A0A077ZJ17_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZJ17, Species TRITR (Trichuris trichiura, Whipworm), 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	41	Very low	33.2	Very low	236 Å²	236	167.4 Å²	167.4	100%	1.163	85%	0.853	S	S	*	*				0	56.4	0	-62.4	176.6	-174.6	0	0	110.9
2	L	35.7	Very low	33.1	Very low	167 Å²	167	163.7 Å²	163.7	87%	0.874	85%	0.849	S	S	*	*			trans	-130.1	8.2	-173	-102.3	150.5	0	0	0	113.9
3	W	25.5	Very low	32.8	Very low	243 Å²	243	156.4 Å²	156.4	92%	0.92	84%	0.838	S	S	*	*	S	Bend	trans	-106.4	-7.7	-172.6	-87.7	56.3	0	0	0	115.4
4	T	36.7	Very low	32.9	Very low	131 Å²	131	156.1 Å²	156.1	80%	0.804	83%	0.834	S	S	*	*	S	Bend	trans	-96.4	5.6	-174.1	37.5	0	0	0	0	115.8
5	L	35.1	Very low	32.9	Very low	164 Å²	164	161.4 Å²	161.4	86%	0.859	84%	0.838	S	S	*	*	S	Bend	trans	-109.1	-1.3	-179.6	-69.9	177.4	0	0	0	115.4
6	Y	32.2	Very low	33.4	Very low	209 Å²	209	160.8 Å²	160.8	82%	0.82	84%	0.836	S	S	*	*	S	Bend	trans	-88.2	-16.8	-176	-144.2	-97.3	0	0	0	115
7	F	33.2	Very low	33.9	Very low	208 Å²	208	162.1 Å²	162.1	91%	0.912	84%	0.837	S	S	*	*	S	Bend	trans	-102.9	4.7	-177.5	-86.3	-80.3	0	0	0	115.4
8	G	29.4	Very low	34.3	Very low	63 Å²	63	161.8 Å²	161.8	65%	0.649	83%	0.831	S	S	*	*	S	Bend	trans	-96.2	-25.2	-166.1	0	0	0	0	0	118.4
9	S	29.2	Very low	34.8	Very low	114 Å²	114	161.1 Å²	161.1	80%	0.797	83%	0.829	S	S	*	*	S	Bend	trans	-153.4	55.5	-160.8	-51.1	0	0	0	0	115.6
10	I	35.4	Very low	35.2	Very low	146 Å²	146	161.2 Å²	161.2	75%	0.749	83%	0.826	S	S	*	*			trans	-137.8	86.9	163.5	-52.8	177.3	0	0	0	109.4
11	L	31.2	Very low	36	Very low	160 Å²	160	158.1 Å²	158.1	84%	0.838	81%	0.814	S	S	*	*			trans	-166	73.9	143.1	-102.9	144.1	0	0	0	109.5
12	P	33	Very low	36.2	Very low	123 Å²	123	156 Å²	156	80%	0.799	80%	0.801	S	S	*	*			trans	-88.3	118.3	164.7	21.3	-5.1	0	0	0	109.7
13	G	28.5	Very low	36.6	Very low	69 Å²	69	155 Å²	155	71%	0.711	80%	0.796	S	S	*	*			trans	91.5	70.9	148.4	0	0	0	0	0	116.9
14	I	34.9	Very low	37.5	Very low	152 Å²	152	154.2 Å²	154.2	78%	0.779	79%	0.793	S	S	*	*			trans	-109.4	92.2	140.9	36.4	174.1	0	0	0	106.4	D16	I14-D16 PolarHBondContact O-N 3.1Å
15	R	32.1	Very low	37.8	Very low	236 Å²	236	153.9 Å²	153.9	89%	0.891	79%	0.793	S	S	*	*			trans	-86.9	88	165.9	-74	174.3	63.1	-138.3	-1.6	105.8
16	D	41.5	Very low	38.1	Very low	151 Å²	151	153.5 Å²	153.5	81%	0.807	79%	0.792	S	S	*	*			trans	-133	101.5	163.6	-77.9	-44	0	0	0	108	I14	I14-D16 PolarHBondContact O-N 3.1Å
17	E	41.1	Very low	38.6	Very low	183 Å²	183	148 Å²	148	86%	0.855	78%	0.784	S	S	*	*			trans	39.8	109.3	149.9	-142.9	70	-177.3	0	0	118.6	D19	E17-D19 PolarHBondContact O-N 3.39Å; E17-D19 VanDerWaalsContact O-N 3.08Å
18	E	42	Very low	39.1	Very low	158 Å²	158	144 Å²	144	74%	0.738	78%	0.779	S	S	*	*			trans	-59.4	99.4	172.1	-63.1	170.3	160.7	0	0	111	H20	E18-H20 PolarHBondContact O-N 3.43Å; E18-H20 VanDerWaalsContact O-N 3.07Å
19	D	43.9	Very low	39.7	Very low	147 Å²	147	147 Å²	147	79%	0.786	79%	0.785	S	S	*	*			trans	-72.9	100	162.1	-149	4.6	0	0	0	107.1	E17 V21	E17-D19 PolarHBondContact O-N 3.39Å; E17-D19 VanDerWaalsContact O-N 3.08Å; D19-V21 PolarHBondContact O-N 2.75Å
20	H	43.1	Very low	40.4	Very low	164 Å²	164	147.1 Å²	147.1	76%	0.759	78%	0.782	S	S	*	*			trans	-65.9	65.7	-179.9	-82	-78	0	0	0	111.6	E18 E22	E18-H20 PolarHBondContact O-N 3.43Å; E18-H20 VanDerWaalsContact O-N 3.07Å; H20-E22 PolarHBondContact O-N 3.02Å
21	V	51.3	Low	40.9	Very low	96 Å²	96	149 Å²	149	58%	0.582	79%	0.788	S	S	*	*			trans	-86	99.7	161.8	-167.5	0	0	0	0	105.9	D19 L23	D19-V21 PolarHBondContact O-N 2.75Å; V21-L23 HydrophobicContact CB-CG 4.43Å; V21-L23 HydrophobicContact CG1-CD2 3.85Å; V21-L23 HydrophobicContact CG1-CG 3.99Å; V21-L23 PolarHBondContact O-N 3.04Å
22	E	44.2	Very low	41.8	Very low	191 Å²	191	147.2 Å²	147.2	89%	0.893	78%	0.784	S	S	*	*			trans	-65.4	75.5	173.7	-152	-179.5	-155.1	0	0	108.4	H20 R24	H20-E22 PolarHBondContact O-N 3.02Å; E22-R24 VanDerWaalsContact C-N 3.29Å; E22-R24 PolarHBondContact O-N 2.88Å
23	L	46	Very low	42.2	Very low	146 Å²	146	150.3 Å²	150.3	76%	0.764	79%	0.788	S	S	*	*			trans	-70.5	94.2	174.2	-70	177	0	0	0	106.4	V21 P25	V21-L23 HydrophobicContact CB-CG 4.43Å; V21-L23 HydrophobicContact CG1-CD2 3.85Å; V21-L23 HydrophobicContact CG1-CG 3.99Å; V21-L23 PolarHBondContact O-N 3.04Å; L23-P25 VanDerWaalsContact O-N 3.16Å
24	R	43.9	Very low	43.2	Very low	228 Å²	228	154.1 Å²	154.1	86%	0.86	79%	0.79	S	S	*	*			trans	-44.2	123	166.8	-105.5	-179.8	156.2	175.1	-5.6	108	E22 D26	E22-R24 VanDerWaalsContact C-N 3.29Å; E22-R24 PolarHBondContact O-N 2.88Å; R24-D26 PolarHBondContact O-N 3.32Å
25	P	42.8	Very low	43.8	Very low	123 Å²	123	155.9 Å²	155.9	80%	0.799	80%	0.795	S	S	*	*			trans	-65.2	101.8	175.6	24.9	-31	0	0	0	107.4	L23 S27	L23-P25 VanDerWaalsContact O-N 3.16Å; P25-S27 PolarHBondContact O-N 3.05Å
26	D	41	Very low	44.3	Very low	157 Å²	157	148.1 Å²	148.1	84%	0.84	79%	0.788	S	S	*	*			trans	-57.2	135.5	161.7	-104.2	-24.8	0	0	0	107.3	R24	R24-D26 PolarHBondContact O-N 3.32Å
27	S	42.5	Very low	44.5	Very low	93 Å²	93	146 Å²	146	65%	0.65	78%	0.78	S	S	*	*			trans	-41	153.5	-167.3	47.2	0	0	0	0	116.4	P25 T29	P25-S27 PolarHBondContact O-N 3.05Å; S27-T29 PolarHBondContact O-N 3.48Å; S27-T29 VanDerWaalsContact O-N 3.14Å
28	P	43.1	Very low	44.5	Very low	125 Å²	125	142 Å²	142	81%	0.812	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-56.6	117.6	-174	-15.6	27.5	0	0	0	111.4
29	T	43.6	Very low	44.5	Very low	126 Å²	126	141.6 Å²	141.6	77%	0.773	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-58.6	124.6	168.2	-44	0	0	0	0	107.7	S27 E31	S27-T29 PolarHBondContact O-N 3.48Å; S27-T29 VanDerWaalsContact O-N 3.14Å; T29-E31 PolarHBondContact O-N 2.88Å
30	P	43.6	Very low	44.9	Very low	115 Å²	115	141.5 Å²	141.5	75%	0.747	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-57.1	126.3	-176.1	19.9	-30.5	0	0	0	109.8	V32	P30-V32 PolarHBondContact O-N 3.46Å
31	E	44.8	Very low	45.3	Very low	186 Å²	186	139.8 Å²	139.8	87%	0.869	75%	0.752	S	S	*	*			trans	-57.6	106.5	172.1	-57.7	-163.7	-177.5	0	0	107	T29 E33	T29-E31 PolarHBondContact O-N 2.88Å; E31-E33 PolarHBondContact O-N 3.03Å
32	V	51.8	Low	44.8	Very low	122 Å²	122	142.5 Å²	142.5	74%	0.739	76%	0.757	S	S	*	*			trans	-67.7	106.8	171.2	116	0	0	0	0	104.7	P30 I34	P30-V32 PolarHBondContact O-N 3.46Å; V32-I34 HydrophobicContact CG1-CG2 3.69Å; V32-I34 PolarHBondContact O-N 2.84Å
33	E	41.4	Very low	45	Very low	189 Å²	189	139.5 Å²	139.5	88%	0.883	75%	0.751	S	S	*	*			trans	-62.5	89.4	170.7	-67.1	-179.1	166.6	0	0	106.9	E31 E35	E31-E33 PolarHBondContact O-N 3.03Å; E33-E35 PolarHBondContact O-N 2.97Å; E33-E35 VanDerWaalsContact O-N 3.07Å
34	I	49.6	Very low	45.1	Very low	148 Å²	148	136.2 Å²	136.2	76%	0.759	74%	0.74	S	S	*	*			trans	-68.4	103.6	167.3	45.6	169.4	0	0	0	106.5	V32 G36	V32-I34 HydrophobicContact CG1-CG2 3.69Å; V32-I34 PolarHBondContact O-N 2.84Å; I34-G36 PolarHBondContact O-N 3.27Å
35	E	46.6	Very low	45.2	Very low	190 Å²	190	132.6 Å²	132.6	89%	0.888	74%	0.735	S	S	*	*			trans	-47.8	114.6	168.7	-112.1	-179.8	163.1	0	0	107.9	E33 V37	E33-E35 PolarHBondContact O-N 2.97Å; E33-E35 VanDerWaalsContact O-N 3.07Å; E35-V37 PolarHBondContact O-N 2.72Å; E35-V37 VanDerWaalsContact O-N 3.15Å
36	G	43.6	Very low	45.2	Very low	72 Å²	72	133.7 Å²	133.7	74%	0.742	73%	0.734	S	S	*	*			trans	-57.1	121.3	-175.7	0	0	0	0	0	109.7	I34 N38	I34-G36 PolarHBondContact O-N 3.27Å; G36-N38 PolarHBondContact O-N 3.38Å
37	V	43.9	Very low	45.5	Very low	106 Å²	106	133.4 Å²	133.4	64%	0.642	73%	0.732	S	S	*	*			trans	-59.6	111.1	171.6	179.9	0	0	0	0	107.2	E35 F39	E35-V37 PolarHBondContact O-N 2.72Å; E35-V37 VanDerWaalsContact O-N 3.15Å; V37-F39 VanDerWaalsContact O-CD2 3.25Å; V37-F39 WeakPolarHBondContact O-CD2 3.37Å; V37-F39 WeakPolarHBondContact O-CE2 3.34Å; V37-F39 PolarHBondContact O-N 3.39Å
38	N	42.1	Very low	45.9	Very low	101 Å²	101	137.9 Å²	137.9	54%	0.54	74%	0.743	S	S	.	*			trans	-71	106.4	177.3	-178.4	-13.9	0	0	0	108	G36 E40	G36-N38 PolarHBondContact O-N 3.38Å; N38-E40 PolarHBondContact O-N 3.37Å; N38-E40 VanDerWaalsContact OD1-CB 3.3Å; N38-E40 WeakPolarHBondContact OD1-CB 3.36Å; N38-E40 PolarHBondContact OD1-N 2.92Å; N38-E40 PolarHBondContact OD1-OE2 3.48Å
39	F	42.7	Very low	46.2	Very low	148 Å²	148	138.5 Å²	138.5	65%	0.649	74%	0.739	S	S	*	*	G	3₁₀ helix	trans	-76.2	-12.9	-174.6	-70.9	-79.6	0	0	0	112.7	V37 D41 F42	V37-F39 VanDerWaalsContact O-CD2 3.25Å; V37-F39 WeakPolarHBondContact O-CD2 3.37Å; V37-F39 WeakPolarHBondContact O-CE2 3.34Å; V37-F39 PolarHBondContact O-N 3.39Å; F39-D41 PolarHBondContact O-N 3.16Å; F39-F42 WeakPolarHBondContact O-CB 3.43Å; F39-F42 PolarHBondContact O-N 3.25Å; F39-F42 VanDerWaalsContact O-N 3.14Å
40	E	50.3	Low	46.5	Very low	146 Å²	146	136.8 Å²	136.8	68%	0.682	74%	0.737	S	S	*	*	G	3₁₀ helix	trans	-64.6	-26	176	-69.4	67.6	-170	0	0	111.6	N38 F42 V43	N38-E40 PolarHBondContact O-N 3.37Å; N38-E40 VanDerWaalsContact OD1-CB 3.3Å; N38-E40 WeakPolarHBondContact OD1-CB 3.36Å; N38-E40 PolarHBondContact OD1-N 2.92Å; N38-E40 PolarHBondContact OD1-OE2 3.48Å; E40-F42 VanDerWaalsContact C-N 3.28Å; E40-F42 PolarHBondContact O-N 3.36Å; E40-V43 PolarHBondContact O-N 3.08Å
41	D	52.6	Low	46.7	Very low	127 Å²	127	137.1 Å²	137.1	68%	0.679	74%	0.737	S	S	*	*	G	3₁₀ helix	trans	-74	-18.7	177.1	-140.1	30.6	0	0	0	112.6	F39 V43 S44	F39-D41 PolarHBondContact O-N 3.16Å; D41-V43 VanDerWaalsContact C-N 3.31Å; D41-S44 PolarHBondContact O-OG 3.21Å
42	F	40.3	Very low	46.9	Very low	154 Å²	154	132.9 Å²	132.9	68%	0.675	73%	0.728	S	S	*	*	G	3₁₀ helix	trans	-78.2	-16.9	176.4	-116.8	-90.7	0	0	0	113	F39 E40	F39-F42 WeakPolarHBondContact O-CB 3.43Å; F39-F42 PolarHBondContact O-N 3.25Å; F39-F42 VanDerWaalsContact O-N 3.14Å; E40-F42 VanDerWaalsContact C-N 3.28Å; E40-F42 PolarHBondContact O-N 3.36Å
43	V	48.4	Very low	47	Very low	128 Å²	128	132.8 Å²	132.8	78%	0.776	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	-14.1	-177.9	-170.9	0	0	0	0	111.9	E40 D41	E40-V43 PolarHBondContact O-N 3.08Å; D41-V43 VanDerWaalsContact C-N 3.31Å
44	S	47.4	Very low	47.6	Very low	76 Å²	76	131.7 Å²	131.7	53%	0.531	72%	0.723	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.8	10.3	176	53.8	0	0	0	0	114.4	D41 D46	D41-S44 PolarHBondContact O-OG 3.21Å; S44-D46 VanDerWaalsContact C-N 3.34Å; S44-D46 PolarHBondContact O-N 2.8Å
45	M	46.6	Very low	47.8	Very low	153 Å²	153	128.6 Å²	128.6	75%	0.754	71%	0.713	S	S	*	*	S	Bend	trans	-71	99.3	171.5	-160.2	158.3	65	0	0	107.6
46	D	44	Very low	48.6	Very low	145 Å²	145	123.8 Å²	123.8	78%	0.775	69%	0.693	S	S	*	*			trans	-38	135.7	-173.8	-78.4	-51	0	0	0	112.5	S44 E48	S44-D46 VanDerWaalsContact C-N 3.34Å; S44-D46 PolarHBondContact O-N 2.8Å; D46-E48 PolarHBondContact O-N 2.7Å
47	D	47.4	Very low	48.8	Very low	151 Å²	151	125 Å²	125	81%	0.807	69%	0.688	S	S	*	*			trans	-60.4	49	169.1	-74.3	-46.8	0	0	0	112.2	L49	D47-L49 PolarHBondContact O-N 2.88Å
48	E	50.9	Low	49.3	Very low	187 Å²	187	126.8 Å²	126.8	87%	0.874	69%	0.689	S	S	*	*			trans	-67.6	76.9	147.9	-98.1	-161.5	161.7	0	0	106.5	D46 A50	D46-E48 PolarHBondContact O-N 2.7Å; E48-A50 PolarHBondContact O-N 2.66Å
49	L	47.9	Very low	50.4	Low	139 Å²	139	124.6 Å²	124.6	73%	0.728	69%	0.685	S	S	*	*			trans	-55.3	89.9	157	-64.6	174	0	0	0	105.4	D47 T51	D47-L49 PolarHBondContact O-N 2.88Å; L49-T51 VanDerWaalsContact C-N 3.31Å; L49-T51 PolarHBondContact O-N 2.75Å
50	A	49.6	Very low	51.3	Low	89 Å²	89	121.4 Å²	121.4	74%	0.736	67%	0.674	S	S	*	*			trans	-48.1	111.4	154.9	0	0	0	0	0	104.1	E48 S52	E48-A50 PolarHBondContact O-N 2.66Å; A50-S52 PolarHBondContact O-N 2.73Å
51	T	48.9	Very low	51.2	Low	122 Å²	122	118.9 Å²	118.9	75%	0.748	66%	0.661	S	S	*	*			trans	-67.2	72.5	171.4	55	0	0	0	0	106	L49 T53	L49-T51 VanDerWaalsContact C-N 3.31Å; L49-T51 PolarHBondContact O-N 2.75Å; T51-T53 PolarHBondContact O-N 3.15Å; T51-T53 PolarHBondContact O-OG1 3.46Å
52	S	48.4	Very low	51.7	Low	98 Å²	98	117.9 Å²	117.9	69%	0.685	65%	0.652	S	S	*	*			trans	-62.4	85.6	160.2	171.2	0	0	0	0	103.7	A50 E54	A50-S52 PolarHBondContact O-N 2.73Å; S52-E54 PolarHBondContact O-N 3.49Å
53	T	54	Low	52.6	Low	119 Å²	119	114 Å²	114	73%	0.73	64%	0.644	S	S	*	*			trans	-66.1	88.6	167.1	-53.9	0	0	0	0	103	T51 P55	T51-T53 PolarHBondContact O-N 3.15Å; T51-T53 PolarHBondContact O-OG1 3.46Å; T53-P55 WeakPolarHBondContact O-CD 3.47Å
54	E	53.5	Low	52.9	Low	166 Å²	166	111.9 Å²	111.9	78%	0.776	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-51.6	116.4	173.8	-121.9	178	178.3	0	0	105.4	S52 D56	S52-E54 PolarHBondContact O-N 3.49Å; E54-D56 PolarHBondContact O-N 2.87Å
55	P	54.1	Low	52.9	Low	84 Å²	84	109.7 Å²	109.7	55%	0.545	61%	0.609	S	S	.	*	P	Polyproline II helix	trans	-59.4	129	-175.5	21.6	-31.3	0	0	0	108.2	T53 P57 I60	T53-P55 WeakPolarHBondContact O-CD 3.47Å; P55-P57 WeakPolarHBondContact O-CD 3.44Å; P55-P57 VanDerWaalsContact O-N 3.12Å; P55-I60 HydrophobicContact CB-CD1 3.99Å; P55-I60 HydrophobicContact CB-CG1 4.13Å; P55-I60 HydrophobicContact CG-CD1 3.88Å; P55-I60 HydrophobicContact CG-CG1 4.47Å
56	D	64.2	Low	53.6	Low	88 Å²	88	106 Å²	106	47%	0.471	60%	0.604	S	S	.	*	P	Polyproline II helix	trans	-51.3	120.8	174.5	172.2	17.4	0	0	0	108.7	E54 Q58 A59 I60	E54-D56 PolarHBondContact O-N 2.87Å; D56-Q58 PolarHBondContact O-N 3Å; D56-Q58 WeakPolarHBondContact OD1-CB 3.34Å; D56-Q58 PolarHBondContact OD1-N 3.42Å; D56-Q58 WeakPolarHBondContact OD2-CB 3.41Å; D56-A59 HydrophobicContact CB-CB 4.07Å; D56-A59 WeakPolarHBondContact O-CA 3.23Å; D56-A59 WeakPolarHBondContact O-CB 3.46Å; D56-A59 PolarHBondContact O-N 2.91Å; D56-I60 PolarHBondContact O-N 3.32Å; D56-I60 VanDerWaalsContact O-N 3.15Å
57	P	47	Very low	54.2	Low	98 Å²	98	107 Å²	107	64%	0.636	60%	0.604	S	S	*	*	H	α-helix	trans	-52.6	-30.7	178.4	-26.7	34	0	0	0	112.7	P55 I60 F61	P55-P57 WeakPolarHBondContact O-CD 3.44Å; P55-P57 VanDerWaalsContact O-N 3.12Å; P57-I60 PolarHBondContact O-N 2.96Å; P57-F61 PolarHBondContact O-N 3.35Å; P57-F61 VanDerWaalsContact O-N 3.15Å
58	Q	54.8	Low	54.7	Low	144 Å²	144	104.5 Å²	104.5	67%	0.673	59%	0.593	S	S	*	*	H	α-helix	trans	-68.3	-39	176.1	-121.5	135.3	-26.2	0	0	112.3	D56 F61 Q62	D56-Q58 PolarHBondContact O-N 3Å; D56-Q58 WeakPolarHBondContact OD1-CB 3.34Å; D56-Q58 PolarHBondContact OD1-N 3.42Å; D56-Q58 WeakPolarHBondContact OD2-CB 3.41Å; Q58-F61 PolarHBondContact O-N 3.3Å; Q58-Q62 WeakPolarHBondContact O-CG 3.31Å; Q58-Q62 PolarHBondContact O-N 3.06Å
59	A	64.5	Low	54.2	Low	55 Å²	55	98.6 Å²	98.6	46%	0.455	58%	0.583	S	S	.	*	H	α-helix	trans	-66.2	-38.8	175.5	0	0	0	0	0	111.9	D56 F61 Q62 S63	D56-A59 HydrophobicContact CB-CB 4.07Å; D56-A59 WeakPolarHBondContact O-CA 3.23Å; D56-A59 WeakPolarHBondContact O-CB 3.46Å; D56-A59 PolarHBondContact O-N 2.91Å; A59-F61 VanDerWaalsContact C-N 3.32Å; A59-F61 PolarHBondContact O-N 3.36Å; A59-Q62 PolarHBondContact O-N 2.98Å; A59-S63 VanDerWaalsContact O-CB 3.31Å; A59-S63 WeakPolarHBondContact O-CB 3.36Å; A59-S63 PolarHBondContact O-N 3.03Å
60	I	62.2	Low	54.3	Low	81 Å²	81	96.8 Å²	96.8	42%	0.415	57%	0.573	S	S	.	*	H	α-helix	trans	-60	-46.1	173.9	-64.4	163.5	0	0	0	110	P55 D56 P57 S63 I64	P55-I60 HydrophobicContact CB-CD1 3.99Å; P55-I60 HydrophobicContact CB-CG1 4.13Å; P55-I60 HydrophobicContact CG-CD1 3.88Å; P55-I60 HydrophobicContact CG-CG1 4.47Å; D56-I60 PolarHBondContact O-N 3.32Å; D56-I60 VanDerWaalsContact O-N 3.15Å; P57-I60 PolarHBondContact O-N 2.96Å; I60-S63 WeakPolarHBondContact O-CB 3.46Å; I60-S63 PolarHBondContact O-N 3.15Å; I60-I64 HydrophobicContact CG2-CD1 3.97Å; I60-I64 VanDerWaalsContact O-CG1 3.31Å; I60-I64 WeakPolarHBondContact O-CG1 3.34Å; I60-I64 PolarHBondContact O-N 3.43Å
61	F	47.6	Very low	54.2	Low	92 Å²	92	95.4 Å²	95.4	40%	0.404	56%	0.559	S	S	.	*	H	α-helix	trans	-65.5	-41.9	-179	-156.5	-96.3	0	0	0	112.5	P57 Q58 A59 S63 I64 L65	P57-F61 PolarHBondContact O-N 3.35Å; P57-F61 VanDerWaalsContact O-N 3.15Å; Q58-F61 PolarHBondContact O-N 3.3Å; A59-F61 VanDerWaalsContact C-N 3.32Å; A59-F61 PolarHBondContact O-N 3.36Å; F61-S63 VanDerWaalsContact C-N 3.35Å; F61-I64 PolarHBondContact O-N 3.19Å; F61-L65 HydrophobicContact CD1-CD1 3.95Å; F61-L65 HydrophobicContact CD1-CG 4.25Å; F61-L65 HydrophobicContact CE1-CD1 3.93Å; F61-L65 HydrophobicContact CE1-CD2 4.44Å; F61-L65 HydrophobicContact CE1-CG 4.22Å; F61-L65 WeakPolarHBondContact O-CG 3.33Å; F61-L65 PolarHBondContact O-N 3.39Å
62	Q	64.5	Low	54.2	Low	107 Å²	107	93.4 Å²	93.4	50%	0.5	55%	0.547	S	S	.	.	H	α-helix	trans	-66.7	-36.8	175.6	-69	-67.2	-8.4	0	0	112.2	Q58 A59 I64 L65 A66	Q58-Q62 WeakPolarHBondContact O-CG 3.31Å; Q58-Q62 PolarHBondContact O-N 3.06Å; A59-Q62 PolarHBondContact O-N 2.98Å; Q62-I64 VanDerWaalsContact C-N 3.34Å; Q62-L65 PolarHBondContact O-N 2.79Å; Q62-A66 WeakPolarHBondContact O-CB 3.13Å; Q62-A66 PolarHBondContact O-N 3.2Å
63	S	59.6	Low	54.2	Low	72 Å²	72	96.4 Å²	96.4	50%	0.503	55%	0.551	S	S	.	*	H	α-helix	trans	-61.2	-44.5	174.2	-170.4	0	0	0	0	111.2	A59 I60 F61 A66 E67	A59-S63 VanDerWaalsContact O-CB 3.31Å; A59-S63 WeakPolarHBondContact O-CB 3.36Å; A59-S63 PolarHBondContact O-N 3.03Å; I60-S63 WeakPolarHBondContact O-CB 3.46Å; I60-S63 PolarHBondContact O-N 3.15Å; F61-S63 VanDerWaalsContact C-N 3.35Å; S63-A66 PolarHBondContact O-N 2.93Å; S63-E67 WeakPolarHBondContact O-CB 3.41Å; S63-E67 PolarHBondContact O-N 2.72Å
64	I	53.2	Low	53.7	Low	84 Å²	84	96.1 Å²	96.1	43%	0.431	54%	0.544	S	S	.	.	H	α-helix	trans	-61.2	-50.4	176.5	-66.9	164.1	0	0	0	109.7	I60 F61 Q62 A66 E67 V68	I60-I64 HydrophobicContact CG2-CD1 3.97Å; I60-I64 VanDerWaalsContact O-CG1 3.31Å; I60-I64 WeakPolarHBondContact O-CG1 3.34Å; I60-I64 PolarHBondContact O-N 3.43Å; F61-I64 PolarHBondContact O-N 3.19Å; Q62-I64 VanDerWaalsContact C-N 3.34Å; I64-A66 VanDerWaalsContact C-N 3.29Å; I64-A66 PolarHBondContact O-N 3.09Å; I64-E67 PolarHBondContact O-N 2.96Å; I64-E67 VanDerWaalsContact O-N 3.08Å; I64-V68 HydrophobicContact CG2-CG2 4.19Å; I64-V68 WeakPolarHBondContact O-CG2 3.31Å; I64-V68 PolarHBondContact O-N 3.33Å
65	L	47.3	Very low	53.4	Low	29 Å²	29	96 Å²	96	15%	0.152	55%	0.549	C	S	.	.	H	α-helix	trans	-58.8	-40.2	179.3	-68.3	179.4	0	0	0	112.7	F61 Q62 G69 L70	F61-L65 HydrophobicContact CD1-CD1 3.95Å; F61-L65 HydrophobicContact CD1-CG 4.25Å; F61-L65 HydrophobicContact CE1-CD1 3.93Å; F61-L65 HydrophobicContact CE1-CD2 4.44Å; F61-L65 HydrophobicContact CE1-CG 4.22Å; F61-L65 WeakPolarHBondContact O-CG 3.33Å; F61-L65 PolarHBondContact O-N 3.39Å; Q62-L65 PolarHBondContact O-N 2.79Å; L65-G69 PolarHBondContact O-N 2.89Å; L65-L70 PolarHBondContact O-N 3.44Å
66	A	63	Low	53.2	Low	77 Å²	77	97.6 Å²	97.6	64%	0.636	56%	0.557	S	S	*	*	H	α-helix	trans	-65.7	-38.1	175.5	0	0	0	0	0	112.3	Q62 S63 I64 G69	Q62-A66 WeakPolarHBondContact O-CB 3.13Å; Q62-A66 PolarHBondContact O-N 3.2Å; S63-A66 PolarHBondContact O-N 2.93Å; I64-A66 VanDerWaalsContact C-N 3.29Å; I64-A66 PolarHBondContact O-N 3.09Å; A66-G69 PolarHBondContact O-N 2.88Å; A66-G69 VanDerWaalsContact O-N 3.16Å
67	E	55.5	Low	52.2	Low	166 Å²	166	101.6 Å²	101.6	78%	0.776	57%	0.573	S	S	*	*	H	α-helix	trans	-69.7	-36.3	178.3	-170.3	168.2	-165.2	0	0	112.4	S63 I64 G69	S63-E67 WeakPolarHBondContact O-CB 3.41Å; S63-E67 PolarHBondContact O-N 2.72Å; I64-E67 PolarHBondContact O-N 2.96Å; I64-E67 VanDerWaalsContact O-N 3.08Å; E67-G69 PolarHBondContact O-N 3.26Å
68	V	57.3	Low	51.8	Low	97 Å²	97	104.1 Å²	104.1	59%	0.588	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	-0.9	172.6	-150	0	0	0	0	112.2	I64 L70	I64-V68 HydrophobicContact CG2-CG2 4.19Å; I64-V68 WeakPolarHBondContact O-CG2 3.31Å; I64-V68 PolarHBondContact O-N 3.33Å; V68-L70 HydrophobicContact CB-CD1 4.2Å; V68-L70 HydrophobicContact CB-CG 4.24Å; V68-L70 HydrophobicContact CG1-CD1 4.28Å; V68-L70 HydrophobicContact CG1-CG 4.46Å; V68-L70 PolarHBondContact O-N 2.92Å
69	G	42.1	Very low	51	Low	63 Å²	63	106.4 Å²	106.4	65%	0.649	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	69.1	18.2	179.2	0	0	0	0	0	114.4	L65 A66 E67 S71	L65-G69 PolarHBondContact O-N 2.89Å; A66-G69 PolarHBondContact O-N 2.88Å; A66-G69 VanDerWaalsContact O-N 3.16Å; E67-G69 PolarHBondContact O-N 3.26Å; G69-S71 PolarHBondContact O-N 2.81Å
70	L	48.7	Very low	49.8	Very low	101 Å²	101	108.8 Å²	108.8	53%	0.529	60%	0.601	S	S	.	*			trans	-89.4	86.6	-179.5	-64.6	172.7	0	0	0	109.2	L65 V68	L65-L70 PolarHBondContact O-N 3.44Å; V68-L70 HydrophobicContact CB-CD1 4.2Å; V68-L70 HydrophobicContact CB-CG 4.24Å; V68-L70 HydrophobicContact CG1-CD1 4.28Å; V68-L70 HydrophobicContact CG1-CG 4.46Å; V68-L70 PolarHBondContact O-N 2.92Å
71	S	47.4	Very low	48.9	Very low	61 Å²	61	114.3 Å²	114.3	43%	0.427	63%	0.625	S	S	.	*			trans	-61.8	135.3	167.3	176.8	0	0	0	0	109.5	G69 E73 D74	G69-S71 PolarHBondContact O-N 2.81Å; S71-E73 PolarHBondContact O-N 3.34Å; S71-E73 VanDerWaalsContact O-N 3.1Å; S71-D74 WeakPolarHBondContact CB-OD2 3.36Å
72	P	48.8	Very low	48.7	Very low	79 Å²	79	116 Å²	116	51%	0.513	64%	0.638	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.2	-7.7	-173.8	26.5	-33.7	0	0	0	115
73	E	49.7	Very low	47.5	Very low	162 Å²	162	119 Å²	119	76%	0.757	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.1	-9.5	-171.6	-54.1	-77.7	144.1	0	0	113.7	S71 D75	S71-E73 PolarHBondContact O-N 3.34Å; S71-E73 VanDerWaalsContact O-N 3.1Å; E73-D75 PolarHBondContact O-N 3.44Å
74	D	43.3	Very low	46.7	Very low	112 Å²	112	121.9 Å²	121.9	60%	0.599	67%	0.667	S	S	*	*			trans	-90.9	108.2	-175.3	-65.1	-44.9	0	0	0	109.9	S71 V76	S71-D74 WeakPolarHBondContact CB-OD2 3.36Å; D74-V76 HydrophobicContact CB-CG2 3.59Å; D74-V76 PolarHBondContact O-N 3.04Å
75	D	45.9	Very low	46.1	Very low	164 Å²	164	126 Å²	126	88%	0.877	68%	0.684	S	S	*	*			trans	-60.7	69.1	160	-69.5	-43.4	0	0	0	108.6	E73 E77	E73-D75 PolarHBondContact O-N 3.44Å; D75-E77 PolarHBondContact O-N 2.96Å
76	V	50.2	Low	45.6	Very low	117 Å²	117	131.9 Å²	131.9	71%	0.709	71%	0.712	S	S	*	*			trans	-74.8	100.8	-179.6	177	0	0	0	0	108	D74 E78	D74-V76 HydrophobicContact CB-CG2 3.59Å; D74-V76 PolarHBondContact O-N 3.04Å; V76-E78 PolarHBondContact O-N 3.01Å
77	E	43.5	Very low	44.6	Very low	173 Å²	173	134.5 Å²	134.5	81%	0.808	72%	0.721	S	S	*	*			trans	-35.5	124.2	160.5	-69.8	-74.9	159	0	0	111.3	D75 E79	D75-E77 PolarHBondContact O-N 2.96Å; E77-E79 PolarHBondContact O-N 3.22Å
78	E	39.6	Very low	43.9	Very low	150 Å²	150	133.7 Å²	133.7	70%	0.701	72%	0.716	S	S	*	*			trans	-63.9	99.5	177.4	-74.7	-162.5	-143.2	0	0	111.5	V76 K144	V76-E78 PolarHBondContact O-N 3.01Å; E78-K144 WeakPolarHBondContact OE1-CE 3.17Å; E78-K144 IonicContact OE1-NZ 2.93Å; E78-K144 PolarHBondContact OE1-NZ 3.27Å
79	E	37.8	Very low	43.4	Very low	192 Å²	192	138.1 Å²	138.1	90%	0.897	73%	0.728	S	S	*	*			trans	-142.8	81	155.1	-74.6	-163.2	171.3	0	0	110	E77	E77-E79 PolarHBondContact O-N 3.22Å
80	S	39.3	Very low	43.3	Very low	106 Å²	106	140.9 Å²	140.9	74%	0.741	73%	0.727	S	S	*	*			trans	-124.7	93.7	151.2	70.8	0	0	0	0	108.3	N82	S80-N82 PolarHBondContact O-N 2.89Å
81	E	42	Very low	43.6	Very low	197 Å²	197	142.6 Å²	142.6	92%	0.921	73%	0.73	S	S	*	*			trans	-61.1	66.4	149.6	-66.1	-179.5	163.4	0	0	107.7	E83	E81-E83 VanDerWaalsContact C-N 3.35Å; E81-E83 PolarHBondContact O-N 3.16Å
82	N	44.7	Very low	43.8	Very low	127 Å²	127	148.3 Å²	148.3	68%	0.679	75%	0.75	S	S	*	*			trans	-66	104.8	167.4	170.3	24.4	0	0	0	104.9	S80 T84	S80-N82 PolarHBondContact O-N 2.89Å; N82-T84 PolarHBondContact O-N 3.37Å
83	E	39.8	Very low	43.9	Very low	170 Å²	170	151.1 Å²	151.1	79%	0.794	76%	0.757	S	S	*	*			trans	-30.3	108.5	160.4	-72.5	-178.6	134.8	0	0	107.4	E81 E85	E81-E83 VanDerWaalsContact C-N 3.35Å; E81-E83 PolarHBondContact O-N 3.16Å; E83-E85 PolarHBondContact O-N 3.21Å
84	T	42	Very low	44.3	Very low	133 Å²	133	146.4 Å²	146.4	82%	0.816	74%	0.737	S	S	*	*			trans	-66.3	71.6	169	47.6	0	0	0	0	106.4	N82 M86	N82-T84 PolarHBondContact O-N 3.37Å; T84-M86 PolarHBondContact O-N 2.82Å; T84-M86 VanDerWaalsContact O-N 3.12Å
85	E	41.4	Very low	44.7	Very low	170 Å²	170	143.3 Å²	143.3	79%	0.794	72%	0.722	S	S	*	*			trans	-49.5	121.8	164.5	-172.7	176.2	-167.6	0	0	103.6	E83 V87	E83-E85 PolarHBondContact O-N 3.21Å; E85-V87 PolarHBondContact O-N 3.41Å
86	M	36	Very low	44.9	Very low	152 Å²	152	137.4 Å²	137.4	75%	0.749	70%	0.7	S	S	*	*			trans	-58.9	90.2	-172.1	-56.5	-177.2	-53.7	0	0	107.7	T84 Q88	T84-M86 PolarHBondContact O-N 2.82Å; T84-M86 VanDerWaalsContact O-N 3.12Å; M86-Q88 HydrophobicContact CB-CG 4.46Å; M86-Q88 PolarHBondContact O-N 3.34Å
87	V	40.9	Very low	45.3	Very low	133 Å²	133	138.6 Å²	138.6	81%	0.806	69%	0.691	S	S	*	*			trans	-64.6	87.8	156.4	-173.5	0	0	0	0	101.9	E85 K89	E85-V87 PolarHBondContact O-N 3.41Å; V87-K89 PolarHBondContact O-N 2.93Å
88	Q	40.9	Very low	45.7	Very low	148 Å²	148	134.7 Å²	134.7	69%	0.692	68%	0.679	S	S	*	*			trans	-54.8	100.1	170.6	-72.1	-176.8	-2.2	0	0	103.4	M86 L90	M86-Q88 HydrophobicContact CB-CG 4.46Å; M86-Q88 PolarHBondContact O-N 3.34Å; Q88-L90 PolarHBondContact O-N 2.66Å
89	K	47.6	Very low	46.5	Very low	190 Å²	190	129.2 Å²	129.2	83%	0.826	66%	0.655	S	S	*	*			trans	-66.2	85.6	179.8	-157.8	173.5	-168.6	172.9	0	103.8	V87 K91	V87-K89 PolarHBondContact O-N 2.93Å; K89-K91 PolarHBondContact O-N 2.94Å
90	L	40.6	Very low	47.6	Very low	121 Å²	121	125.1 Å²	125.1	63%	0.634	64%	0.639	S	S	*	*			trans	-52.6	109.8	172.7	-81.4	166.1	0	0	0	103.7	Q88 E92 V95	Q88-L90 PolarHBondContact O-N 2.66Å; L90-E92 PolarHBondContact O-N 2.79Å; L90-V95 HydrophobicContact CB-CG2 3.88Å; L90-V95 HydrophobicContact CD1-CG2 4.46Å
91	K	54.3	Low	48.5	Very low	137 Å²	137	126 Å²	126	60%	0.596	63%	0.631	S	S	*	*			trans	-61.7	141	178.7	-65.7	-179.4	179	178	0	105.5	K89 E93 D94 V95	K89-K91 PolarHBondContact O-N 2.94Å; K91-E93 PolarHBondContact O-N 2.78Å; K91-D94 PolarHBondContact N-OD2 3.14Å; K91-D94 WeakPolarHBondContact O-CA 3.29Å; K91-D94 WeakPolarHBondContact O-CB 3.15Å; K91-D94 PolarHBondContact O-N 2.99Å; K91-V95 PolarHBondContact O-N 2.86Å
92	E	51.8	Low	49	Very low	181 Å²	181	120 Å²	120	85%	0.846	61%	0.605	S	S	*	*	H	α-helix	trans	-48.5	-36.1	176.5	-172.5	-179.7	168.1	0	0	111.2	L90 D94 V95 G96	L90-E92 PolarHBondContact O-N 2.79Å; E92-D94 PolarHBondContact O-N 3.21Å; E92-V95 PolarHBondContact O-N 2.84Å; E92-G96 PolarHBondContact O-N 3.23Å
93	E	51.6	Low	49.5	Very low	138 Å²	138	116.2 Å²	116.2	65%	0.645	58%	0.582	S	S	*	*	H	α-helix	trans	-59.2	-38	172.7	-63.1	-179.1	-174.8	0	0	114.3	K91 R97	K91-E93 PolarHBondContact O-N 2.78Å; E93-R97 VanDerWaalsContact O-CB 3.28Å; E93-R97 WeakPolarHBondContact O-CB 3.45Å; E93-R97 PolarHBondContact O-N 2.81Å
94	D	56.5	Low	50.5	Low	64 Å²	64	111.7 Å²	111.7	34%	0.342	57%	0.569	S	S	.	*	H	α-helix	trans	-72.3	-42.6	-179.5	-64.4	-36	0	0	0	110.8	K91 E92 R97 V98	K91-D94 PolarHBondContact N-OD2 3.14Å; K91-D94 WeakPolarHBondContact O-CA 3.29Å; K91-D94 WeakPolarHBondContact O-CB 3.15Å; K91-D94 PolarHBondContact O-N 2.99Å; E92-D94 PolarHBondContact O-N 3.21Å; D94-R97 PolarHBondContact O-N 3.43Å; D94-V98 WeakPolarHBondContact O-CG2 3.45Å; D94-V98 PolarHBondContact O-N 3.32Å
95	V	51.7	Low	51.2	Low	46 Å²	46	110.7 Å²	110.7	28%	0.279	55%	0.553	S	S	.	*	H	α-helix	trans	-63.6	-46.8	175.7	-177.1	0	0	0	0	110.5	L90 K91 E92 R97 V98 L99 L124	L90-V95 HydrophobicContact CB-CG2 3.88Å; L90-V95 HydrophobicContact CD1-CG2 4.46Å; K91-V95 PolarHBondContact O-N 2.86Å; E92-V95 PolarHBondContact O-N 2.84Å; V95-R97 VanDerWaalsContact C-N 3.28Å; V95-R97 PolarHBondContact O-N 3.31Å; V95-V98 PolarHBondContact O-N 3.37Å; V95-L99 WeakPolarHBondContact O-CB 3.25Å; V95-L99 PolarHBondContact O-N 3.41Å; V95-L124 HydrophobicContact CG1-CD2 3.72Å
96	G	50.9	Low	51.6	Low	41 Å²	41	102.6 Å²	102.6	42%	0.423	52%	0.515	S	S	.	.	H	α-helix	trans	-58.9	-39.6	176.6	0	0	0	0	0	112.5	E92 L100	E92-G96 PolarHBondContact O-N 3.23Å; G96-L100 VanDerWaalsContact O-CB 3.3Å; G96-L100 WeakPolarHBondContact O-CB 3.46Å; G96-L100 PolarHBondContact O-N 2.88Å
97	R	57.5	Low	52.5	Low	141 Å²	141	97.9 Å²	97.9	53%	0.532	50%	0.501	S	S	.	.	H	α-helix	trans	-67	-46	177.8	-167.9	-170.6	-46.3	-102.9	-3.3	112.4	E93 D94 V95 L100 Q101	E93-R97 VanDerWaalsContact O-CB 3.28Å; E93-R97 WeakPolarHBondContact O-CB 3.45Å; E93-R97 PolarHBondContact O-N 2.81Å; D94-R97 PolarHBondContact O-N 3.43Å; V95-R97 VanDerWaalsContact C-N 3.28Å; V95-R97 PolarHBondContact O-N 3.31Å; R97-L100 PolarHBondContact O-N 2.83Å; R97-Q101 WeakPolarHBondContact O-CG 3.09Å; R97-Q101 PolarHBondContact O-N 3.42Å
98	V	53	Low	52.7	Low	91 Å²	91	98.1 Å²	98.1	55%	0.552	49%	0.493	S	S	*	.	H	α-helix	trans	-63.6	-44	178	172.1	0	0	0	0	110.6	D94 V95 L100 Q101 L102	D94-V98 WeakPolarHBondContact O-CG2 3.45Å; D94-V98 PolarHBondContact O-N 3.32Å; V95-V98 PolarHBondContact O-N 3.37Å; V98-L100 VanDerWaalsContact C-N 3.35Å; V98-L100 PolarHBondContact O-N 3.25Å; V98-Q101 PolarHBondContact O-N 2.93Å; V98-L102 WeakPolarHBondContact O-CB 3.25Å; V98-L102 PolarHBondContact O-N 3.44Å
99	L	56.4	Low	54	Low	35 Å²	35	97.1 Å²	97.1	18%	0.183	49%	0.486	C	S	.	.	H	α-helix	trans	-63.6	-41.4	178.2	-174.2	65	0	0	0	111.8	V95 L102 K103 E121	V95-L99 WeakPolarHBondContact O-CB 3.25Å; V95-L99 PolarHBondContact O-N 3.41Å; L99-L102 PolarHBondContact O-N 3.3Å; L99-K103 WeakPolarHBondContact O-CB 3.43Å; L99-K103 WeakPolarHBondContact O-CG 3.46Å; L99-K103 PolarHBondContact O-N 2.98Å; L99-E121 HydrophobicContact CD1-CB 4.17Å; L99-E121 HydrophobicContact CD1-CG 4.42Å; L99-E121 HydrophobicContact CD2-CG 3.87Å
100	L	60.2	Low	54.5	Low	107 Å²	107	90 Å²	90	56%	0.56	46%	0.46	S	S	*	.	H	α-helix	trans	-62.9	-44.5	174.5	-177.2	63.6	0	0	0	111.7	G96 R97 V98 L102 K103 C104	G96-L100 VanDerWaalsContact O-CB 3.3Å; G96-L100 WeakPolarHBondContact O-CB 3.46Å; G96-L100 PolarHBondContact O-N 2.88Å; R97-L100 PolarHBondContact O-N 2.83Å; V98-L100 VanDerWaalsContact C-N 3.35Å; V98-L100 PolarHBondContact O-N 3.25Å; L100-L102 VanDerWaalsContact C-N 3.34Å; L100-L102 PolarHBondContact O-N 3.17Å; L100-K103 WeakPolarHBondContact O-CB 3.43Å; L100-K103 PolarHBondContact O-N 3.33Å; L100-C104 PolarHBondContact O-N 2.89Å; L100-C104 PolarHBondContact O-SG 3.5Å; L100-C104 VanDerWaalsContact O-SG 3.36Å
101	Q	57.8	Low	55.3	Low	125 Å²	125	88.3 Å²	88.3	58%	0.584	46%	0.457	S	S	*	.	H	α-helix	trans	-60	-44.5	175.9	-77.8	179.6	-14.5	0	0	111.7	R97 V98 K103 C104 F105	R97-Q101 WeakPolarHBondContact O-CG 3.09Å; R97-Q101 PolarHBondContact O-N 3.42Å; V98-Q101 PolarHBondContact O-N 2.93Å; Q101-K103 VanDerWaalsContact C-N 3.31Å; Q101-K103 PolarHBondContact O-N 3.16Å; Q101-C104 PolarHBondContact O-N 2.63Å; Q101-F105 VanDerWaalsContact O-CB 3.3Å; Q101-F105 WeakPolarHBondContact O-CB 3.36Å; Q101-F105 PolarHBondContact O-N 3Å
102	L	52.5	Low	55.5	Low	71 Å²	71	88.7 Å²	88.7	37%	0.372	46%	0.458	S	S	.	.	H	α-helix	trans	-61.9	-40.2	176.8	-175.8	62.4	0	0	0	111.5	V98 L99 L100 A106 V117	V98-L102 WeakPolarHBondContact O-CB 3.25Å; V98-L102 PolarHBondContact O-N 3.44Å; L99-L102 PolarHBondContact O-N 3.3Å; L100-L102 VanDerWaalsContact C-N 3.34Å; L100-L102 PolarHBondContact O-N 3.17Å; L102-A106 VanDerWaalsContact O-CB 3.26Å; L102-A106 WeakPolarHBondContact O-CB 3.46Å; L102-A106 PolarHBondContact O-N 2.83Å; L102-V117 HydrophobicContact CD1-CG2 4.45Å; L102-V117 HydrophobicContact CD2-CG1 4.12Å; L102-V117 HydrophobicContact CD2-CG2 4.11Å; L102-V117 HydrophobicContact CG-CG1 4.17Å; L102-V117 HydrophobicContact CG-CG2 3.9Å
103	K	55.6	Low	55.6	Low	46 Å²	46	84 Å²	84	20%	0.2	44%	0.437	C	S	.	.	H	α-helix	trans	-63.5	-48.5	174.7	-76.8	174.9	177.6	175.5	0	112.2	L99 L100 Q101 F105 A106 A107 V117 E121	L99-K103 WeakPolarHBondContact O-CB 3.43Å; L99-K103 WeakPolarHBondContact O-CG 3.46Å; L99-K103 PolarHBondContact O-N 2.98Å; L100-K103 WeakPolarHBondContact O-CB 3.43Å; L100-K103 PolarHBondContact O-N 3.33Å; Q101-K103 VanDerWaalsContact C-N 3.31Å; Q101-K103 PolarHBondContact O-N 3.16Å; K103-F105 VanDerWaalsContact C-N 3.34Å; K103-F105 PolarHBondContact O-N 3.47Å; K103-A106 PolarHBondContact O-N 3.28Å; K103-A107 VanDerWaalsContact O-CB 3.3Å; K103-A107 WeakPolarHBondContact O-CB 3.33Å; K103-A107 PolarHBondContact O-N 2.97Å; K103-V117 HydrophobicContact CG-CG1 3.87Å; K103-E121 WeakPolarHBondContact CE-OE2 3.49Å; K103-E121 IonicContact NZ-OE1 2.71Å; K103-E121 PolarHBondContact NZ-OE1 2.89Å; K103-E121 IonicContact NZ-OE2 2.75Å; K103-E121 PolarHBondContact NZ-OE2 2.99Å
104	C	61.2	Low	55.8	Low	76 Å²	76	80.5 Å²	80.5	51%	0.514	42%	0.422	S	S	.	.	H	α-helix	trans	-61.2	-43.9	177.5	-68.5	0	0	0	0	111.4	L100 Q101 A107 E108	L100-C104 PolarHBondContact O-N 2.89Å; L100-C104 PolarHBondContact O-SG 3.5Å; L100-C104 VanDerWaalsContact O-SG 3.36Å; Q101-C104 PolarHBondContact O-N 2.63Å; C104-A107 PolarHBondContact O-N 3.22Å; C104-E108 WeakPolarHBondContact O-CB 3.42Å; C104-E108 PolarHBondContact O-N 3.01Å
105	F	56	Low	55.9	Low	111 Å²	111	80 Å²	80	49%	0.487	42%	0.424	S	S	.	.	H	α-helix	trans	-62.3	-46.8	177	-179.6	-93.3	0	0	0	112	Q101 K103 E108 K109	Q101-F105 VanDerWaalsContact O-CB 3.3Å; Q101-F105 WeakPolarHBondContact O-CB 3.36Å; Q101-F105 PolarHBondContact O-N 3Å; K103-F105 VanDerWaalsContact C-N 3.34Å; K103-F105 PolarHBondContact O-N 3.47Å; F105-E108 PolarHBondContact O-N 2.84Å; F105-K109 HydrophobicContact CD2-CG 4.03Å; F105-K109 HydrophobicContact CE1-CB 4.38Å; F105-K109 HydrophobicContact CE1-CG 4.41Å; F105-K109 HydrophobicContact CE2-CG 3.74Å; F105-K109 HydrophobicContact CG-CG 4.49Å; F105-K109 HydrophobicContact CZ-CB 4.3Å; F105-K109 HydrophobicContact CZ-CG 3.95Å; F105-K109 WeakPolarHBondContact O-CB 3.29Å; F105-K109 PolarHBondContact O-N 3.5Å
106	A	50.8	Low	56	Low	0 Å²	0	80.4 Å²	80.4	0%	0	43%	0.432	C	S	.	.	H	α-helix	trans	-64.4	-41	177.6	0	0	0	0	0	111.6	L102 K103 E108 C110 M113 L114 V117	L102-A106 VanDerWaalsContact O-CB 3.26Å; L102-A106 WeakPolarHBondContact O-CB 3.46Å; L102-A106 PolarHBondContact O-N 2.83Å; K103-A106 PolarHBondContact O-N 3.28Å; A106-E108 VanDerWaalsContact C-N 3.33Å; A106-E108 PolarHBondContact O-N 2.71Å; A106-C110 CarbonylContact O-C 2.86Å; A106-C110 WeakPolarHBondContact O-CA 3.27Å; A106-C110 PolarHBondContact O-N 2.92Å; A106-M113 HydrophobicContact CB-CB 4.45Å; A106-L114 HydrophobicContact CB-CD2 3.71Å; A106-L114 HydrophobicContact CB-CG 4.33Å; A106-V117 HydrophobicContact CB-CG2 3.89Å
107	A	54.4	Low	56.1	Low	54 Å²	54	78.8 Å²	78.8	45%	0.446	41%	0.414	S	S	.	.	H	α-helix	trans	-62.5	-38.6	176.9	0	0	0	0	0	112.6	K103 C104 L114	K103-A107 VanDerWaalsContact O-CB 3.3Å; K103-A107 WeakPolarHBondContact O-CB 3.33Å; K103-A107 PolarHBondContact O-N 2.97Å; C104-A107 PolarHBondContact O-N 3.22Å; A107-L114 HydrophobicContact CB-CD2 4.35Å
108	E	46.1	Very low	56.2	Low	137 Å²	137	73.2 Å²	73.2	64%	0.64	40%	0.398	S	S	*	.	H	α-helix	trans	-79.2	-46.3	-179.2	-165.5	-161.1	149.5	0	0	112.7	C104 F105 A106	C104-E108 WeakPolarHBondContact O-CB 3.42Å; C104-E108 PolarHBondContact O-N 3.01Å; F105-E108 PolarHBondContact O-N 2.84Å; A106-E108 VanDerWaalsContact C-N 3.33Å; A106-E108 PolarHBondContact O-N 2.71Å
109	K	68.3	Low	56.6	Low	127 Å²	127	74.6 Å²	74.6	55%	0.552	40%	0.401	S	S	*	.	H	α-helix	trans	-95.6	-34.6	-168.3	-59.5	-52	-171.6	-162.3	0	113.7	F105	F105-K109 HydrophobicContact CD2-CG 4.03Å; F105-K109 HydrophobicContact CE1-CB 4.38Å; F105-K109 HydrophobicContact CE1-CG 4.41Å; F105-K109 HydrophobicContact CE2-CG 3.74Å; F105-K109 HydrophobicContact CG-CG 4.49Å; F105-K109 HydrophobicContact CZ-CB 4.3Å; F105-K109 HydrophobicContact CZ-CG 3.95Å; F105-K109 WeakPolarHBondContact O-CB 3.29Å; F105-K109 PolarHBondContact O-N 3.5Å
110	C	56.9	Low	56.5	Low	42 Å²	42	75.4 Å²	75.4	28%	0.284	41%	0.413	S	S	.	.			trans	-154.9	80.5	-173.3	-168.9	0	0	0	0	110.8	A106 K112 M113	A106-C110 CarbonylContact O-C 2.86Å; A106-C110 WeakPolarHBondContact O-CA 3.27Å; A106-C110 PolarHBondContact O-N 2.92Å; C110-K112 PolarHBondContact O-N 2.9Å; C110-M113 HydrophobicContact CB-CB 4.18Å; C110-M113 HydrophobicContact CB-CG 4.14Å; C110-M113 HydrophobicContact CB-SD 3.94Å; C110-M113 WeakPolarHBondContact O-CB 3.5Å; C110-M113 PolarHBondContact O-N 3.36Å
111	P	57	Low	56.5	Low	85 Å²	85	72.1 Å²	72.1	55%	0.552	40%	0.395	S	S	*	.	G	3₁₀ helix	trans	-53.8	-28.5	179.2	-27.1	33.8	0	0	0	112.9	M113 L114	P111-M113 VanDerWaalsContact C-N 3.25Å; P111-M113 PolarHBondContact O-N 3.43Å; P111-L114 HydrophobicContact CB-CD1 4.44Å; P111-L114 VanDerWaalsContact O-CB 3.27Å; P111-L114 WeakPolarHBondContact O-CB 3.4Å; P111-L114 WeakPolarHBondContact O-CG 3.3Å; P111-L114 PolarHBondContact O-N 2.86Å; P111-L114 VanDerWaalsContact O-N 3.1Å
112	K	59.4	Low	56.6	Low	144 Å²	144	68 Å²	68	63%	0.626	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-61.4	-30.7	175.2	-58.4	-173.9	-174.4	-175.9	0	113	C110 L114 S115 Y188	C110-K112 PolarHBondContact O-N 2.9Å; K112-L114 VanDerWaalsContact C-N 3.31Å; K112-L114 PolarHBondContact O-N 2.83Å; K112-S115 PolarHBondContact O-OG 3.18Å; K112-Y188 WeakPolarHBondContact CE-OH 3.27Å; K112-Y188 PolarHBondContact NZ-OH 3.37Å
113	M	54.2	Low	56.9	Low	84 Å²	84	67.5 Å²	67.5	41%	0.414	39%	0.386	S	S	.	.	G	3₁₀ helix	trans	-74.9	-13.5	175.9	-83.8	174.5	61.2	0	0	113.8	A106 C110 P111 S115 A116 V117	A106-M113 HydrophobicContact CB-CB 4.45Å; C110-M113 HydrophobicContact CB-CB 4.18Å; C110-M113 HydrophobicContact CB-CG 4.14Å; C110-M113 HydrophobicContact CB-SD 3.94Å; C110-M113 WeakPolarHBondContact O-CB 3.5Å; C110-M113 PolarHBondContact O-N 3.36Å; P111-M113 VanDerWaalsContact C-N 3.25Å; P111-M113 PolarHBondContact O-N 3.43Å; M113-S115 PolarHBondContact O-N 2.85Å; M113-S115 VanDerWaalsContact O-N 3.12Å; M113-A116 WeakPolarHBondContact O-CB 3.33Å; M113-A116 PolarHBondContact O-N 3.33Å; M113-V117 WeakPolarHBondContact O-CG2 3.24Å; M113-V117 PolarHBondContact O-N 2.81Å
114	L	55.8	Low	56.8	Low	63 Å²	63	68.5 Å²	68.5	33%	0.33	39%	0.393	S	S	.	.	H	α-helix	trans	-56.1	-32.5	178.7	-69.8	172.2	0	0	0	112.1	A106 A107 P111 K112 V117 A118	A106-L114 HydrophobicContact CB-CD2 3.71Å; A106-L114 HydrophobicContact CB-CG 4.33Å; A107-L114 HydrophobicContact CB-CD2 4.35Å; P111-L114 HydrophobicContact CB-CD1 4.44Å; P111-L114 VanDerWaalsContact O-CB 3.27Å; P111-L114 WeakPolarHBondContact O-CB 3.4Å; P111-L114 WeakPolarHBondContact O-CG 3.3Å; P111-L114 PolarHBondContact O-N 2.86Å; P111-L114 VanDerWaalsContact O-N 3.1Å; K112-L114 VanDerWaalsContact C-N 3.31Å; K112-L114 PolarHBondContact O-N 2.83Å; L114-V117 PolarHBondContact O-N 3.45Å; L114-A118 WeakPolarHBondContact O-CB 3.49Å; L114-A118 PolarHBondContact O-N 2.93Å
115	S	58.9	Low	56.7	Low	55 Å²	55	65.7 Å²	65.7	39%	0.385	38%	0.377	S	S	.	.	H	α-helix	trans	-61.2	-47.8	172.7	60.8	0	0	0	0	112.8	K112 M113 V117 A118 I119	K112-S115 PolarHBondContact O-OG 3.18Å; M113-S115 PolarHBondContact O-N 2.85Å; M113-S115 VanDerWaalsContact O-N 3.12Å; S115-V117 VanDerWaalsContact C-N 3.31Å; S115-V117 PolarHBondContact O-N 2.93Å; S115-A118 PolarHBondContact O-N 3.27Å; S115-I119 WeakPolarHBondContact O-CG1 3.41Å; S115-I119 PolarHBondContact O-N 3.31Å
116	A	53	Low	56.8	Low	54 Å²	54	63 Å²	63	45%	0.446	38%	0.375	S	S	.	.	H	α-helix	trans	-63.8	-37.7	176.2	0	0	0	0	0	111.6	M113 I119 A120	M113-A116 WeakPolarHBondContact O-CB 3.33Å; M113-A116 PolarHBondContact O-N 3.33Å; A116-I119 PolarHBondContact O-N 3.12Å; A116-A120 WeakPolarHBondContact O-CB 3.45Å; A116-A120 PolarHBondContact O-N 2.83Å
117	V	52.9	Low	57.1	Low	6 Å²	6	69.3 Å²	69.3	4%	0.036	40%	0.4	C	S	.	.	H	α-helix	trans	-64.1	-40.4	174.5	177.2	0	0	0	0	111.3	L102 K103 A106 M113 L114 S115 A120 E121	L102-V117 HydrophobicContact CD1-CG2 4.45Å; L102-V117 HydrophobicContact CD2-CG1 4.12Å; L102-V117 HydrophobicContact CD2-CG2 4.11Å; L102-V117 HydrophobicContact CG-CG1 4.17Å; L102-V117 HydrophobicContact CG-CG2 3.9Å; K103-V117 HydrophobicContact CG-CG1 3.87Å; A106-V117 HydrophobicContact CB-CG2 3.89Å; M113-V117 WeakPolarHBondContact O-CG2 3.24Å; M113-V117 PolarHBondContact O-N 2.81Å; L114-V117 PolarHBondContact O-N 3.45Å; S115-V117 VanDerWaalsContact C-N 3.31Å; S115-V117 PolarHBondContact O-N 2.93Å; V117-A120 PolarHBondContact O-N 3.38Å; V117-E121 WeakPolarHBondContact O-CB 3.29Å; V117-E121 PolarHBondContact O-N 3.37Å
118	A	60.2	Low	57.2	Low	24 Å²	24	70 Å²	70	20%	0.198	40%	0.398	C	S	.	.	H	α-helix	trans	-66.4	-38.1	177.2	0	0	0	0	0	112.7	L114 S115 E121 S122	L114-A118 WeakPolarHBondContact O-CB 3.49Å; L114-A118 PolarHBondContact O-N 2.93Å; S115-A118 PolarHBondContact O-N 3.27Å; A118-E121 PolarHBondContact O-N 3.15Å; A118-S122 PolarHBondContact O-N 3.47Å; A118-S122 PolarHBondContact O-OG 3.15Å
119	I	61.9	Low	57.7	Low	120 Å²	120	65 Å²	65	62%	0.615	38%	0.378	S	S	*	.	H	α-helix	trans	-64.9	-46.1	173.5	-65.7	167	0	0	0	110.1	S115 A116 E121 S122 A123	S115-I119 WeakPolarHBondContact O-CG1 3.41Å; S115-I119 PolarHBondContact O-N 3.31Å; A116-I119 PolarHBondContact O-N 3.12Å; I119-E121 VanDerWaalsContact C-N 3.31Å; I119-E121 PolarHBondContact O-N 3.32Å; I119-S122 PolarHBondContact O-N 2.63Å; I119-A123 WeakPolarHBondContact O-CB 3.42Å; I119-A123 PolarHBondContact O-N 2.94Å
120	A	54.3	Low	57.1	Low	52 Å²	52	63 Å²	63	43%	0.43	38%	0.377	S	S	.	.	H	α-helix	trans	-61.1	-39.6	177.4	0	0	0	0	0	112.1	A116 V117 A123 L124	A116-A120 WeakPolarHBondContact O-CB 3.45Å; A116-A120 PolarHBondContact O-N 2.83Å; V117-A120 PolarHBondContact O-N 3.38Å; A120-A123 PolarHBondContact O-N 3.13Å; A120-L124 VanDerWaalsContact O-CB 3.28Å; A120-L124 WeakPolarHBondContact O-CB 3.25Å; A120-L124 PolarHBondContact O-N 3.02Å
121	E	58.6	Low	56.9	Low	39 Å²	39	65.2 Å²	65.2	18%	0.182	38%	0.383	C	S	.	.	H	α-helix	trans	-61.9	-43.9	173.9	179.9	171.3	-161.7	0	0	112	L99 K103 V117 A118 I119 L124 G125	L99-E121 HydrophobicContact CD1-CB 4.17Å; L99-E121 HydrophobicContact CD1-CG 4.42Å; L99-E121 HydrophobicContact CD2-CG 3.87Å; K103-E121 WeakPolarHBondContact CE-OE2 3.49Å; K103-E121 IonicContact NZ-OE1 2.71Å; K103-E121 PolarHBondContact NZ-OE1 2.89Å; K103-E121 IonicContact NZ-OE2 2.75Å; K103-E121 PolarHBondContact NZ-OE2 2.99Å; V117-E121 WeakPolarHBondContact O-CB 3.29Å; V117-E121 PolarHBondContact O-N 3.37Å; A118-E121 PolarHBondContact O-N 3.15Å; I119-E121 VanDerWaalsContact C-N 3.31Å; I119-E121 PolarHBondContact O-N 3.32Å; E121-L124 PolarHBondContact O-N 3.19Å; E121-G125 PolarHBondContact O-N 2.78Å
122	S	60.4	Low	57	Low	37 Å²	37	64.5 Å²	64.5	26%	0.259	38%	0.379	S	S	.	.	H	α-helix	trans	-65.3	-44	178.4	-55	0	0	0	0	111.4	A118 I119 L124 G125 A126	A118-S122 PolarHBondContact O-N 3.47Å; A118-S122 PolarHBondContact O-OG 3.15Å; I119-S122 PolarHBondContact O-N 2.63Å; S122-L124 VanDerWaalsContact C-N 3.33Å; S122-L124 PolarHBondContact O-N 2.85Å; S122-G125 PolarHBondContact O-N 3.25Å; S122-A126 PolarHBondContact O-N 3.46Å
123	A	57.9	Low	56.7	Low	61 Å²	61	58.2 Å²	58.2	50%	0.504	36%	0.355	S	S	.	.	H	α-helix	trans	-63.2	-39.9	176.1	0	0	0	0	0	111.6	I119 A120 A126 Y127	I119-A123 WeakPolarHBondContact O-CB 3.42Å; I119-A123 PolarHBondContact O-N 2.94Å; A120-A123 PolarHBondContact O-N 3.13Å; A123-A126 PolarHBondContact O-N 3.2Å; A123-Y127 WeakPolarHBondContact O-CB 3.35Å; A123-Y127 PolarHBondContact O-N 3.17Å
124	L	55.5	Low	56.6	Low	68 Å²	68	60.9 Å²	60.9	36%	0.356	37%	0.365	S	S	.	.	H	α-helix	trans	-66.2	-42.2	175.8	-173.8	65.2	0	0	0	111.6	V95 A120 E121 S122 Y127 V128	V95-L124 HydrophobicContact CG1-CD2 3.72Å; A120-L124 VanDerWaalsContact O-CB 3.28Å; A120-L124 WeakPolarHBondContact O-CB 3.25Å; A120-L124 PolarHBondContact O-N 3.02Å; E121-L124 PolarHBondContact O-N 3.19Å; S122-L124 VanDerWaalsContact C-N 3.33Å; S122-L124 PolarHBondContact O-N 2.85Å; L124-Y127 PolarHBondContact O-N 2.91Å; L124-V128 HydrophobicContact CD1-CG2 4.43Å; L124-V128 HydrophobicContact CG-CG2 4.48Å; L124-V128 WeakPolarHBondContact O-CB 3.47Å; L124-V128 VanDerWaalsContact O-CG2 3.31Å; L124-V128 WeakPolarHBondContact O-CG2 3.42Å; L124-V128 PolarHBondContact O-N 2.92Å
125	G	58.9	Low	56.8	Low	17 Å²	17	60.7 Å²	60.7	18%	0.175	37%	0.368	C	S	.	.	H	α-helix	trans	-61.8	-42.4	175.3	0	0	0	0	0	112.5	E121 S122 C129	E121-G125 PolarHBondContact O-N 2.78Å; S122-G125 PolarHBondContact O-N 3.25Å; G125-C129 WeakPolarHBondContact O-CB 3.45Å; G125-C129 PolarHBondContact O-N 2.71Å; G125-C129 PolarHBondContact O-SG 3.33Å
126	A	57.8	Low	56.8	Low	54 Å²	54	59 Å²	59	45%	0.446	36%	0.358	S	S	.	.	H	α-helix	trans	-63	-46.4	173.5	0	0	0	0	0	111.8	S122 A123 C129 T130	S122-A126 PolarHBondContact O-N 3.46Å; A123-A126 PolarHBondContact O-N 3.2Å; A126-C129 WeakPolarHBondContact O-CB 3.25Å; A126-C129 PolarHBondContact O-N 2.88Å; A126-T130 WeakPolarHBondContact O-CG2 3.22Å; A126-T130 PolarHBondContact O-N 3.44Å; A126-T130 PolarHBondContact O-OG1 2.71Å
127	Y	57	Low	56.8	Low	132 Å²	132	58.3 Å²	58.3	52%	0.518	35%	0.348	S	S	.	.	H	α-helix	trans	-60.9	-46.6	177.5	176.4	-98.3	0	0	0	112.4	A123 L124 C129 T130 E131	A123-Y127 WeakPolarHBondContact O-CB 3.35Å; A123-Y127 PolarHBondContact O-N 3.17Å; L124-Y127 PolarHBondContact O-N 2.91Å; Y127-C129 VanDerWaalsContact C-N 3.27Å; Y127-C129 PolarHBondContact O-N 3.44Å; Y127-T130 WeakPolarHBondContact CA-OG1 3.14Å; Y127-T130 PolarHBondContact O-N 3.5Å; Y127-T130 VanDerWaalsContact O-N 3.15Å; Y127-T130 PolarHBondContact O-OG1 3.07Å; Y127-E131 HydrophobicContact CD1-CG 4.02Å; Y127-E131 HydrophobicContact CD2-CG 4.05Å; Y127-E131 HydrophobicContact CE1-CG 3.54Å; Y127-E131 HydrophobicContact CE2-CG 3.58Å; Y127-E131 HydrophobicContact CG-CG 4.26Å; Y127-E131 WeakPolarHBondContact O-CB 3.31Å; Y127-E131 WeakPolarHBondContact O-CG 3.49Å; Y127-E131 PolarHBondContact O-N 2.8Å
128	V	56.3	Low	56.9	Low	68 Å²	68	60.5 Å²	60.5	41%	0.412	36%	0.362	S	S	.	.	H	α-helix	trans	-62	-38.9	176.4	172.7	0	0	0	0	110.3	L124 T130 C132	L124-V128 HydrophobicContact CD1-CG2 4.43Å; L124-V128 HydrophobicContact CG-CG2 4.48Å; L124-V128 WeakPolarHBondContact O-CB 3.47Å; L124-V128 VanDerWaalsContact O-CG2 3.31Å; L124-V128 WeakPolarHBondContact O-CG2 3.42Å; L124-V128 PolarHBondContact O-N 2.92Å; V128-T130 PolarHBondContact O-N 3.46Å; V128-C132 WeakPolarHBondContact O-CB 3.48Å; V128-C132 PolarHBondContact O-N 2.85Å; V128-C132 PolarHBondContact O-SG 3.18Å
129	C	57.3	Low	57.1	Low	32 Å²	32	65.7 Å²	65.7	22%	0.216	38%	0.382	C	S	.	.	H	α-helix	trans	-63.7	-39.9	174.6	-68.5	0	0	0	0	112.6	G125 A126 Y127 G133 I167	G125-C129 WeakPolarHBondContact O-CB 3.45Å; G125-C129 PolarHBondContact O-N 2.71Å; G125-C129 PolarHBondContact O-SG 3.33Å; A126-C129 WeakPolarHBondContact O-CB 3.25Å; A126-C129 PolarHBondContact O-N 2.88Å; Y127-C129 VanDerWaalsContact C-N 3.27Å; Y127-C129 PolarHBondContact O-N 3.44Å; C129-G133 WeakPolarHBondContact O-CA 3.38Å; C129-G133 PolarHBondContact O-N 3.48Å; C129-I167 HydrophobicContact CB-CD1 4.34Å; C129-I167 HydrophobicContact CB-CG1 4.08Å
130	T	55.4	Low	56.8	Low	86 Å²	86	60.7 Å²	60.7	53%	0.528	36%	0.356	S	S	.	.	H	α-helix	trans	-70.5	-44.7	178	53.4	0	0	0	0	111.9	A126 Y127 V128 G133 F134	A126-T130 WeakPolarHBondContact O-CG2 3.22Å; A126-T130 PolarHBondContact O-N 3.44Å; A126-T130 PolarHBondContact O-OG1 2.71Å; Y127-T130 WeakPolarHBondContact CA-OG1 3.14Å; Y127-T130 PolarHBondContact O-N 3.5Å; Y127-T130 VanDerWaalsContact O-N 3.15Å; Y127-T130 PolarHBondContact O-OG1 3.07Å; V128-T130 PolarHBondContact O-N 3.46Å; T130-G133 WeakPolarHBondContact O-CA 3.43Å; T130-G133 PolarHBondContact O-N 2.89Å; T130-F134 WeakPolarHBondContact O-CB 3.48Å; T130-F134 PolarHBondContact O-N 2.67Å
131	E	52.1	Low	57	Low	89 Å²	89	62.8 Å²	62.8	42%	0.416	36%	0.359	S	S	.	.	H	α-helix	trans	-68.3	-44.7	179.5	-69.6	-56.1	126.2	0	0	111.9	Y127 G133 F134 S135	Y127-E131 HydrophobicContact CD1-CG 4.02Å; Y127-E131 HydrophobicContact CD2-CG 4.05Å; Y127-E131 HydrophobicContact CE1-CG 3.54Å; Y127-E131 HydrophobicContact CE2-CG 3.58Å; Y127-E131 HydrophobicContact CG-CG 4.26Å; Y127-E131 WeakPolarHBondContact O-CB 3.31Å; Y127-E131 WeakPolarHBondContact O-CG 3.49Å; Y127-E131 PolarHBondContact O-N 2.8Å; E131-G133 VanDerWaalsContact C-N 3.25Å; E131-G133 PolarHBondContact O-N 3.32Å; E131-F134 PolarHBondContact O-N 2.87Å; E131-S135 VanDerWaalsContact O-CB 3.24Å; E131-S135 WeakPolarHBondContact O-CB 3.24Å; E131-S135 PolarHBondContact O-N 3.38Å
132	C	59.3	Low	57.1	Low	69 Å²	69	65.3 Å²	65.3	47%	0.466	38%	0.381	S	S	.	.	H	α-helix	trans	-65.7	-33.4	173.7	-66.4	0	0	0	0	111.4	V128 A136 M163	V128-C132 WeakPolarHBondContact O-CB 3.48Å; V128-C132 PolarHBondContact O-N 2.85Å; V128-C132 PolarHBondContact O-SG 3.18Å; C132-A136 VanDerWaalsContact O-CB 3.22Å; C132-A136 WeakPolarHBondContact O-CB 3.48Å; C132-A136 PolarHBondContact O-N 2.89Å; C132-M163 WeakPolarHBondContact O-CE 3.44Å
133	G	53.1	Low	57.1	Low	12 Å²	12	65.6 Å²	65.6	12%	0.124	38%	0.384	C	S	.	.	H	α-helix	trans	-55.7	-58.9	169.8	0	0	0	0	0	112.1	C129 T130 E131 A136 V137 M163	C129-G133 WeakPolarHBondContact O-CA 3.38Å; C129-G133 PolarHBondContact O-N 3.48Å; T130-G133 WeakPolarHBondContact O-CA 3.43Å; T130-G133 PolarHBondContact O-N 2.89Å; E131-G133 VanDerWaalsContact C-N 3.25Å; E131-G133 PolarHBondContact O-N 3.32Å; G133-A136 PolarHBondContact O-N 2.7Å; G133-V137 WeakPolarHBondContact O-CB 3.45Å; G133-V137 VanDerWaalsContact O-CG2 3.24Å; G133-V137 WeakPolarHBondContact O-CG2 3.48Å; G133-V137 PolarHBondContact O-N 3.34Å; G133-M163 VanDerWaalsContact CA-CE 3.45Å; G133-M163 VanDerWaalsContact CA-SD 3.55Å
134	F	52.8	Low	57.1	Low	141 Å²	141	71.4 Å²	71.4	62%	0.618	40%	0.397	S	S	*	.	H	α-helix	trans	-63.4	-43.7	-178.4	-167.1	-100.4	0	0	0	111.9	T130 E131 A136 V137 T138	T130-F134 WeakPolarHBondContact O-CB 3.48Å; T130-F134 PolarHBondContact O-N 2.67Å; E131-F134 PolarHBondContact O-N 2.87Å; F134-A136 PolarHBondContact O-N 3.21Å; F134-V137 PolarHBondContact O-N 2.89Å; F134-T138 HydrophobicContact CD1-CG2 3.92Å; F134-T138 HydrophobicContact CE1-CG2 3.62Å; F134-T138 HydrophobicContact CE2-CG2 4.48Å; F134-T138 HydrophobicContact CG-CG2 4.47Å; F134-T138 HydrophobicContact CZ-CG2 3.93Å; F134-T138 WeakPolarHBondContact O-CB 3.49Å; F134-T138 VanDerWaalsContact O-CG2 3.27Å; F134-T138 WeakPolarHBondContact O-CG2 3.46Å; F134-T138 PolarHBondContact O-N 3.44Å; F134-T138 PolarHBondContact O-OG1 3.39Å
135	S	58.4	Low	57	Low	58 Å²	58	74.4 Å²	74.4	41%	0.406	40%	0.404	S	S	.	.	H	α-helix	trans	-59.9	-43.9	175.6	175.1	0	0	0	0	112	E131 T138 E139	E131-S135 VanDerWaalsContact O-CB 3.24Å; E131-S135 WeakPolarHBondContact O-CB 3.24Å; E131-S135 PolarHBondContact O-N 3.38Å; S135-T138 VanDerWaalsContact CA-OG1 3.29Å; S135-T138 WeakPolarHBondContact CA-OG1 3.37Å; S135-T138 PolarHBondContact O-N 3.42Å; S135-T138 PolarHBondContact O-OG1 3.35Å; S135-E139 WeakPolarHBondContact O-CB 3.25Å; S135-E139 WeakPolarHBondContact O-CG 3.5Å; S135-E139 PolarHBondContact O-N 2.88Å
136	A	59.3	Low	57	Low	19 Å²	19	76.2 Å²	76.2	16%	0.157	41%	0.414	C	S	.	.	H	α-helix	trans	-72.6	-35.2	-180	0	0	0	0	0	111.9	C132 G133 F134 L140 M159 M163	C132-A136 VanDerWaalsContact O-CB 3.22Å; C132-A136 WeakPolarHBondContact O-CB 3.48Å; C132-A136 PolarHBondContact O-N 2.89Å; G133-A136 PolarHBondContact O-N 2.7Å; F134-A136 PolarHBondContact O-N 3.21Å; A136-L140 VanDerWaalsContact O-CB 3.29Å; A136-L140 WeakPolarHBondContact O-CB 3.39Å; A136-L140 PolarHBondContact O-N 3.42Å; A136-M159 HydrophobicContact CB-CE 3.65Å; A136-M159 HydrophobicContact CB-CG 4.06Å; A136-M159 HydrophobicContact CB-SD 3.25Å; A136-M159 WeakPolarHBondContact CB-SD 3Å; A136-M159 WeakPolarHBondContact O-CE 3.39Å; A136-M163 HydrophobicContact CB-CE 3.71Å
137	V	53.3	Low	56.7	Low	40 Å²	40	81.3 Å²	81.3	24%	0.242	42%	0.422	C	S	.	.	H	α-helix	trans	-64.3	-43.9	172.6	171.9	0	0	0	0	110.8	G133 F134 L140 L141 L156 M159	G133-V137 WeakPolarHBondContact O-CB 3.45Å; G133-V137 VanDerWaalsContact O-CG2 3.24Å; G133-V137 WeakPolarHBondContact O-CG2 3.48Å; G133-V137 PolarHBondContact O-N 3.34Å; F134-V137 PolarHBondContact O-N 2.89Å; V137-L140 WeakPolarHBondContact O-CB 3.34Å; V137-L140 PolarHBondContact O-N 2.9Å; V137-L141 HydrophobicContact CG1-CD1 3.87Å; V137-L141 HydrophobicContact CG1-CG 4.34Å; V137-L141 WeakPolarHBondContact O-CB 3.45Å; V137-L141 VanDerWaalsContact O-CG 3.25Å; V137-L141 WeakPolarHBondContact O-CG 3.28Å; V137-L141 PolarHBondContact O-N 3.23Å; V137-L156 HydrophobicContact CG2-CD1 3.71Å; V137-M159 HydrophobicContact CG2-SD 4.31Å
138	T	55.7	Low	56.5	Low	53 Å²	53	80.4 Å²	80.4	33%	0.325	43%	0.426	S	S	.	.	H	α-helix	trans	-67.9	-39.9	177.8	50.9	0	0	0	0	112.3	F134 S135 L140 L141 S142	F134-T138 HydrophobicContact CD1-CG2 3.92Å; F134-T138 HydrophobicContact CE1-CG2 3.62Å; F134-T138 HydrophobicContact CE2-CG2 4.48Å; F134-T138 HydrophobicContact CG-CG2 4.47Å; F134-T138 HydrophobicContact CZ-CG2 3.93Å; F134-T138 WeakPolarHBondContact O-CB 3.49Å; F134-T138 VanDerWaalsContact O-CG2 3.27Å; F134-T138 WeakPolarHBondContact O-CG2 3.46Å; F134-T138 PolarHBondContact O-N 3.44Å; F134-T138 PolarHBondContact O-OG1 3.39Å; S135-T138 VanDerWaalsContact CA-OG1 3.29Å; S135-T138 WeakPolarHBondContact CA-OG1 3.37Å; S135-T138 PolarHBondContact O-N 3.42Å; S135-T138 PolarHBondContact O-OG1 3.35Å; T138-L140 VanDerWaalsContact C-N 3.29Å; T138-L140 PolarHBondContact O-N 2.88Å; T138-L141 PolarHBondContact O-N 3.46Å; T138-S142 VanDerWaalsContact O-CB 3.25Å; T138-S142 WeakPolarHBondContact O-CB 3.31Å; T138-S142 PolarHBondContact O-N 3.35Å; T138-S142 PolarHBondContact O-OG 2.83Å
139	E	63.4	Low	56.4	Low	132 Å²	132	80 Å²	80	62%	0.617	42%	0.421	S	S	*	.	H	α-helix	trans	-60.7	-38.5	170.6	-79.1	-173.6	180	0	0	112.2	S135 S142 S143	S135-E139 WeakPolarHBondContact O-CB 3.25Å; S135-E139 WeakPolarHBondContact O-CG 3.5Å; S135-E139 PolarHBondContact O-N 2.88Å; E139-S142 WeakPolarHBondContact CA-OG 3.31Å; E139-S142 PolarHBondContact O-OG 3.4Å; E139-S143 WeakPolarHBondContact O-CB 3.28Å; E139-S143 PolarHBondContact O-N 3.04Å
140	L	56.4	Low	56.2	Low	15 Å²	15	78.9 Å²	78.9	8%	0.079	41%	0.413	C	S	.	.	H	α-helix	trans	-67.7	-43.5	177.4	-173.5	63.6	0	0	0	111.2	A136 V137 T138 S143 I150 D155 L156 M159	A136-L140 VanDerWaalsContact O-CB 3.29Å; A136-L140 WeakPolarHBondContact O-CB 3.39Å; A136-L140 PolarHBondContact O-N 3.42Å; V137-L140 WeakPolarHBondContact O-CB 3.34Å; V137-L140 PolarHBondContact O-N 2.9Å; T138-L140 VanDerWaalsContact C-N 3.29Å; T138-L140 PolarHBondContact O-N 2.88Å; L140-S143 WeakPolarHBondContact O-CB 3.24Å; L140-I150 HydrophobicContact CD1-CG1 4.08Å; L140-I150 HydrophobicContact CD1-CG2 4.15Å; L140-I150 HydrophobicContact CD2-CG2 3.55Å; L140-I150 HydrophobicContact CG-CD1 4.26Å; L140-I150 HydrophobicContact CG-CG1 4.15Å; L140-I150 HydrophobicContact CG-CG2 3.63Å; L140-I150 WeakPolarHBondContact O-CD1 3.47Å; L140-D155 HydrophobicContact CD1-CB 3.78Å; L140-D155 HydrophobicContact CD2-CB 4.15Å; L140-L156 HydrophobicContact CD2-CB 3.82Å; L140-L156 HydrophobicContact CD2-CD1 4.24Å; L140-M159 HydrophobicContact CB-CE 4.22Å; L140-M159 HydrophobicContact CD2-CE 4.23Å
141	L	58.4	Low	55.9	Low	96 Å²	96	79.9 Å²	79.9	50%	0.503	42%	0.418	S	S	.	.	H	α-helix	trans	-71.5	-33.1	178.5	-69.1	174.5	0	0	0	113.1	V137 T138	V137-L141 HydrophobicContact CG1-CD1 3.87Å; V137-L141 HydrophobicContact CG1-CG 4.34Å; V137-L141 WeakPolarHBondContact O-CB 3.45Å; V137-L141 VanDerWaalsContact O-CG 3.25Å; V137-L141 WeakPolarHBondContact O-CG 3.28Å; V137-L141 PolarHBondContact O-N 3.23Å; T138-L141 PolarHBondContact O-N 3.46Å
142	S	60	Low	56	Low	92 Å²	92	81.3 Å²	81.3	64%	0.643	43%	0.429	S	S	*	.	H	α-helix	trans	-79.8	-19.6	176.9	68.8	0	0	0	0	112.9	T138 E139 K144	T138-S142 VanDerWaalsContact O-CB 3.25Å; T138-S142 WeakPolarHBondContact O-CB 3.31Å; T138-S142 PolarHBondContact O-N 3.35Å; T138-S142 PolarHBondContact O-OG 2.83Å; E139-S142 WeakPolarHBondContact CA-OG 3.31Å; E139-S142 PolarHBondContact O-OG 3.4Å; S142-K144 PolarHBondContact O-N 2.95Å
143	S	60.3	Low	56	Low	44 Å²	44	86.4 Å²	86.4	31%	0.308	44%	0.438	S	S	.	.	S	Bend	trans	-60.2	126.4	173.4	-159.9	0	0	0	0	109.7	E139 L140 R145	E139-S143 WeakPolarHBondContact O-CB 3.28Å; E139-S143 PolarHBondContact O-N 3.04Å; L140-S143 WeakPolarHBondContact O-CB 3.24Å; S143-R145 PolarHBondContact O-N 3.19Å
144	K	58.2	Low	56	Low	182 Å²	182	86.4 Å²	86.4	79%	0.791	44%	0.438	S	S	*	.	S	Bend	trans	-59.8	15.3	175.2	-73.1	-179.5	174.6	166.1	0	115	E78 S142	E78-K144 WeakPolarHBondContact OE1-CE 3.17Å; E78-K144 IonicContact OE1-NZ 2.93Å; E78-K144 PolarHBondContact OE1-NZ 3.27Å; S142-K144 PolarHBondContact O-N 2.95Å
145	R	54.5	Low	56.3	Low	131 Å²	131	81.4 Å²	81.4	49%	0.494	42%	0.418	S	S	.	.	S	Bend	trans	-66.6	146.8	167.9	-61.5	-174.1	-158.2	-171.9	3.4	108.1	S143 R147 I150 D155	S143-R145 PolarHBondContact O-N 3.19Å; R145-R147 PolarHBondContact O-N 3.5Å; R145-I150 HydrophobicContact CB-CG1 4.39Å; R145-D155 IonicContact CZ-OD2 3.95Å; R145-D155 IonicContact NH1-OD2 2.79Å; R145-D155 PolarHBondContact NH1-OD2 2.65Å
146	S	57.8	Low	56	Low	56 Å²	56	81.5 Å²	81.5	39%	0.392	41%	0.414	S	S	.	.			trans	-57.5	135	173.6	81	0	0	0	0	108.4	L148 D149 I150	S146-L148 PolarHBondContact O-N 2.75Å; S146-D149 WeakPolarHBondContact O-CB 3.44Å; S146-D149 PolarHBondContact O-N 3.35Å; S146-D149 VanDerWaalsContact OG-CG 3.32Å; S146-D149 PolarHBondContact OG-N 2.94Å; S146-D149 PolarHBondContact OG-OD2 2.73Å; S146-I150 PolarHBondContact O-N 3.21Å
147	R	51.9	Low	56.3	Low	161 Å²	161	89.8 Å²	89.8	61%	0.608	44%	0.441	S	S	*	.	H	α-helix	trans	-47.6	-32.4	173.3	-75.4	168.7	61.7	-171.8	1.6	111.3	R145 V151	R145-R147 PolarHBondContact O-N 3.5Å; R147-V151 PolarHBondContact O-N 3.01Å
148	L	51.8	Low	56.7	Low	113 Å²	113	92.3 Å²	92.3	59%	0.592	45%	0.453	S	S	*	.	H	α-helix	trans	-65.7	-40	176.2	-169.8	65.9	0	0	0	113.3	S146 V151 N152	S146-L148 PolarHBondContact O-N 2.75Å; L148-V151 PolarHBondContact O-N 2.97Å; L148-N152 WeakPolarHBondContact CD1-ND2 3.23Å; L148-N152 VanDerWaalsContact CG-ND2 3.34Å; L148-N152 WeakPolarHBondContact CG-ND2 3.39Å; L148-N152 VanDerWaalsContact O-CB 3.23Å; L148-N152 WeakPolarHBondContact O-CB 3.45Å; L148-N152 PolarHBondContact O-N 3.32Å
149	D	55.9	Low	56.8	Low	60 Å²	60	91.8 Å²	91.8	32%	0.321	45%	0.447	S	S	.	.	H	α-helix	trans	-65.9	-38.6	177.1	-79.9	-63.1	0	0	0	112	S146 V151 R153	S146-D149 WeakPolarHBondContact O-CB 3.44Å; S146-D149 PolarHBondContact O-N 3.35Å; S146-D149 VanDerWaalsContact OG-CG 3.32Å; S146-D149 PolarHBondContact OG-N 2.94Å; S146-D149 PolarHBondContact OG-OD2 2.73Å; D149-V151 VanDerWaalsContact C-N 3.31Å; D149-V151 PolarHBondContact O-N 2.76Å; D149-R153 WeakPolarHBondContact O-CB 3.47Å; D149-R153 VanDerWaalsContact O-CG 3.29Å; D149-R153 WeakPolarHBondContact O-CG 3.27Å; D149-R153 PolarHBondContact O-N 3.45Å; D149-R153 IonicContact OD1-NE 3.39Å; D149-R153 PolarHBondContact OD1-NE 3.44Å
150	I	52.1	Low	56.2	Low	8 Å²	8	89.2 Å²	89.2	4%	0.041	44%	0.44	C	S	.	.	H	α-helix	trans	-59.1	-45.7	178.7	-66.2	167.6	0	0	0	110.6	L140 R145 S146 G154 D155 L156	L140-I150 HydrophobicContact CD1-CG1 4.08Å; L140-I150 HydrophobicContact CD1-CG2 4.15Å; L140-I150 HydrophobicContact CD2-CG2 3.55Å; L140-I150 HydrophobicContact CG-CD1 4.26Å; L140-I150 HydrophobicContact CG-CG1 4.15Å; L140-I150 HydrophobicContact CG-CG2 3.63Å; L140-I150 WeakPolarHBondContact O-CD1 3.47Å; R145-I150 HydrophobicContact CB-CG1 4.39Å; S146-I150 PolarHBondContact O-N 3.21Å; I150-G154 PolarHBondContact O-N 3.27Å; I150-D155 PolarHBondContact O-N 3.49Å; I150-L156 HydrophobicContact CG2-CB 4.46Å
151	V	48.8	Very low	56.2	Low	106 Å²	106	92.4 Å²	92.4	64%	0.642	46%	0.46	S	S	*	.	H	α-helix	trans	-73.7	-50.7	179.7	179.6	0	0	0	0	110.9	R147 L148 D149 G154	R147-V151 PolarHBondContact O-N 3.01Å; L148-V151 PolarHBondContact O-N 2.97Å; D149-V151 VanDerWaalsContact C-N 3.31Å; D149-V151 PolarHBondContact O-N 2.76Å; V151-G154 PolarHBondContact O-N 3.02Å; V151-G154 VanDerWaalsContact O-N 3.09Å
152	N	55.5	Low	56.3	Low	119 Å²	119	94 Å²	94	64%	0.636	46%	0.463	S	S	*	.	H	α-helix	trans	-71	-34	-173.3	-74.9	-16.7	0	0	0	113.5	L148 G154	L148-N152 WeakPolarHBondContact CD1-ND2 3.23Å; L148-N152 VanDerWaalsContact CG-ND2 3.34Å; L148-N152 WeakPolarHBondContact CG-ND2 3.39Å; L148-N152 VanDerWaalsContact O-CB 3.23Å; L148-N152 WeakPolarHBondContact O-CB 3.45Å; L148-N152 PolarHBondContact O-N 3.32Å; N152-G154 PolarHBondContact O-N 3.02Å
153	R	57.7	Low	56.2	Low	176 Å²	176	91.5 Å²	91.5	66%	0.664	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-15.5	173.2	-65.3	177.3	176.2	-113.2	-0.8	112	D149 D155	D149-R153 WeakPolarHBondContact O-CB 3.47Å; D149-R153 VanDerWaalsContact O-CG 3.29Å; D149-R153 WeakPolarHBondContact O-CG 3.27Å; D149-R153 PolarHBondContact O-N 3.45Å; D149-R153 IonicContact OD1-NE 3.39Å; D149-R153 PolarHBondContact OD1-NE 3.44Å; R153-D155 VanDerWaalsContact C-N 3.3Å
154	G	52.9	Low	55.9	Low	12 Å²	12	93.8 Å²	93.8	12%	0.124	45%	0.448	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.8	30.5	-177.9	0	0	0	0	0	112.3	I150 V151 N152 L156 R157 L158	I150-G154 PolarHBondContact O-N 3.27Å; V151-G154 PolarHBondContact O-N 3.02Å; V151-G154 VanDerWaalsContact O-N 3.09Å; N152-G154 PolarHBondContact O-N 3.02Å; G154-L156 VanDerWaalsContact C-N 3.27Å; G154-L156 PolarHBondContact O-N 3.24Å; G154-R157 WeakPolarHBondContact O-CB 3.42Å; G154-R157 PolarHBondContact O-N 3.44Å; G154-R157 VanDerWaalsContact O-N 3.16Å; G154-L158 WeakPolarHBondContact O-CB 3.23Å; G154-L158 PolarHBondContact O-N 3.5Å
155	D	60.8	Low	55.8	Low	36 Å²	36	93.4 Å²	93.4	19%	0.193	44%	0.441	C	S	.	.	H	α-helix	trans	-60.1	-42.7	179.5	-76	-11.5	0	0	0	110.1	L140 R145 I150 R153 L158 M159	L140-D155 HydrophobicContact CD1-CB 3.78Å; L140-D155 HydrophobicContact CD2-CB 4.15Å; R145-D155 IonicContact CZ-OD2 3.95Å; R145-D155 IonicContact NH1-OD2 2.79Å; R145-D155 PolarHBondContact NH1-OD2 2.65Å; I150-D155 PolarHBondContact O-N 3.49Å; R153-D155 VanDerWaalsContact C-N 3.3Å; D155-L158 PolarHBondContact O-N 3.41Å; D155-M159 WeakPolarHBondContact O-CB 3.27Å; D155-M159 PolarHBondContact O-N 3.27Å
156	L	51.9	Low	55.8	Low	61 Å²	61	91.7 Å²	91.7	32%	0.319	44%	0.442	S	S	.	.	H	α-helix	trans	-63.2	-45.8	174.6	-178.3	61.5	0	0	0	111.3	V137 L140 I150 G154 L158 M159 V160	V137-L156 HydrophobicContact CG2-CD1 3.71Å; L140-L156 HydrophobicContact CD2-CB 3.82Å; L140-L156 HydrophobicContact CD2-CD1 4.24Å; I150-L156 HydrophobicContact CG2-CB 4.46Å; G154-L156 VanDerWaalsContact C-N 3.27Å; G154-L156 PolarHBondContact O-N 3.24Å; L156-L158 VanDerWaalsContact C-N 3.3Å; L156-L158 PolarHBondContact O-N 2.91Å; L156-M159 WeakPolarHBondContact O-CB 3.49Å; L156-M159 PolarHBondContact O-N 3.3Å; L156-V160 HydrophobicContact CD1-CG2 4.22Å; L156-V160 HydrophobicContact CG-CG2 4.44Å; L156-V160 WeakPolarHBondContact O-CG2 3.4Å; L156-V160 PolarHBondContact O-N 2.71Å
157	R	63.9	Low	55.4	Low	193 Å²	193	91.9 Å²	91.9	73%	0.728	44%	0.438	S	S	*	.	H	α-helix	trans	-58.6	-44.3	177	-172.7	-178.2	73.5	-172.8	1.5	111	G154 M159 T161	G154-R157 WeakPolarHBondContact O-CB 3.42Å; G154-R157 PolarHBondContact O-N 3.44Å; G154-R157 VanDerWaalsContact O-N 3.16Å; R157-M159 VanDerWaalsContact C-N 3.33Å; R157-T161 WeakPolarHBondContact O-CB 3.42Å; R157-T161 PolarHBondContact O-N 2.79Å; R157-T161 PolarHBondContact O-OG1 2.89Å
158	L	62.7	Low	55.8	Low	93 Å²	93	87.6 Å²	87.6	49%	0.487	43%	0.427	S	S	.	.	H	α-helix	trans	-64.5	-40.4	179.4	-175.2	65.4	0	0	0	111.4	G154 D155 L156 T161 K162	G154-L158 WeakPolarHBondContact O-CB 3.23Å; G154-L158 PolarHBondContact O-N 3.5Å; D155-L158 PolarHBondContact O-N 3.41Å; L156-L158 VanDerWaalsContact C-N 3.3Å; L156-L158 PolarHBondContact O-N 2.91Å; L158-T161 PolarHBondContact O-N 3.22Å; L158-K162 VanDerWaalsContact O-CG 3.31Å; L158-K162 WeakPolarHBondContact O-CG 3.36Å; L158-K162 PolarHBondContact O-N 3.45Å
159	M	57.6	Low	56.2	Low	41 Å²	41	86.2 Å²	86.2	20%	0.202	42%	0.42	C	S	.	.	H	α-helix	trans	-64.3	-51.9	177	-174.9	-178.6	-72.7	0	0	111.8	A136 V137 L140 D155 L156 R157 T161 K162 M163	A136-M159 HydrophobicContact CB-CE 3.65Å; A136-M159 HydrophobicContact CB-CG 4.06Å; A136-M159 HydrophobicContact CB-SD 3.25Å; A136-M159 WeakPolarHBondContact CB-SD 3Å; A136-M159 WeakPolarHBondContact O-CE 3.39Å; V137-M159 HydrophobicContact CG2-SD 4.31Å; L140-M159 HydrophobicContact CB-CE 4.22Å; L140-M159 HydrophobicContact CD2-CE 4.23Å; D155-M159 WeakPolarHBondContact O-CB 3.27Å; D155-M159 PolarHBondContact O-N 3.27Å; L156-M159 WeakPolarHBondContact O-CB 3.49Å; L156-M159 PolarHBondContact O-N 3.3Å; R157-M159 VanDerWaalsContact C-N 3.33Å; M159-T161 VanDerWaalsContact C-N 3.27Å; M159-T161 PolarHBondContact O-N 3.47Å; M159-K162 PolarHBondContact O-N 3.39Å; M159-K162 VanDerWaalsContact O-N 3.17Å; M159-M163 HydrophobicContact CG-CE 3.65Å; M159-M163 HydrophobicContact CG-SD 4.21Å; M159-M163 WeakPolarHBondContact O-CG 3.24Å; M159-M163 PolarHBondContact O-N 2.77Å; M159-M163 HydrophobicContact SD-CE 4.32Å
160	V	50.6	Low	55.7	Low	78 Å²	78	85.7 Å²	85.7	47%	0.473	42%	0.417	S	S	.	.	H	α-helix	trans	-57.3	-41.9	175.2	173.8	0	0	0	0	110.8	L156 K162 M163 Q164	L156-V160 HydrophobicContact CD1-CG2 4.22Å; L156-V160 HydrophobicContact CG-CG2 4.44Å; L156-V160 WeakPolarHBondContact O-CG2 3.4Å; L156-V160 PolarHBondContact O-N 2.71Å; V160-K162 PolarHBondContact O-N 2.81Å; V160-M163 PolarHBondContact O-N 3.4Å; V160-Q164 WeakPolarHBondContact O-CB 3.23Å; V160-Q164 PolarHBondContact O-N 2.98Å
161	T	57.5	Low	55.7	Low	82 Å²	82	90 Å²	90	50%	0.503	44%	0.44	S	S	.	.	H	α-helix	trans	-65.8	-40.7	178.6	-52.1	0	0	0	0	112.3	R157 L158 M159 M163 Q164 R165	R157-T161 WeakPolarHBondContact O-CB 3.42Å; R157-T161 PolarHBondContact O-N 2.79Å; R157-T161 PolarHBondContact O-OG1 2.89Å; L158-T161 PolarHBondContact O-N 3.22Å; M159-T161 VanDerWaalsContact C-N 3.27Å; M159-T161 PolarHBondContact O-N 3.47Å; T161-M163 VanDerWaalsContact C-N 3.29Å; T161-M163 PolarHBondContact O-N 3.35Å; T161-Q164 PolarHBondContact O-N 2.75Å; T161-R165 PolarHBondContact O-N 2.91Å; T161-R165 VanDerWaalsContact O-N 3.16Å
162	K	60.4	Low	56.1	Low	131 Å²	131	89.5 Å²	89.5	57%	0.57	44%	0.437	S	S	*	.	H	α-helix	trans	-62.7	-39	175.2	-77	174.6	179.4	179.2	0	111.2	L158 M159 V160 N166	L158-K162 VanDerWaalsContact O-CG 3.31Å; L158-K162 WeakPolarHBondContact O-CG 3.36Å; L158-K162 PolarHBondContact O-N 3.45Å; M159-K162 PolarHBondContact O-N 3.39Å; M159-K162 VanDerWaalsContact O-N 3.17Å; V160-K162 PolarHBondContact O-N 2.81Å; K162-N166 PolarHBondContact O-N 3.49Å
163	M	56.5	Low	56	Low	39 Å²	39	89.9 Å²	89.9	19%	0.192	44%	0.438	C	S	.	.	H	α-helix	trans	-70.5	-42.7	177	-70.1	167	180	0	0	112.4	C132 G133 A136 M159 V160 T161 R165 N166 I167	C132-M163 WeakPolarHBondContact O-CE 3.44Å; G133-M163 VanDerWaalsContact CA-CE 3.45Å; G133-M163 VanDerWaalsContact CA-SD 3.55Å; A136-M163 HydrophobicContact CB-CE 3.71Å; M159-M163 HydrophobicContact CG-CE 3.65Å; M159-M163 HydrophobicContact CG-SD 4.21Å; M159-M163 WeakPolarHBondContact O-CG 3.24Å; M159-M163 PolarHBondContact O-N 2.77Å; M159-M163 HydrophobicContact SD-CE 4.32Å; V160-M163 PolarHBondContact O-N 3.4Å; T161-M163 VanDerWaalsContact C-N 3.29Å; T161-M163 PolarHBondContact O-N 3.35Å; M163-R165 PolarHBondContact O-N 2.98Å; M163-N166 WeakPolarHBondContact O-CA 3.4Å; M163-N166 WeakPolarHBondContact O-CB 3.46Å; M163-N166 PolarHBondContact O-N 2.96Å; M163-I167 WeakPolarHBondContact O-CG1 3.27Å; M163-I167 PolarHBondContact O-N 3.12Å
164	Q	54.3	Low	55.6	Low	92 Å²	92	82.7 Å²	82.7	43%	0.43	41%	0.412	S	S	.	.	H	α-helix	trans	-54.6	-43.8	175.2	-172.5	61.5	48.7	0	0	110.7	V160 T161 N166 I167 D168	V160-Q164 WeakPolarHBondContact O-CB 3.23Å; V160-Q164 PolarHBondContact O-N 2.98Å; T161-Q164 PolarHBondContact O-N 2.75Å; Q164-N166 VanDerWaalsContact C-N 3.28Å; Q164-N166 PolarHBondContact O-N 3.46Å; Q164-I167 PolarHBondContact O-N 3.2Å; Q164-D168 PolarHBondContact NE2-OD1 3.25Å; Q164-D168 WeakPolarHBondContact O-CB 3.19Å; Q164-D168 PolarHBondContact O-N 2.92Å
165	R	56.6	Low	55.4	Low	174 Å²	174	88.6 Å²	88.6	66%	0.657	44%	0.436	S	S	*	.	H	α-helix	trans	-60.4	-37.3	175.7	-160.6	-176.8	-157.4	96.1	3	112.8	T161 M163 N169	T161-R165 PolarHBondContact O-N 2.91Å; T161-R165 VanDerWaalsContact O-N 3.16Å; M163-R165 PolarHBondContact O-N 2.98Å; R165-N169 VanDerWaalsContact O-CB 3.24Å; R165-N169 WeakPolarHBondContact O-CB 3.42Å; R165-N169 PolarHBondContact O-N 3.47Å; R165-N169 PolarHBondContact O-ND2 2.96Å
166	N	54.8	Low	54.8	Low	95 Å²	95	89.5 Å²	89.5	51%	0.508	45%	0.454	S	S	.	.	H	α-helix	trans	-69.1	-40.8	176.9	-68.7	-15.2	0	0	0	111.4	K162 M163 Q164 N169 L170	K162-N166 PolarHBondContact O-N 3.49Å; M163-N166 WeakPolarHBondContact O-CA 3.4Å; M163-N166 WeakPolarHBondContact O-CB 3.46Å; M163-N166 PolarHBondContact O-N 2.96Å; Q164-N166 VanDerWaalsContact C-N 3.28Å; Q164-N166 PolarHBondContact O-N 3.46Å; N166-N169 PolarHBondContact O-N 3.03Å; N166-L170 VanDerWaalsContact O-CB 3.25Å; N166-L170 WeakPolarHBondContact O-CB 3.34Å; N166-L170 PolarHBondContact O-N 3.39Å
167	I	50	Low	54.4	Low	59 Å²	59	93.4 Å²	93.4	30%	0.303	46%	0.464	S	S	.	.	H	α-helix	trans	-64.1	-47.1	175.1	-63.3	168	0	0	0	110.2	C129 M163 Q164 N169 L170 L171	C129-I167 HydrophobicContact CB-CD1 4.34Å; C129-I167 HydrophobicContact CB-CG1 4.08Å; M163-I167 WeakPolarHBondContact O-CG1 3.27Å; M163-I167 PolarHBondContact O-N 3.12Å; Q164-I167 PolarHBondContact O-N 3.2Å; I167-N169 PolarHBondContact O-N 3.23Å; I167-L170 CarbonylContact O-C 3.58Å; I167-L170 WeakPolarHBondContact O-CB 3.47Å; I167-L170 PolarHBondContact O-N 2.8Å; I167-L171 HydrophobicContact CG2-CD1 4.02Å; I167-L171 HydrophobicContact CG2-CG 4.32Å; I167-L171 WeakPolarHBondContact O-CB 3.49Å; I167-L171 VanDerWaalsContact O-CG 3.31Å; I167-L171 WeakPolarHBondContact O-CG 3.49Å; I167-L171 PolarHBondContact O-N 2.89Å
168	D	58.8	Low	53.3	Low	71 Å²	71	88.3 Å²	88.3	38%	0.38	45%	0.451	S	S	.	.	H	α-helix	trans	-63.3	-42.6	178.8	-64.6	-18.5	0	0	0	111.3	Q164 L170 L171 V172	Q164-D168 PolarHBondContact NE2-OD1 3.25Å; Q164-D168 WeakPolarHBondContact O-CB 3.19Å; Q164-D168 PolarHBondContact O-N 2.92Å; D168-L170 VanDerWaalsContact C-N 3.3Å; D168-L170 PolarHBondContact O-N 3.4Å; D168-L171 PolarHBondContact O-N 3.27Å; D168-V172 WeakPolarHBondContact O-CB 3.26Å; D168-V172 VanDerWaalsContact O-CG2 3.28Å; D168-V172 WeakPolarHBondContact O-CG2 3.4Å; D168-V172 PolarHBondContact O-N 2.93Å
169	N	59.8	Low	52.3	Low	84 Å²	84	87 Å²	87	45%	0.449	45%	0.45	S	S	.	.	H	α-helix	trans	-61	-41.8	174.6	-75.8	-20.4	0	0	0	111.3	R165 N166 I167 V172 L173	R165-N169 VanDerWaalsContact O-CB 3.24Å; R165-N169 WeakPolarHBondContact O-CB 3.42Å; R165-N169 PolarHBondContact O-N 3.47Å; R165-N169 PolarHBondContact O-ND2 2.96Å; N166-N169 PolarHBondContact O-N 3.03Å; I167-N169 PolarHBondContact O-N 3.23Å; N169-V172 PolarHBondContact O-N 3.32Å; N169-L173 VanDerWaalsContact O-CB 3.27Å; N169-L173 WeakPolarHBondContact O-CB 3.46Å; N169-L173 WeakPolarHBondContact O-CD1 3.34Å; N169-L173 WeakPolarHBondContact O-CG 3.39Å; N169-L173 PolarHBondContact O-N 3.02Å
170	L	47.1	Very low	51.8	Low	49 Å²	49	91.6 Å²	91.6	26%	0.257	47%	0.471	S	S	.	.	H	α-helix	trans	-62.9	-46.2	175.8	-171.4	69	0	0	0	110.2	N166 I167 D168 V172 L173 H174	N166-L170 VanDerWaalsContact O-CB 3.25Å; N166-L170 WeakPolarHBondContact O-CB 3.34Å; N166-L170 PolarHBondContact O-N 3.39Å; I167-L170 CarbonylContact O-C 3.58Å; I167-L170 WeakPolarHBondContact O-CB 3.47Å; I167-L170 PolarHBondContact O-N 2.8Å; D168-L170 VanDerWaalsContact C-N 3.3Å; D168-L170 PolarHBondContact O-N 3.4Å; L170-V172 PolarHBondContact O-N 2.94Å; L170-L173 PolarHBondContact O-N 2.95Å; L170-H174 WeakPolarHBondContact CD1-NE2 3.5Å; L170-H174 WeakPolarHBondContact O-CB 3.34Å; L170-H174 PolarHBondContact O-CD2 3.38Å; L170-H174 VanDerWaalsContact O-CG 3.26Å; L170-H174 PolarHBondContact O-N 2.85Å
171	L	50.7	Low	51.3	Low	99 Å²	99	91.3 Å²	91.3	52%	0.518	47%	0.466	S	S	.	.	H	α-helix	trans	-61.3	-40.6	176.3	-72.7	173.7	0	0	0	112.4	I167 D168 H174 Q175	I167-L171 HydrophobicContact CG2-CD1 4.02Å; I167-L171 HydrophobicContact CG2-CG 4.32Å; I167-L171 WeakPolarHBondContact O-CB 3.49Å; I167-L171 VanDerWaalsContact O-CG 3.31Å; I167-L171 WeakPolarHBondContact O-CG 3.49Å; I167-L171 PolarHBondContact O-N 2.89Å; D168-L171 PolarHBondContact O-N 3.27Å; L171-H174 CarbonylContact O-C 3.59Å; L171-H174 PolarHBondContact O-N 3Å; L171-Q175 WeakPolarHBondContact O-CB 3.37Å; L171-Q175 WeakPolarHBondContact O-CG 3.38Å; L171-Q175 PolarHBondContact O-N 3.07Å
172	V	58.5	Low	50.5	Low	95 Å²	95	93.5 Å²	93.5	58%	0.576	47%	0.469	S	S	*	.	H	α-helix	trans	-70.3	-45	177.4	171.9	0	0	0	0	111.2	D168 N169 L170 H174 Q175 G176	D168-V172 WeakPolarHBondContact O-CB 3.26Å; D168-V172 VanDerWaalsContact O-CG2 3.28Å; D168-V172 WeakPolarHBondContact O-CG2 3.4Å; D168-V172 PolarHBondContact O-N 2.93Å; N169-V172 PolarHBondContact O-N 3.32Å; L170-V172 PolarHBondContact O-N 2.94Å; V172-H174 PolarHBondContact O-N 3.12Å; V172-Q175 PolarHBondContact O-N 3.38Å; V172-G176 PolarHBondContact O-N 3.21Å
173	L	53.8	Low	49.5	Very low	128 Å²	128	94.1 Å²	94.1	67%	0.67	47%	0.474	S	S	*	.	H	α-helix	trans	-54.7	-36	172.1	-90.4	157.8	0	0	0	111.2	N169 L170	N169-L173 VanDerWaalsContact O-CB 3.27Å; N169-L173 WeakPolarHBondContact O-CB 3.46Å; N169-L173 WeakPolarHBondContact O-CD1 3.34Å; N169-L173 WeakPolarHBondContact O-CG 3.39Å; N169-L173 PolarHBondContact O-N 3.02Å; L170-L173 PolarHBondContact O-N 2.95Å
174	H	48	Very low	48.9	Very low	25 Å²	25	97.5 Å²	97.5	12%	0.116	49%	0.493	C	S	.	.	H	α-helix	trans	-85.2	-33.1	177	-66.6	-51.1	0	0	0	113.9	L170 L171 V172 G176 R177 L178	L170-H174 WeakPolarHBondContact CD1-NE2 3.5Å; L170-H174 WeakPolarHBondContact O-CB 3.34Å; L170-H174 PolarHBondContact O-CD2 3.38Å; L170-H174 VanDerWaalsContact O-CG 3.26Å; L170-H174 PolarHBondContact O-N 2.85Å; L171-H174 CarbonylContact O-C 3.59Å; L171-H174 PolarHBondContact O-N 3Å; V172-H174 PolarHBondContact O-N 3.12Å; H174-G176 VanDerWaalsContact C-N 3.27Å; H174-G176 PolarHBondContact O-N 2.77Å; H174-R177 CarbonylContact O-C 3.47Å; H174-R177 PolarHBondContact O-N 3.48Å; H174-L178 HydrophobicContact CB-CD1 4Å; H174-L178 HydrophobicContact CB-CG 4.21Å; H174-L178 VanDerWaalsContact O-CB 3.24Å; H174-L178 WeakPolarHBondContact O-CB 3.28Å; H174-L178 VanDerWaalsContact O-CG 3.27Å; H174-L178 WeakPolarHBondContact O-CG 3.3Å; H174-L178 PolarHBondContact O-N 3.1Å
175	Q	50	Low	48.1	Very low	136 Å²	136	96.7 Å²	96.7	64%	0.636	49%	0.491	S	S	*	.	H	α-helix	trans	-57.2	-43.5	177.8	-90.8	-179.7	-6.5	0	0	111.1	L171 V172 R177 S179	L171-Q175 WeakPolarHBondContact O-CB 3.37Å; L171-Q175 WeakPolarHBondContact O-CG 3.38Å; L171-Q175 PolarHBondContact O-N 3.07Å; V172-Q175 PolarHBondContact O-N 3.38Å; Q175-R177 PolarHBondContact O-N 3.47Å; Q175-S179 PolarHBondContact O-N 3.1Å; Q175-S179 PolarHBondContact O-OG 3.32Å
176	G	47.4	Very low	47.2	Very low	54 Å²	54	92.6 Å²	92.6	56%	0.557	48%	0.481	S	S	*	.	H	α-helix	trans	-66.1	-18.6	175.9	0	0	0	0	0	114.4	V172 H174	V172-G176 PolarHBondContact O-N 3.21Å; H174-G176 VanDerWaalsContact C-N 3.27Å; H174-G176 PolarHBondContact O-N 2.77Å
177	R	44.2	Very low	46.4	Very low	144 Å²	144	91.3 Å²	91.3	54%	0.543	48%	0.476	S	S	.	.	H	α-helix	trans	-112.3	-21.1	-174.8	-148.2	173.8	-178.6	173.9	2.8	113.6	H174 Q175 N181	H174-R177 CarbonylContact O-C 3.47Å; H174-R177 PolarHBondContact O-N 3.48Å; Q175-R177 PolarHBondContact O-N 3.47Å; R177-N181 PolarHBondContact O-ND2 2.88Å
178	L	40.6	Very low	45.6	Very low	85 Å²	85	94 Å²	94	45%	0.445	48%	0.483	S	S	.	.	H	α-helix	trans	-76.4	-38.6	171.8	-74	173.3	0	0	0	109.2	H174 E180 N181 F182	H174-L178 HydrophobicContact CB-CD1 4Å; H174-L178 HydrophobicContact CB-CG 4.21Å; H174-L178 VanDerWaalsContact O-CB 3.24Å; H174-L178 WeakPolarHBondContact O-CB 3.28Å; H174-L178 VanDerWaalsContact O-CG 3.27Å; H174-L178 WeakPolarHBondContact O-CG 3.3Å; H174-L178 PolarHBondContact O-N 3.1Å; L178-E180 PolarHBondContact O-N 2.95Å; L178-N181 CarbonylContact O-C 3.5Å; L178-N181 PolarHBondContact O-N 3.5Å; L178-F182 VanDerWaalsContact O-CB 3.23Å; L178-F182 WeakPolarHBondContact O-CB 3.39Å; L178-F182 PolarHBondContact O-N 2.98Å
179	S	41.9	Very low	44.4	Very low	67 Å²	67	98.4 Å²	98.4	47%	0.469	50%	0.495	S	S	.	.	H	α-helix	trans	-59.5	-49.9	179.3	64.9	0	0	0	0	112.4	Q175 N181 F182 E183	Q175-S179 PolarHBondContact O-N 3.1Å; Q175-S179 PolarHBondContact O-OG 3.32Å; S179-N181 PolarHBondContact O-N 2.82Å; S179-F182 PolarHBondContact O-N 3.37Å; S179-E183 PolarHBondContact O-N 2.87Å
180	E	45.3	Very low	43.1	Very low	137 Å²	137	99 Å²	99	64%	0.64	50%	0.497	S	S	*	.	H	α-helix	trans	-60	-34.1	177.7	-115.5	-178.6	178	0	0	112.5	L178 N184	L178-E180 PolarHBondContact O-N 2.95Å; E180-N184 PolarHBondContact O-ND2 3.48Å
181	N	41.5	Very low	42.6	Very low	71 Å²	71	105.6 Å²	105.6	38%	0.38	52%	0.519	S	S	.	.	H	α-helix	trans	-85.2	-30.1	179.4	-74.2	-51.8	0	0	0	113.1	R177 L178 S179 L185	R177-N181 PolarHBondContact O-ND2 2.88Å; L178-N181 CarbonylContact O-C 3.5Å; L178-N181 PolarHBondContact O-N 3.5Å; S179-N181 PolarHBondContact O-N 2.82Å; N181-L185 WeakPolarHBondContact O-CB 3.39Å; N181-L185 PolarHBondContact O-N 3.44Å
182	F	39.4	Very low	42.3	Very low	128 Å²	128	106.7 Å²	106.7	56%	0.561	52%	0.521	S	S	*	.	H	α-helix	trans	-72.1	-38.9	178.1	-147.5	-85.7	0	0	0	110.7	L178 S179 N184 L185 M186	L178-F182 VanDerWaalsContact O-CB 3.23Å; L178-F182 WeakPolarHBondContact O-CB 3.39Å; L178-F182 PolarHBondContact O-N 2.98Å; S179-F182 PolarHBondContact O-N 3.37Å; F182-N184 VanDerWaalsContact C-N 3.34Å; F182-N184 PolarHBondContact O-N 2.87Å; F182-L185 CarbonylContact O-C 3.59Å; F182-L185 PolarHBondContact O-N 3.23Å; F182-M186 HydrophobicContact CD1-CG 3.71Å; F182-M186 HydrophobicContact CE1-CG 3.81Å; F182-M186 HydrophobicContact CE1-SD 4.09Å; F182-M186 WeakPolarHBondContact O-CB 3.36Å; F182-M186 WeakPolarHBondContact O-CG 3.36Å; F182-M186 PolarHBondContact O-N 3.36Å
183	E	41	Very low	41.2	Very low	145 Å²	145	106.9 Å²	106.9	68%	0.678	52%	0.522	S	S	*	.	H	α-helix	trans	-61.6	-43.5	173.5	-71.6	-136.5	164.7	0	0	111.8	S179 L185 M186 T187	S179-E183 PolarHBondContact O-N 2.87Å; E183-L185 VanDerWaalsContact C-N 3.34Å; E183-L185 PolarHBondContact O-N 3.34Å; E183-M186 PolarHBondContact O-N 3.14Å; E183-T187 WeakPolarHBondContact O-CB 3.45Å; E183-T187 PolarHBondContact O-N 2.69Å; E183-T187 PolarHBondContact O-OG1 2.9Å
184	N	42.4	Very low	39.9	Very low	109 Å²	109	106.2 Å²	106.2	58%	0.583	52%	0.519	S	S	*	.	H	α-helix	trans	-63.7	-39.5	174.4	-78.7	-49.6	0	0	0	111.8	E180 F182 T187 Y188	E180-N184 PolarHBondContact O-ND2 3.48Å; F182-N184 VanDerWaalsContact C-N 3.34Å; F182-N184 PolarHBondContact O-N 2.87Å; N184-T187 PolarHBondContact O-N 2.93Å; N184-Y188 WeakPolarHBondContact O-CB 3.33Å; N184-Y188 PolarHBondContact O-N 2.97Å
185	L	38.3	Very low	39.3	Very low	75 Å²	75	110.3 Å²	110.3	39%	0.393	55%	0.548	S	S	.	.	H	α-helix	trans	-67.7	-40.9	176.6	-174.8	67	0	0	0	112.4	N181 F182 E183 Y188 R189	N181-L185 WeakPolarHBondContact O-CB 3.39Å; N181-L185 PolarHBondContact O-N 3.44Å; F182-L185 CarbonylContact O-C 3.59Å; F182-L185 PolarHBondContact O-N 3.23Å; E183-L185 VanDerWaalsContact C-N 3.34Å; E183-L185 PolarHBondContact O-N 3.34Å; L185-Y188 PolarHBondContact O-N 3.47Å; L185-R189 WeakPolarHBondContact O-CB 3.26Å; L185-R189 PolarHBondContact O-N 2.88Å
186	M	36.8	Very low	38.8	Very low	89 Å²	89	108.1 Å²	108.1	44%	0.438	55%	0.548	S	S	.	.	H	α-helix	trans	-66.5	-41.5	175.9	-77	-62.3	-66.3	0	0	110.8	F182 E183 Y188 R189 L190	F182-M186 HydrophobicContact CD1-CG 3.71Å; F182-M186 HydrophobicContact CE1-CG 3.81Å; F182-M186 HydrophobicContact CE1-SD 4.09Å; F182-M186 WeakPolarHBondContact O-CB 3.36Å; F182-M186 WeakPolarHBondContact O-CG 3.36Å; F182-M186 PolarHBondContact O-N 3.36Å; E183-M186 PolarHBondContact O-N 3.14Å; M186-Y188 VanDerWaalsContact C-N 3.34Å; M186-Y188 PolarHBondContact O-N 3.49Å; M186-R189 PolarHBondContact O-N 3.35Å; M186-L190 VanDerWaalsContact O-CB 3.26Å; M186-L190 WeakPolarHBondContact O-CB 3.3Å; M186-L190 VanDerWaalsContact O-CG 3.27Å; M186-L190 WeakPolarHBondContact O-CG 3.48Å; M186-L190 PolarHBondContact O-N 3.39Å
187	T	38.4	Very low	38.1	Very low	67 Å²	67	111.2 Å²	111.2	41%	0.411	56%	0.56	S	S	.	*	H	α-helix	trans	-63.6	-41.3	175.4	-52.3	0	0	0	0	111.3	E183 N184 R191	E183-T187 WeakPolarHBondContact O-CB 3.45Å; E183-T187 PolarHBondContact O-N 2.69Å; E183-T187 PolarHBondContact O-OG1 2.9Å; N184-T187 PolarHBondContact O-N 2.93Å; T187-R191 WeakPolarHBondContact O-CB 3.24Å; T187-R191 PolarHBondContact O-N 3.43Å; T187-R191 VanDerWaalsContact O-N 3.1Å
188	Y	34.5	Very low	37.9	Very low	116 Å²	116	112.1 Å²	112.1	46%	0.455	57%	0.571	S	S	.	*	H	α-helix	trans	-70.4	-41.1	177.9	-152.3	-93.8	0	0	0	112.3	K112 N184 L185 M186 R191 H192	K112-Y188 WeakPolarHBondContact CE-OH 3.27Å; K112-Y188 PolarHBondContact NZ-OH 3.37Å; N184-Y188 WeakPolarHBondContact O-CB 3.33Å; N184-Y188 PolarHBondContact O-N 2.97Å; L185-Y188 PolarHBondContact O-N 3.47Å; M186-Y188 VanDerWaalsContact C-N 3.34Å; M186-Y188 PolarHBondContact O-N 3.49Å; Y188-R191 PolarHBondContact O-N 3.43Å; Y188-H192 AromaticContact CD1-CD2 3.79Å; Y188-H192 AromaticContact CE1-CD2 3.56Å; Y188-H192 AromaticContact CE2-CD2 3.98Å; Y188-H192 AromaticContact CE2-NE2 3.93Å; Y188-H192 AromaticContact CZ-CD2 3.65Å; Y188-H192 AromaticContact CZ-NE2 3.7Å; Y188-H192 WeakPolarHBondContact O-CB 3.42Å; Y188-H192 PolarHBondContact O-CD2 2.89Å; Y188-H192 PolarHBondContact O-N 2.88Å; Y188-H192 VanDerWaalsContact O-N 3.07Å
189	R	32.5	Very low	37.6	Very low	163 Å²	163	113.7 Å²	113.7	62%	0.615	59%	0.586	S	S	*	*	H	α-helix	trans	-66.5	-43.1	174.6	-88.5	-164.4	167.3	-170.7	-1.5	111.9	L185 M186 R191 H192 V193	L185-R189 WeakPolarHBondContact O-CB 3.26Å; L185-R189 PolarHBondContact O-N 2.88Å; M186-R189 PolarHBondContact O-N 3.35Å; R189-R191 VanDerWaalsContact C-N 3.28Å; R189-R191 PolarHBondContact O-N 3.01Å; R189-H192 PolarHBondContact O-N 3.01Å; R189-V193 HydrophobicContact CB-CG2 4.34Å; R189-V193 HydrophobicContact CG-CG2 4.15Å; R189-V193 WeakPolarHBondContact O-CA 3.47Å; R189-V193 WeakPolarHBondContact O-CB 3.4Å; R189-V193 PolarHBondContact O-N 2.71Å
190	L	32.3	Very low	37.2	Very low	97 Å²	97	115.7 Å²	115.7	51%	0.508	61%	0.607	S	S	.	*	H	α-helix	trans	-63	-36.5	177.6	-76.9	168.3	0	0	0	111.7	M186 L194	M186-L190 VanDerWaalsContact O-CB 3.26Å; M186-L190 WeakPolarHBondContact O-CB 3.3Å; M186-L190 VanDerWaalsContact O-CG 3.27Å; M186-L190 WeakPolarHBondContact O-CG 3.48Å; M186-L190 PolarHBondContact O-N 3.39Å; L190-L194 HydrophobicContact CD2-CD1 3.65Å
191	R	37.6	Very low	36.6	Very low	188 Å²	188	112 Å²	112	71%	0.709	61%	0.606	S	S	*	*	H	α-helix	trans	-78	-28	179.8	-164.9	173	-63.1	163.9	3.5	114.4	T187 Y188 R189	T187-R191 WeakPolarHBondContact O-CB 3.24Å; T187-R191 PolarHBondContact O-N 3.43Å; T187-R191 VanDerWaalsContact O-N 3.1Å; Y188-R191 PolarHBondContact O-N 3.43Å; R189-R191 VanDerWaalsContact C-N 3.28Å; R189-R191 PolarHBondContact O-N 3.01Å
192	H	43.9	Very low	36.3	Very low	121 Å²	121	114.6 Å²	114.6	56%	0.56	63%	0.626	S	S	*	*	H	α-helix	trans	-113.6	-16.2	-174.2	-72	-71.6	0	0	0	115.3	Y188 R189	Y188-H192 AromaticContact CD1-CD2 3.79Å; Y188-H192 AromaticContact CE1-CD2 3.56Å; Y188-H192 AromaticContact CE2-CD2 3.98Å; Y188-H192 AromaticContact CE2-NE2 3.93Å; Y188-H192 AromaticContact CZ-CD2 3.65Å; Y188-H192 AromaticContact CZ-NE2 3.7Å; Y188-H192 WeakPolarHBondContact O-CB 3.42Å; Y188-H192 PolarHBondContact O-CD2 2.89Å; Y188-H192 PolarHBondContact O-N 2.88Å; Y188-H192 VanDerWaalsContact O-N 3.07Å; R189-H192 PolarHBondContact O-N 3.01Å
193	V	34.6	Very low	36.5	Very low	99 Å²	99	118.2 Å²	118.2	60%	0.6	64%	0.642	S	S	*	*	H	α-helix	trans	-106.7	-22	-177.9	-174.1	0	0	0	0	112.6	R189 P195	R189-V193 HydrophobicContact CB-CG2 4.34Å; R189-V193 HydrophobicContact CG-CG2 4.15Å; R189-V193 WeakPolarHBondContact O-CA 3.47Å; R189-V193 WeakPolarHBondContact O-CB 3.4Å; R189-V193 PolarHBondContact O-N 2.71Å; V193-P195 VanDerWaalsContact O-CD 3.23Å; V193-P195 WeakPolarHBondContact O-CD 3.3Å
194	L	27	Very low	36.3	Very low	114 Å²	114	119.9 Å²	119.9	60%	0.597	65%	0.654	S	S	*	*	S	Bend	trans	-83.5	108.7	164	-72.5	171.5	0	0	0	107.9	L190 S196	L190-L194 HydrophobicContact CD2-CD1 3.65Å; L194-S196 PolarHBondContact O-N 2.91Å; L194-S196 VanDerWaalsContact O-N 3.12Å
195	P	36.8	Very low	36.1	Very low	111 Å²	111	119 Å²	119	72%	0.721	66%	0.656	S	S	*	*			trans	-58.9	124.2	172.2	-10.3	26.4	0	0	0	105.5	V193 S197	V193-P195 VanDerWaalsContact O-CD 3.23Å; V193-P195 WeakPolarHBondContact O-CD 3.3Å; P195-S197 PolarHBondContact O-N 2.72Å
196	S	38.8	Very low	36.2	Very low	91 Å²	91	122.2 Å²	122.2	64%	0.636	67%	0.674	S	S	*	*			trans	-45.7	113	171.7	56.1	0	0	0	0	107.3	L194 Q198	L194-S196 PolarHBondContact O-N 2.91Å; L194-S196 VanDerWaalsContact O-N 3.12Å; S196-Q198 PolarHBondContact O-N 3.35Å
197	S	32.1	Very low	36.3	Very low	118 Å²	118	128 Å²	128	83%	0.825	70%	0.7	S	S	*	*			trans	-66.1	72.9	168	52.5	0	0	0	0	106.5	P195 P199	P195-S197 PolarHBondContact O-N 2.72Å; S197-P199 VanDerWaalsContact O-CD 3.24Å; S197-P199 WeakPolarHBondContact O-CD 3.47Å
198	Q	39.5	Very low	36	Very low	163 Å²	163	130.8 Å²	130.8	76%	0.762	71%	0.713	S	S	*	*			trans	-69.4	114.5	168	-78.5	-168.4	-69.2	0	0	105.1	S196 A200	S196-Q198 PolarHBondContact O-N 3.35Å; Q198-A200 PolarHBondContact O-N 2.75Å
199	P	34.2	Very low	36.2	Very low	119 Å²	119	136.3 Å²	136.3	77%	0.773	73%	0.733	S	S	*	*			trans	-58.5	135.9	176.3	24.2	-31.4	0	0	0	107.9	S197 G201	S197-P199 VanDerWaalsContact O-CD 3.24Å; S197-P199 WeakPolarHBondContact O-CD 3.47Å; P199-G201 PolarHBondContact O-N 3.07Å
200	A	34.8	Very low	36.2	Very low	109 Å²	109	130.8 Å²	130.8	90%	0.901	73%	0.727	S	S	*	*			trans	-59.1	86.4	178.8	0	0	0	0	0	110.3	Q198	Q198-A200 PolarHBondContact O-N 2.75Å
201	G	32.7	Very low	36.6	Very low	60 Å²	60	134.5 Å²	134.5	62%	0.619	74%	0.741	S	S	*	*			trans	-75.1	146.6	170.8	0	0	0	0	0	110.2	P199	P199-G201 PolarHBondContact O-N 3.07Å
202	P	35.6	Very low	36.7	Very low	124 Å²	124	136.3 Å²	136.3	81%	0.805	75%	0.75	S	S	*	*			trans	-69.8	141.3	-155.6	-15.3	29.5	0	0	0	112.8	L204	P202-L204 PolarHBondContact O-N 3.08Å
203	K	43.1	Very low	36.5	Very low	205 Å²	205	145.2 Å²	145.2	89%	0.891	78%	0.778	S	S	*	*			trans	-51.3	107.8	172.2	-66.1	176.4	178.8	174.6	0	109.8	S205	K203-S205 VanDerWaalsContact C-N 3.28Å; K203-S205 PolarHBondContact O-N 2.94Å
204	L	35.7	Very low	36.6	Very low	179 Å²	179	147.5 Å²	147.5	94%	0.937	79%	0.787	S	S	*	*			trans	-70.4	87.4	168.3	-82.4	154.5	0	0	0	108.3	P202	P202-L204 PolarHBondContact O-N 3.08Å
205	S	39.1	Very low	37.2	Very low	90 Å²	90	149.3 Å²	149.3	63%	0.629	80%	0.797	S	S	*	*			trans	-69.3	147.2	158.7	55.7	0	0	0	0	109.6	K203	K203-S205 VanDerWaalsContact C-N 3.28Å; K203-S205 PolarHBondContact O-N 2.94Å
206	D	40.2	Very low	37.2	Very low	144 Å²	144	151.4 Å²	151.4	77%	0.77	80%	0.802	S	S	*	*			trans	80	75.4	165.1	-53	-26.5	0	0	0	117	N208	D206-N208 VanDerWaalsContact C-N 3.32Å; D206-N208 PolarHBondContact O-N 3.03Å
207	Q	38.1	Very low	37.1	Very low	209 Å²	209	154.9 Å²	154.9	98%	0.977	81%	0.811	S	S	*	*			trans	-58.9	93.2	145.6	-66	173.8	13.2	0	0	109.4
208	N	33.8	Very low	37.4	Very low	126 Å²	126	157.3 Å²	157.3	67%	0.674	81%	0.81	S	S	*	*			trans	-152.4	86.8	159.1	-168.1	14.1	0	0	0	111	D206	D206-N208 VanDerWaalsContact C-N 3.32Å; D206-N208 PolarHBondContact O-N 3.03Å
209	W	37.2	Very low	37.2	Very low	232 Å²	232	156.9 Å²	156.9	88%	0.879	81%	0.814	S	S	*	*			trans	-129.2	61.3	159.5	-71.4	101	0	0	0	109
210	G	34	Very low	37.5	Very low	48 Å²	48	159.6 Å²	159.6	50%	0.495	82%	0.817	S	S	.	*			trans	-64.6	145.7	149.5	0	0	0	0	0	109.5
211	H	39.1	Very low	37.7	Very low	175 Å²	175	163.5 Å²	163.5	81%	0.81	81%	0.81	S	S	*	*			trans	83.5	84.4	179.2	-63.2	-69.3	0	0	0	117.1
212	Y	41.5	Very low	38.1	Very low	225 Å²	225	172.1 Å²	172.1	88%	0.882	83%	0.826	S	S	*	*				-103.6	117.2	129.3	-83.9	-86.5	0	0	0	108.3
213	R	39.9	Very low	38.3	Very low	308 Å²	308	176.5 Å²	176.5	100%	1.162	83%	0.828	S	S	*	*			trans	-71.2	0	179	-173.3	-167.4	-79.5	-173.1	-5.9	110.5

Retrieved 213 of 213 residues in 244.8 ms (Link to these results)

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