R192 WeakPolarHBondContact O-CB 3.43Å; D188-R192 VanDerWaalsContact O-CG 3.23Å; D188-R192 WeakPolarHBondContact O-CG 3.45Å; D188-R192 PolarHBondContact O-N 3.2Å
193	R	93.1	Very high	95.2	Very high	138 Å²	138	63.6 Å²	63.6	52%	0.521	30%	0.303	S	S	.	.	H	α-helix	trans	-86.7	-10.9	179.3	-171.2	49.4	-177.4	-106.3	-1.6	113.4	Y159 F189 I191	Y159-R193 HydrophobicContact CD2-CB 3.95Å; Y159-R193 HydrophobicContact CD2-CG 4.25Å; Y159-R193 VanDerWaalsContact CE1-NH1 3.32Å; Y159-R193 HydrophobicContact CE2-CB 4.1Å; Y159-R193 HydrophobicContact CE2-CG 4.22Å; Y159-R193 VanDerWaalsContact CZ-NH1 3.28Å; Y159-R193 WeakPolarHBondContact O-CG 3.47Å; Y159-R193 PolarHBondContact OH-NH1 3.47Å; F189-R193 PolarHBondContact O-N 2.95Å; I191-R193 VanDerWaalsContact C-N 3.28Å; I191-R193 PolarHBondContact O-N 3.08Å
194	G	93.8	Very high	95.2	Very high	47 Å²	47	68.9 Å²	68.9	49%	0.485	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.4	26.5	-175.3	0	0	0	0	0	113.4	A190 I191 R196	A190-G194 PolarHBondContact O-N 2.84Å; A190-G194 VanDerWaalsContact O-N 3.1Å; I191-G194 PolarHBondContact O-N 2.87Å; I191-G194 VanDerWaalsContact O-N 3.08Å; G194-R196 PolarHBondContact O-N 3.41Å
195	S	95.3	Very high	95	Very high	3 Å²	3	67.9 Å²	67.9	2%	0.021	31%	0.313	C	S	.	.			trans	-74.2	67.3	-179	-60.8	0	0	0	0	111.7	A158 Y159 N161 A190 A197 S198 Q199	A158-S195 WeakPolarHBondContact O-CB 3.18Å; A158-S195 PolarHBondContact O-OG 3.28Å; Y159-S195 PolarHBondContact O-OG 3.05Å; Y159-S195 VanDerWaalsContact O-OG 3.1Å; N161-S195 WeakPolarHBondContact CB-OG 3.48Å; N161-S195 VanDerWaalsContact OD1-C 3.29Å; N161-S195 WeakPolarHBondContact OD1-CA 3.46Å; N161-S195 WeakPolarHBondContact OD1-CB 3.23Å; N161-S195 PolarHBondContact OD1-O 3.43Å; A190-S195 PolarHBondContact O-N 3.1Å; S195-A197 VanDerWaalsContact C-N 3.28Å; S195-A197 PolarHBondContact O-N 2.66Å; S195-A197 VanDerWaalsContact O-N 3.16Å; S195-S198 PolarHBondContact O-N 2.83Å; S195-S198 VanDerWaalsContact O-N 3.12Å; S195-Q199 WeakPolarHBondContact O-CB 3.35Å; S195-Q199 PolarHBondContact O-N 2.68Å
196	R	95.2	Very high	94.8	Very high	205 Å²	205	69 Å²	69	77%	0.774	32%	0.317	S	S	*	.	H	α-helix	trans	-54.5	-37.6	-171	-66.8	-177.7	-179	176.9	0	114.4	G194 R200	G194-R196 PolarHBondContact O-N 3.41Å; R196-R200 WeakPolarHBondContact O-CB 3.36Å; R196-R200 PolarHBondContact O-N 2.95Å
197	A	95.9	Very high	94.6	Very high	44 Å²	44	73.7 Å²	73.7	36%	0.364	34%	0.341	S	S	.	.	H	α-helix	trans	-69.5	-45.4	-179	0	0	0	0	0	110.9	N161 A163 S195 R200 I201	N161-A197 PolarHBondContact OD1-N 3.45Å; A163-A197 HydrophobicContact CB-CB 3.97Å; S195-A197 VanDerWaalsContact C-N 3.28Å; S195-A197 PolarHBondContact O-N 2.66Å; S195-A197 VanDerWaalsContact O-N 3.16Å; A197-R200 PolarHBondContact O-N 2.94Å; A197-I201 WeakPolarHBondContact O-CG1 3.29Å; A197-I201 PolarHBondContact O-N 2.76Å; A197-I201 VanDerWaalsContact O-N 3.15Å
198	S	95.2	Very high	94.3	Very high	0 Å²	0	75.1 Å²	75.1	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-66.4	-43.6	177.1	-57.9	0	0	0	0	111.6	N161 S195 R200 I201 I202	N161-S198 VanDerWaalsContact CA-OG 3.3Å; N161-S198 WeakPolarHBondContact CA-OG 3.49Å; N161-S198 PolarHBondContact OD1-N 2.92Å; N161-S198 PolarHBondContact OD1-OG 3.15Å; S195-S198 PolarHBondContact O-N 2.83Å; S195-S198 VanDerWaalsContact O-N 3.12Å; S198-R200 PolarHBondContact O-N 3.35Å; S198-I201 PolarHBondContact O-N 3.3Å; S198-I202 VanDerWaalsContact O-CG1 3.29Å; S198-I202 WeakPolarHBondContact O-CG1 3.35Å; S198-I202 PolarHBondContact O-N 3.43Å
199	Q	95.9	Very high	93.9	Very high	49 Å²	49	76.6 Å²	76.6	23%	0.229	36%	0.362	C	S	.	.	H	α-helix	trans	-53.9	-51.8	173.5	179.5	-176.7	-0.1	0	0	111.1	L187 A190 I191 S195 I201 I202 E203	L187-Q199 HydrophobicContact CD1-CG 3.99Å; A190-Q199 HydrophobicContact CB-CB 4.06Å; I191-Q199 HydrophobicContact CG1-CG 4.37Å; S195-Q199 WeakPolarHBondContact O-CB 3.35Å; S195-Q199 PolarHBondContact O-N 2.68Å; Q199-I201 VanDerWaalsContact C-N 3.29Å; Q199-I201 PolarHBondContact O-N 3.21Å; Q199-I202 PolarHBondContact O-N 3.01Å; Q199-E203 HydrophobicContact CG-CG 4.24Å; Q199-E203 VanDerWaalsContact CG-OE1 3.28Å; Q199-E203 WeakPolarHBondContact CG-OE1 3.34Å; Q199-E203 PolarHBondContact NE2-OE1 3.23Å; Q199-E203 WeakPolarHBondContact O-CB 3.47Å; Q199-E203 WeakPolarHBondContact O-CG 3.28Å; Q199-E203 PolarHBondContact O-N 3.32Å
200	R	96.4	Very high	93.5	Very high	190 Å²	190	81.2 Å²	81.2	72%	0.717	39%	0.387	S	S	*	.	H	α-helix	trans	-60.3	-37.6	-179.4	-179.4	176.9	172.2	171.7	-1.3	112.6	R196 A197 S198 K204	R196-R200 WeakPolarHBondContact O-CB 3.36Å; R196-R200 PolarHBondContact O-N 2.95Å; A197-R200 PolarHBondContact O-N 2.94Å; S198-R200 PolarHBondContact O-N 3.35Å; R200-K204 WeakPolarHBondContact O-CB 3.5Å; R200-K204 PolarHBondContact O-N 2.99Å
201	I	96	Very high	93	Very high	49 Å²	49	88.5 Å²	88.5	25%	0.251	42%	0.421	S	S	.	.	H	α-helix	trans	-67.9	-48.1	177.7	-69	168.4	0	0	0	110.2	A163 V166 L170 A197 S198 Q199 K204 H205	A163-I201 HydrophobicContact CB-CD1 3.66Å; A163-I201 WeakPolarHBondContact O-CD1 3.47Å; V166-I201 HydrophobicContact CG1-CB 4.42Å; V166-I201 HydrophobicContact CG1-CG2 3.98Å; L170-I201 HydrophobicContact CD1-CG2 3.82Å; A197-I201 WeakPolarHBondContact O-CG1 3.29Å; A197-I201 PolarHBondContact O-N 2.76Å; A197-I201 VanDerWaalsContact O-N 3.15Å; S198-I201 PolarHBondContact O-N 3.3Å; Q199-I201 VanDerWaalsContact C-N 3.29Å; Q199-I201 PolarHBondContact O-N 3.21Å; I201-K204 PolarHBondContact O-N 3.15Å; I201-H205 WeakPolarHBondContact O-CB 3.4Å; I201-H205 PolarHBondContact O-N 3.43Å
202	I	94.9	Very high	92.2	Very high	0 Å²	0	89.1 Å²	89.1	0%	0	43%	0.429	C	S	.	.	H	α-helix	trans	-62.1	-49.4	179.8	-66	166.6	0	0	0	110.4	A158 V166 I176 A186 L187 A190 S198 Q199 K204 H205 I206	A158-I202 HydrophobicContact CB-CD1 3.9Å; V166-I202 HydrophobicContact CG1-CD1 4.24Å; V166-I202 HydrophobicContact CG1-CG1 3.83Å; I176-I202 HydrophobicContact CG2-CG2 3.93Å; A186-I202 HydrophobicContact CB-CD1 4.27Å; L187-I202 HydrophobicContact CB-CG2 4.1Å; L187-I202 HydrophobicContact CD1-CG2 4.16Å; A190-I202 HydrophobicContact CB-CD1 4.46Å; S198-I202 VanDerWaalsContact O-CG1 3.29Å; S198-I202 WeakPolarHBondContact O-CG1 3.35Å; S198-I202 PolarHBondContact O-N 3.43Å; Q199-I202 PolarHBondContact O-N 3.01Å; I202-K204 VanDerWaalsContact C-N 3.34Å; I202-K204 PolarHBondContact O-N 3.13Å; I202-H205 PolarHBondContact O-N 3.4Å; I202-H205 VanDerWaalsContact O-N 3.12Å; I202-I206 HydrophobicContact CG2-CD1 3.8Å; I202-I206 HydrophobicContact CG2-CG1 4.4Å; I202-I206 WeakPolarHBondContact O-CG1 3.18Å; I202-I206 PolarHBondContact O-N 2.92Å
203	E	94.4	Very high	90.3	Very high	77 Å²	77	92 Å²	92	36%	0.36	45%	0.45	S	S	.	.	H	α-helix	trans	-58.9	-44.6	177.1	-74.3	175.3	178.2	0	0	111.8	L187 Q199 H205 I206 L207	L187-E203 HydrophobicContact CD1-CG 4.01Å; Q199-E203 HydrophobicContact CG-CG 4.24Å; Q199-E203 VanDerWaalsContact CG-OE1 3.28Å; Q199-E203 WeakPolarHBondContact CG-OE1 3.34Å; Q199-E203 PolarHBondContact NE2-OE1 3.23Å; Q199-E203 WeakPolarHBondContact O-CB 3.47Å; Q199-E203 WeakPolarHBondContact O-CG 3.28Å; Q199-E203 PolarHBondContact O-N 3.32Å; E203-H205 VanDerWaalsContact C-N 3.28Å; E203-H205 PolarHBondContact O-N 3.12Å; E203-I206 PolarHBondContact O-N 2.83Å; E203-L207 VanDerWaalsContact O-CG 3.32Å; E203-L207 WeakPolarHBondContact O-CG 3.34Å; E203-L207 PolarHBondContact O-N 2.87Å
204	K	93.7	Very high	90.2	Very high	154 Å²	154	89.8 Å²	89.8	67%	0.67	45%	0.446	S	S	*	.	H	α-helix	trans	-59.9	-41.8	176.2	-177.3	-174.3	175.8	-167.4	0	111.2	R200 I201 I202 L207 S208	R200-K204 WeakPolarHBondContact O-CB 3.5Å; R200-K204 PolarHBondContact O-N 2.99Å; I201-K204 PolarHBondContact O-N 3.15Å; I202-K204 VanDerWaalsContact C-N 3.34Å; I202-K204 PolarHBondContact O-N 3.13Å; K204-L207 PolarHBondContact O-N 3.44Å; K204-S208 PolarHBondContact O-N 3.34Å
205	H	92.3	Very high	90	Very high	58 Å²	58	92 Å²	92	27%	0.269	44%	0.444	S	S	.	.	H	α-helix	trans	-67.4	-43.3	178.9	-163.7	103.5	0	0	0	111.5	L170 I176 I201 I202 E203 L207 S208 L209	L170-H205 HydrophobicContact CD1-CB 4.09Å; I176-H205 HydrophobicContact CD1-CB 4.27Å; I176-H205 WeakPolarHBondContact CD1-CD2 3.13Å; I201-H205 WeakPolarHBondContact O-CB 3.4Å; I201-H205 PolarHBondContact O-N 3.43Å; I202-H205 PolarHBondContact O-N 3.4Å; I202-H205 VanDerWaalsContact O-N 3.12Å; E203-H205 VanDerWaalsContact C-N 3.28Å; E203-H205 PolarHBondContact O-N 3.12Å; H205-L207 PolarHBondContact O-N 3.49Å; H205-S208 VanDerWaalsContact O-CB 3.32Å; H205-S208 WeakPolarHBondContact O-CB 3.32Å; H205-S208 PolarHBondContact O-N 3.4Å; H205-S208 VanDerWaalsContact O-N 3.13Å; H205-L209 WeakPolarHBondContact O-CG 3.37Å; H205-L209 PolarHBondContact O-N 3.03Å
206	I	91.6	Very high	89.7	Confident	54 Å²	54	96.9 Å²	96.9	28%	0.277	47%	0.468	S	S	.	.	H	α-helix	trans	-58.2	-47	174.4	-67.5	167.5	0	0	0	110.9	I176 L187 I202 E203 S208 L209 L210	I176-I206 HydrophobicContact CG2-CD1 3.99Å; I176-I206 HydrophobicContact CG2-CG1 3.93Å; L187-I206 HydrophobicContact CD2-CD1 4.16Å; I202-I206 HydrophobicContact CG2-CD1 3.8Å; I202-I206 HydrophobicContact CG2-CG1 4.4Å; I202-I206 WeakPolarHBondContact O-CG1 3.18Å; I202-I206 PolarHBondContact O-N 2.92Å; E203-I206 PolarHBondContact O-N 2.83Å; I206-S208 VanDerWaalsContact C-N 3.28Å; I206-S208 PolarHBondContact O-N 3.41Å; I206-L209 PolarHBondContact O-N 2.75Å; I206-L209 VanDerWaalsContact O-N 3.16Å; I206-L210 HydrophobicContact CG2-CD1 4.24Å; I206-L210 WeakPolarHBondContact O-CG 3.46Å; I206-L210 PolarHBondContact O-N 3.04Å
207	L	90.5	Very high	89.3	Confident	99 Å²	99	90.6 Å²	90.6	52%	0.518	45%	0.45	S	S	.	.	H	α-helix	trans	-61.7	-37.7	176.6	-70	173.9	0	0	0	112	E203 K204 H205 L209 L210 Q211	E203-L207 VanDerWaalsContact O-CG 3.32Å; E203-L207 WeakPolarHBondContact O-CG 3.34Å; E203-L207 PolarHBondContact O-N 2.87Å; K204-L207 PolarHBondContact O-N 3.44Å; H205-L207 PolarHBondContact O-N 3.49Å; L207-L209 VanDerWaalsContact C-N 3.33Å; L207-L210 PolarHBondContact O-N 3.16Å; L207-Q211 VanDerWaalsContact O-CG 3.3Å; L207-Q211 WeakPolarHBondContact O-CG 3.32Å; L207-Q211 PolarHBondContact O-N 3.39Å
208	S	90.2	Very high	88.9	Confident	65 Å²	65	93.5 Å²	93.5	46%	0.455	46%	0.455	S	S	.	.	H	α-helix	trans	-62.2	-40.4	174.8	-167.8	0	0	0	0	111.7	K204 H205 I206 Q211 T212	K204-S208 PolarHBondContact O-N 3.34Å; H205-S208 VanDerWaalsContact O-CB 3.32Å; H205-S208 WeakPolarHBondContact O-CB 3.32Å; H205-S208 PolarHBondContact O-N 3.4Å; H205-S208 VanDerWaalsContact O-N 3.13Å; I206-S208 VanDerWaalsContact C-N 3.28Å; I206-S208 PolarHBondContact O-N 3.41Å; S208-Q211 PolarHBondContact O-N 2.98Å; S208-T212 WeakPolarHBondContact O-CG2 3.3Å
209	L	87.2	Confident	88.5	Confident	91 Å²	91	99.7 Å²	99.7	48%	0.476	49%	0.485	S	S	.	.	H	α-helix	trans	-65.7	-42.2	176.4	-67.6	173	0	0	0	111.5	I176 H205 I206 L207 Q211 T212	I176-L209 HydrophobicContact CD1-CD1 4.13Å; H205-L209 WeakPolarHBondContact O-CG 3.37Å; H205-L209 PolarHBondContact O-N 3.03Å; I206-L209 PolarHBondContact O-N 2.75Å; I206-L209 VanDerWaalsContact O-N 3.16Å; L207-L209 VanDerWaalsContact C-N 3.33Å; L209-Q211 VanDerWaalsContact C-N 3.32Å; L209-Q211 PolarHBondContact O-N 3.06Å; L209-T212 PolarHBondContact O-N 3.5Å; L209-T212 PolarHBondContact O-OG1 3.35Å
210	L	86.7	Confident	88	Confident	123 Å²	123	103.4 Å²	103.4	64%	0.644	50%	0.504	S	S	*	.	H	α-helix	trans	-67.9	-28.6	179.3	-67	175.7	0	0	0	113.8	I206 L207 T212	I206-L210 HydrophobicContact CG2-CD1 4.24Å; I206-L210 WeakPolarHBondContact O-CG 3.46Å; I206-L210 PolarHBondContact O-N 3.04Å; L207-L210 PolarHBondContact O-N 3.16Å; L210-T212 VanDerWaalsContact C-N 3.33Å
211	Q	86	Confident	87.3	Confident	152 Å²	152	96.7 Å²	96.7	71%	0.71	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-9.9	178.9	-73.6	175.3	0.3	0	0	113.9	L207 S208 L209 H213	L207-Q211 VanDerWaalsContact O-CG 3.3Å; L207-Q211 WeakPolarHBondContact O-CG 3.32Å; L207-Q211 PolarHBondContact O-N 3.39Å; S208-Q211 PolarHBondContact O-N 2.98Å; L209-Q211 VanDerWaalsContact C-N 3.32Å; L209-Q211 PolarHBondContact O-N 3.06Å; Q211-H213 PolarHBondContact O-N 3.18Å
212	T	77.1	Confident	86.6	Confident	101 Å²	101	100.7 Å²	100.7	62%	0.62	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	16.5	-178.5	52.6	0	0	0	0	114.9	S208 L209 L210	S208-T212 WeakPolarHBondContact O-CG2 3.3Å; L209-T212 PolarHBondContact O-N 3.5Å; L209-T212 PolarHBondContact O-OG1 3.35Å; L210-T212 VanDerWaalsContact C-N 3.33Å
213	H	54.9	Low	85.9	Confident	234 Å²	234	109.8 Å²	109.8	100%	1.083	55%	0.553	S	S	*	*			trans	-121.1	0	171.3	-67.4	-53	0	0	0	111	Q211	Q211-H213 PolarHBondContact O-N 3.18Å

Retrieved 213 of 213 residues in 105.8 ms (Link to these results)

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