A0A067ZVG2_HUMAN Loading...

Nuclear pore complex-interacting protein

AlphaFold DB , UniProt , Accession A0A067ZVG2, Species HUMAN (Homo sapiens, Human), Gene NPIP, Length 231 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	F	42.3	Very low	37.8	Very low	242 Å²	242	146.4 Å²	146.4	100%	1.061	80%	0.803	S	S	*	*				0	-27.9	0	-105.9	-87.4	0	0	0	114.4
2	C	34.3	Very low	37.8	Very low	131 Å²	131	139.4 Å²	139.4	89%	0.885	79%	0.79	S	S	*	*			trans	-84.8	-5.5	-179.3	-70.1	0	0	0	0	116.7
3	C	33.3	Very low	37.5	Very low	116 Å²	116	138 Å²	138	78%	0.784	79%	0.792	S	S	*	*	S	Bend	trans	-107.7	-6.6	178.8	-59.1	0	0	0	0	114.4
4	L	39.6	Very low	38.3	Very low	132 Å²	132	142.9 Å²	142.9	69%	0.691	80%	0.799	S	S	*	*	S	Bend	trans	-97	-8.9	-178.4	-74.6	166.2	0	0	0	113.8
5	G	34.6	Very low	38.6	Very low	54 Å²	54	139.6 Å²	139.6	56%	0.557	79%	0.785	S	S	*	*	S	Bend	trans	-88.3	-12.1	-178.1	0	0	0	0	0	114.8
6	Y	33.3	Very low	38.8	Very low	204 Å²	204	146.1 Å²	146.1	80%	0.8	79%	0.793	S	S	*	*	S	Bend	trans	-91.6	-19.9	-172.4	-135.8	-91.5	0	0	0	113.6
7	E	35	Very low	39	Very low	154 Å²	154	146.2 Å²	146.2	72%	0.72	79%	0.787	S	S	*	*	G	3₁₀ helix	trans	-83.6	-16.9	178.4	-74.5	-175.4	154.8	0	0	113.7	L9	E7-L9 VanDerWaalsContact C-N 3.28Å; E7-L9 PolarHBondContact O-N 3.39Å
8	W	42.4	Very low	39.3	Very low	227 Å²	227	141.8 Å²	141.8	86%	0.86	77%	0.769	S	S	*	*	G	3₁₀ helix	trans	-74.3	-15.7	179.5	-87.7	79.8	0	0	0	114.2
9	L	39.9	Very low	39.5	Very low	165 Å²	165	137.3 Å²	137.3	86%	0.864	75%	0.753	S	S	*	*	G	3₁₀ helix	trans	-101.8	-7.9	-178.3	-86.5	161.6	0	0	0	114.1	E7	E7-L9 VanDerWaalsContact C-N 3.28Å; E7-L9 PolarHBondContact O-N 3.39Å
10	S	38.2	Very low	39.4	Very low	90 Å²	90	139.5 Å²	139.5	63%	0.629	75%	0.749	S	S	*	*	S	Bend	trans	-111	97.3	176.2	-160.8	0	0	0	0	108	G12	S10-G12 PolarHBondContact O-N 3.35Å
11	G	43.1	Very low	39.9	Very low	95 Å²	95	137 Å²	137	98%	0.979	74%	0.739	S	S	*	*			trans	-61.8	78	-177.7	0	0	0	0	0	113.2
12	G	37.2	Very low	40.1	Very low	63 Å²	63	130.6 Å²	130.6	65%	0.649	72%	0.715	S	S	*	*			trans	-138.8	112.6	-174.9	0	0	0	0	0	112.4	S10	S10-G12 PolarHBondContact O-N 3.35Å
13	C	34.7	Very low	40.4	Very low	121 Å²	121	130 Å²	130	82%	0.818	70%	0.703	S	S	*	*			trans	72.9	111.9	160.6	-120.5	0	0	0	0	119.9	T15	C13-T15 PolarHBondContact O-N 3.02Å
14	K	48.8	Very low	40.9	Very low	206 Å²	206	127.6 Å²	127.6	90%	0.896	69%	0.685	S	S	*	*			trans	-60.9	107.3	161.4	-69.8	165.9	175.6	166.1	0	109.7
15	T	42.9	Very low	41	Very low	94 Å²	94	127.3 Å²	127.3	58%	0.577	68%	0.683	S	S	*	*			trans	-120.9	129.7	163.5	50.4	0	0	0	0	109.8	C13 H17 S18	C13-T15 PolarHBondContact O-N 3.02Å; T15-H17 PolarHBondContact O-N 3.31Å; T15-S18 PolarHBondContact O-N 3.46Å; T15-S18 PolarHBondContact O-OG 3.17Å; T15-S18 VanDerWaalsContact O-OG 3.05Å
16	W	41.7	Very low	41.3	Very low	244 Å²	244	127 Å²	127	92%	0.924	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-44.4	-16.9	-173.2	-79.2	69.3	0	0	0	117
17	H	41.2	Very low	41.6	Very low	148 Å²	148	123.6 Å²	123.6	69%	0.685	67%	0.671	S	S	*	*	H	α-helix	trans	-67.7	-30.2	174.6	-110.1	-79.1	0	0	0	114.6	T15 W20 V21	T15-H17 PolarHBondContact O-N 3.31Å; H17-W20 PolarHBondContact O-N 3.12Å; H17-V21 PolarHBondContact O-N 3.45Å
18	S	44.6	Very low	42	Very low	66 Å²	66	124 Å²	124	46%	0.462	67%	0.673	S	S	.	*	H	α-helix	trans	-73.5	-28.9	179.8	53.4	0	0	0	0	112.6	T15 I22	T15-S18 PolarHBondContact O-N 3.46Å; T15-S18 PolarHBondContact O-OG 3.17Å; T15-S18 VanDerWaalsContact O-OG 3.05Å; S18-I22 WeakPolarHBondContact O-CB 3.48Å; S18-I22 WeakPolarHBondContact O-CD1 3.17Å; S18-I22 WeakPolarHBondContact O-CG1 3.33Å; S18-I22 PolarHBondContact O-N 2.8Å; S18-I22 VanDerWaalsContact O-N 3.1Å
19	A	43.6	Very low	42	Very low	56 Å²	56	123.5 Å²	123.5	46%	0.463	67%	0.671	S	S	.	*	H	α-helix	trans	-67.7	-35.9	174.3	0	0	0	0	0	112	I22 N23	A19-I22 PolarHBondContact O-N 2.93Å; A19-N23 WeakPolarHBondContact O-CB 3.25Å; A19-N23 PolarHBondContact O-N 3.03Å
20	W	38.3	Very low	41.9	Very low	181 Å²	181	123.9 Å²	123.9	69%	0.686	67%	0.668	S	S	*	*	H	α-helix	trans	-67.4	-46.1	177.1	-163.9	68.7	0	0	0	111.3	H17 I22 N23 T24	H17-W20 PolarHBondContact O-N 3.12Å; W20-I22 VanDerWaalsContact C-N 3.3Å; W20-I22 PolarHBondContact O-N 3.07Å; W20-N23 PolarHBondContact O-N 2.78Å; W20-T24 PolarHBondContact O-N 3.05Å; W20-T24 PolarHBondContact O-OG1 3.35Å
21	V	48.5	Very low	41.9	Very low	89 Å²	89	130.5 Å²	130.5	54%	0.539	68%	0.679	S	S	.	*	H	α-helix	trans	-63.5	-35.8	177.7	177.7	0	0	0	0	112.1	H17 L25	H17-V21 PolarHBondContact O-N 3.45Å; V21-L25 WeakPolarHBondContact O-CB 3.44Å; V21-L25 PolarHBondContact O-N 3.49Å
22	I	47.2	Very low	41.9	Very low	107 Å²	107	129.8 Å²	129.8	55%	0.549	67%	0.672	S	S	.	*	H	α-helix	trans	-71	-40.6	176.8	-66.2	165.7	0	0	0	111.1	S18 A19 W20 L25 A26	S18-I22 WeakPolarHBondContact O-CB 3.48Å; S18-I22 WeakPolarHBondContact O-CD1 3.17Å; S18-I22 WeakPolarHBondContact O-CG1 3.33Å; S18-I22 PolarHBondContact O-N 2.8Å; S18-I22 VanDerWaalsContact O-N 3.1Å; A19-I22 PolarHBondContact O-N 2.93Å; W20-I22 VanDerWaalsContact C-N 3.3Å; W20-I22 PolarHBondContact O-N 3.07Å; I22-L25 PolarHBondContact O-N 2.97Å; I22-A26 WeakPolarHBondContact O-CB 3.49Å; I22-A26 PolarHBondContact O-N 3.35Å
23	N	40.6	Very low	41.9	Very low	117 Å²	117	132.5 Å²	132.5	63%	0.626	68%	0.676	S	S	*	*	H	α-helix	trans	-69.7	-38.8	177.3	-98.8	-6.4	0	0	0	112.7	A19 W20 L25 A26 D27	A19-N23 WeakPolarHBondContact O-CB 3.25Å; A19-N23 PolarHBondContact O-N 3.03Å; W20-N23 PolarHBondContact O-N 2.78Å; N23-L25 PolarHBondContact O-N 2.91Å; N23-A26 PolarHBondContact O-N 3.24Å; N23-A26 VanDerWaalsContact O-N 3.16Å; N23-D27 WeakPolarHBondContact O-CB 3.48Å; N23-D27 PolarHBondContact O-N 3.43Å
24	T	44.5	Very low	42.3	Very low	66 Å²	66	134.6 Å²	134.6	41%	0.405	68%	0.679	S	S	.	*	H	α-helix	trans	-66.1	-29	175.4	-39.3	0	0	0	0	111.7	W20	W20-T24 PolarHBondContact O-N 3.05Å; W20-T24 PolarHBondContact O-OG1 3.35Å
25	L	41.4	Very low	41.7	Very low	127 Å²	127	132.9 Å²	132.9	67%	0.665	67%	0.672	S	S	*	*	H	α-helix	trans	-76.9	-30.3	174	-146.7	88.2	0	0	0	112.8	V21 I22 N23	V21-L25 WeakPolarHBondContact O-CB 3.44Å; V21-L25 PolarHBondContact O-N 3.49Å; I22-L25 PolarHBondContact O-N 2.97Å; N23-L25 PolarHBondContact O-N 2.91Å
26	A	40.9	Very low	41.7	Very low	48 Å²	48	132.6 Å²	132.6	40%	0.397	69%	0.687	S	S	.	*	H	α-helix	trans	-74.7	-36	175.7	0	0	0	0	0	111.9	I22 N23 H28 R29	I22-A26 WeakPolarHBondContact O-CB 3.49Å; I22-A26 PolarHBondContact O-N 3.35Å; N23-A26 PolarHBondContact O-N 3.24Å; N23-A26 VanDerWaalsContact O-N 3.16Å; A26-H28 VanDerWaalsContact C-N 3.28Å; A26-H28 PolarHBondContact O-N 3.32Å; A26-R29 WeakPolarHBondContact O-CB 3.38Å; A26-R29 PolarHBondContact O-N 3.16Å
27	D	38.3	Very low	42.1	Very low	131 Å²	131	123.6 Å²	123.6	70%	0.701	67%	0.67	S	S	*	*	H	α-helix	trans	-70.1	-25.1	-178.1	-153.9	50.7	0	0	0	112.8	N23 R29	N23-D27 WeakPolarHBondContact O-CB 3.48Å; N23-D27 PolarHBondContact O-N 3.43Å; D27-R29 PolarHBondContact O-N 2.93Å
28	H	44.1	Very low	42.7	Very low	164 Å²	164	118.8 Å²	118.8	76%	0.759	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	-2.7	170.1	-85.3	-21.6	0	0	0	115	A26	A26-H28 VanDerWaalsContact C-N 3.28Å; A26-H28 PolarHBondContact O-N 3.32Å
29	R	42.8	Very low	43.1	Very low	216 Å²	216	120 Å²	120	82%	0.815	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	-2.5	177.3	-72	-168.7	171.7	-147.5	0.3	114.9	A26 D27	A26-R29 WeakPolarHBondContact O-CB 3.38Å; A26-R29 PolarHBondContact O-N 3.16Å; D27-R29 PolarHBondContact O-N 2.93Å
30	H	37.7	Very low	43.3	Very low	173 Å²	173	126.9 Å²	126.9	80%	0.801	67%	0.674	S	S	*	*	S	Bend	trans	-105	10.5	-172.9	-94.3	-63.8	0	0	0	117
31	R	38.9	Very low	43.9	Very low	229 Å²	229	123.5 Å²	123.5	86%	0.864	67%	0.668	S	S	*	*	S	Bend	trans	-116.3	103.8	170	-116.2	175.8	176	-177.6	-1.5	111.1	T33	R31-T33 PolarHBondContact O-N 3.23Å; R31-T33 PolarHBondContact O-OG1 3Å
32	G	42.1	Very low	44.3	Very low	80 Å²	80	124.7 Å²	124.7	83%	0.825	67%	0.671	S	S	*	*			trans	-40.4	118.1	-178.4	0	0	0	0	0	112.6
33	T	37.2	Very low	44.7	Very low	120 Å²	120	124.5 Å²	124.5	74%	0.736	67%	0.67	S	S	*	*			trans	-149.6	120.4	155.9	9.7	0	0	0	0	107.3	R31 F35	R31-T33 PolarHBondContact O-N 3.23Å; R31-T33 PolarHBondContact O-OG1 3Å; T33-F35 PolarHBondContact O-N 3.03Å
34	D	42.2	Very low	45.4	Very low	165 Å²	165	122.6 Å²	122.6	88%	0.882	66%	0.659	S	S	*	*			trans	-57.2	96.2	174.7	-58.1	-63.3	0	0	0	110.6
35	F	37.8	Very low	46	Very low	170 Å²	170	123.2 Å²	123.2	75%	0.746	66%	0.663	S	S	*	*			trans	-130.4	67.5	163.6	-92.8	-82.3	0	0	0	109.8	T33 G37	T33-F35 PolarHBondContact O-N 3.03Å; F35-G37 PolarHBondContact O-N 2.72Å
36	G	42.6	Very low	46.6	Very low	87 Å²	87	121.4 Å²	121.4	90%	0.897	66%	0.657	S	S	*	*			trans	-61.2	102.7	159.8	0	0	0	0	0	109.8
37	G	49	Very low	46.9	Very low	56 Å²	56	126.4 Å²	126.4	58%	0.577	67%	0.67	S	S	*	*	S	Bend	trans	85.3	90.9	165.7	0	0	0	0	0	115.1	F35	F35-G37 PolarHBondContact O-N 2.72Å
38	S	54.1	Low	47.7	Very low	46 Å²	46	124.8 Å²	124.8	32%	0.322	66%	0.661	S	S	.	*			trans	-161.5	-2	161.3	-88.6	0	0	0	0	118.6	L42	S38-L42 WeakPolarHBondContact O-CG 3.4Å; S38-L42 PolarHBondContact O-N 3.29Å
39	P	53.3	Low	48.2	Very low	92 Å²	92	125.6 Å²	125.6	60%	0.597	66%	0.657	S	S	*	*	H	α-helix	trans	-66.8	-40.6	170.8	-22.3	33.3	0	0	0	112.7	L41 L42 I43	P39-L41 PolarHBondContact O-N 3.05Å; P39-L42 PolarHBondContact O-N 2.96Å; P39-I43 VanDerWaalsContact O-CG1 3.29Å; P39-I43 WeakPolarHBondContact O-CG1 3.17Å; P39-I43 PolarHBondContact O-N 3.14Å
40	W	47.3	Very low	48.7	Very low	201 Å²	201	118.7 Å²	118.7	76%	0.761	64%	0.642	S	S	*	*	H	α-helix	trans	-67.7	-36.5	-178.4	-102	83	0	0	0	113.5	I43 I44	W40-I43 PolarHBondContact O-N 3.14Å; W40-I44 HydrophobicContact CE3-CD1 4.01Å; W40-I44 HydrophobicContact CE3-CG1 4.37Å; W40-I44 VanDerWaalsContact O-CG1 3.27Å; W40-I44 WeakPolarHBondContact O-CG1 3.35Å; W40-I44 PolarHBondContact O-N 3.37Å
41	L	52	Low	49.6	Very low	109 Å²	109	116.1 Å²	116.1	57%	0.571	63%	0.626	S	S	*	*	H	α-helix	trans	-69.5	-35.3	177.2	-69.2	174.1	0	0	0	112	P39 T45	P39-L41 PolarHBondContact O-N 3.05Å; L41-T45 WeakPolarHBondContact O-CB 3.42Å; L41-T45 WeakPolarHBondContact O-CG2 3.38Å; L41-T45 PolarHBondContact O-N 3.34Å; L41-T45 PolarHBondContact O-OG1 3.3Å
42	L	55.6	Low	50.7	Low	115 Å²	115	112.2 Å²	112.2	60%	0.602	62%	0.615	S	S	*	*	H	α-helix	trans	-65	-42.6	171.8	-76.5	167.7	0	0	0	111.2	S38 P39 T45 V46	S38-L42 WeakPolarHBondContact O-CG 3.4Å; S38-L42 PolarHBondContact O-N 3.29Å; P39-L42 PolarHBondContact O-N 2.96Å; L42-T45 WeakPolarHBondContact CA-OG1 3.26Å; L42-T45 PolarHBondContact O-N 2.9Å; L42-T45 PolarHBondContact O-OG1 3.46Å; L42-T45 VanDerWaalsContact O-OG1 3.05Å; L42-V46 WeakPolarHBondContact O-CB 3.35Å; L42-V46 WeakPolarHBondContact O-CG2 3.21Å; L42-V46 PolarHBondContact O-N 3.36Å
43	I	56.8	Low	50.7	Low	103 Å²	103	114.5 Å²	114.5	53%	0.528	60%	0.603	S	S	.	*	H	α-helix	trans	-62.3	-47.9	176.1	-66.2	163.7	0	0	0	110.7	P39 W40 T45 V46 F47	P39-I43 VanDerWaalsContact O-CG1 3.29Å; P39-I43 WeakPolarHBondContact O-CG1 3.17Å; P39-I43 PolarHBondContact O-N 3.14Å; W40-I43 PolarHBondContact O-N 3.14Å; I43-T45 PolarHBondContact O-N 3.04Å; I43-V46 PolarHBondContact O-N 3.02Å; I43-F47 VanDerWaalsContact O-CB 3.3Å; I43-F47 WeakPolarHBondContact O-CB 3.39Å; I43-F47 PolarHBondContact O-N 3.03Å
44	I	54.9	Low	51.3	Low	76 Å²	76	111.4 Å²	111.4	39%	0.39	59%	0.589	S	S	.	*	H	α-helix	trans	-61.8	-44.6	179.6	-70.1	164.6	0	0	0	111.4	W40 F47 L48	W40-I44 HydrophobicContact CE3-CD1 4.01Å; W40-I44 HydrophobicContact CE3-CG1 4.37Å; W40-I44 VanDerWaalsContact O-CG1 3.27Å; W40-I44 WeakPolarHBondContact O-CG1 3.35Å; W40-I44 PolarHBondContact O-N 3.37Å; I44-F47 PolarHBondContact O-N 3.36Å; I44-L48 HydrophobicContact CG2-CD1 3.64Å; I44-L48 WeakPolarHBondContact O-CB 3.25Å; I44-L48 WeakPolarHBondContact O-CD1 3.37Å; I44-L48 PolarHBondContact O-N 2.68Å
45	T	57.8	Low	52.4	Low	79 Å²	79	106.5 Å²	106.5	49%	0.485	56%	0.563	S	S	.	*	H	α-helix	trans	-68.3	-39.8	-179.9	44.9	0	0	0	0	112.6	L41 L42 I43 R49	L41-T45 WeakPolarHBondContact O-CB 3.42Å; L41-T45 WeakPolarHBondContact O-CG2 3.38Å; L41-T45 PolarHBondContact O-N 3.34Å; L41-T45 PolarHBondContact O-OG1 3.3Å; L42-T45 WeakPolarHBondContact CA-OG1 3.26Å; L42-T45 PolarHBondContact O-N 2.9Å; L42-T45 PolarHBondContact O-OG1 3.46Å; L42-T45 VanDerWaalsContact O-OG1 3.05Å; I43-T45 PolarHBondContact O-N 3.04Å; T45-R49 VanDerWaalsContact O-CB 3.28Å; T45-R49 WeakPolarHBondContact O-CB 3.44Å; T45-R49 PolarHBondContact O-N 3.1Å
46	V	53.3	Low	53.2	Low	89 Å²	89	101.9 Å²	101.9	54%	0.539	55%	0.551	S	S	.	*	H	α-helix	trans	-63.6	-43.5	172.9	171.7	0	0	0	0	110.3	L42 I43 R49 S50	L42-V46 WeakPolarHBondContact O-CB 3.35Å; L42-V46 WeakPolarHBondContact O-CG2 3.21Å; L42-V46 PolarHBondContact O-N 3.36Å; I43-V46 PolarHBondContact O-N 3.02Å; V46-R49 PolarHBondContact O-N 3.2Å; V46-S50 WeakPolarHBondContact O-CB 3.5Å; V46-S50 PolarHBondContact O-N 3.35Å; V46-S50 PolarHBondContact O-OG 3.4Å
47	F	47.8	Very low	53.6	Low	154 Å²	154	103 Å²	103	68%	0.675	54%	0.536	S	S	*	.	H	α-helix	trans	-64.8	-43.5	179.4	-154.8	-91.8	0	0	0	112.4	I43 I44 R49 S50 Y51	I43-F47 VanDerWaalsContact O-CB 3.3Å; I43-F47 WeakPolarHBondContact O-CB 3.39Å; I43-F47 PolarHBondContact O-N 3.03Å; I44-F47 PolarHBondContact O-N 3.36Å; F47-R49 VanDerWaalsContact C-N 3.34Å; F47-R49 PolarHBondContact O-N 3.44Å; F47-S50 PolarHBondContact O-N 3.2Å; F47-Y51 VanDerWaalsContact O-CB 3.28Å; F47-Y51 WeakPolarHBondContact O-CB 3.36Å; F47-Y51 PolarHBondContact O-N 3.36Å
48	L	55.5	Low	53.7	Low	96 Å²	96	103.8 Å²	103.8	50%	0.503	53%	0.532	S	S	.	.	H	α-helix	trans	-62.6	-39	174.2	-88.3	152.6	0	0	0	112.6	I44 K52	I44-L48 HydrophobicContact CG2-CD1 3.64Å; I44-L48 WeakPolarHBondContact O-CB 3.25Å; I44-L48 WeakPolarHBondContact O-CD1 3.37Å; I44-L48 PolarHBondContact O-N 2.68Å; L48-K52 WeakPolarHBondContact O-CG 3.23Å; L48-K52 PolarHBondContact O-N 3.47Å
49	R	54.3	Low	54	Low	182 Å²	182	105.2 Å²	105.2	69%	0.687	54%	0.539	S	S	*	.	H	α-helix	trans	-70	-43.6	178.4	-170.1	171.1	-180	139.5	-1.2	111.1	T45 V46 F47 K52 F53	T45-R49 VanDerWaalsContact O-CB 3.28Å; T45-R49 WeakPolarHBondContact O-CB 3.44Å; T45-R49 PolarHBondContact O-N 3.1Å; V46-R49 PolarHBondContact O-N 3.2Å; F47-R49 VanDerWaalsContact C-N 3.34Å; F47-R49 PolarHBondContact O-N 3.44Å; R49-K52 PolarHBondContact O-N 3.43Å; R49-F53 PolarHBondContact O-N 3.18Å
50	S	52.1	Low	54	Low	70 Å²	70	103.5 Å²	103.5	49%	0.49	53%	0.529	S	S	.	.	H	α-helix	trans	-64.3	-39.8	175.1	-61.4	0	0	0	0	112.1	V46 F47 F53 A54	V46-S50 WeakPolarHBondContact O-CB 3.5Å; V46-S50 PolarHBondContact O-N 3.35Å; V46-S50 PolarHBondContact O-OG 3.4Å; F47-S50 PolarHBondContact O-N 3.2Å; S50-F53 WeakPolarHBondContact O-CB 3.41Å; S50-F53 PolarHBondContact O-N 3.43Å; S50-A54 WeakPolarHBondContact O-CB 3.48Å; S50-A54 PolarHBondContact O-N 2.75Å
51	Y	57.7	Low	54.3	Low	120 Å²	120	102.2 Å²	102.2	47%	0.471	53%	0.525	S	S	.	.	H	α-helix	trans	-63.9	-44.4	175.2	172.3	-109	0	0	0	112.2	F47 F53 A54 I55	F47-Y51 VanDerWaalsContact O-CB 3.28Å; F47-Y51 WeakPolarHBondContact O-CB 3.36Å; F47-Y51 PolarHBondContact O-N 3.36Å; Y51-F53 VanDerWaalsContact C-N 3.3Å; Y51-F53 PolarHBondContact O-N 2.77Å; Y51-A54 PolarHBondContact O-N 3.43Å; Y51-I55 HydrophobicContact CD1-CD1 3.65Å; Y51-I55 HydrophobicContact CD2-CD1 4.16Å; Y51-I55 HydrophobicContact CD2-CG1 4.33Å; Y51-I55 HydrophobicContact CE1-CD1 3.16Å; Y51-I55 HydrophobicContact CE1-CG1 4.27Å; Y51-I55 HydrophobicContact CE2-CD1 3.72Å; Y51-I55 HydrophobicContact CE2-CG1 3.97Å; Y51-I55 HydrophobicContact CG-CD1 4.13Å; Y51-I55 VanDerWaalsContact O-CG1 3.31Å; Y51-I55 WeakPolarHBondContact O-CG1 3.43Å; Y51-I55 PolarHBondContact O-N 2.9Å
52	K	60.5	Low	54.6	Low	147 Å²	147	100.5 Å²	100.5	64%	0.639	52%	0.516	S	S	*	.	H	α-helix	trans	-60.7	-39.7	173.3	-79.8	-176.3	170	-177.8	0	112.3	L48 R49 S56	L48-K52 WeakPolarHBondContact O-CG 3.23Å; L48-K52 PolarHBondContact O-N 3.47Å; R49-K52 PolarHBondContact O-N 3.43Å; K52-S56 WeakPolarHBondContact O-CB 3.49Å; K52-S56 PolarHBondContact O-N 3.44Å
53	F	43.2	Very low	54.4	Low	128 Å²	128	98.3 Å²	98.3	56%	0.561	51%	0.51	S	S	*	.	H	α-helix	trans	-65.7	-42.5	174.2	-104.2	-87.2	0	0	0	112.3	R49 S50 Y51 S56 L57	R49-F53 PolarHBondContact O-N 3.18Å; S50-F53 WeakPolarHBondContact O-CB 3.41Å; S50-F53 PolarHBondContact O-N 3.43Å; Y51-F53 VanDerWaalsContact C-N 3.3Å; Y51-F53 PolarHBondContact O-N 2.77Å; F53-S56 PolarHBondContact O-N 2.94Å; F53-L57 WeakPolarHBondContact O-CB 3.37Å; F53-L57 WeakPolarHBondContact O-CG 3.18Å; F53-L57 PolarHBondContact O-N 2.99Å
54	A	50.2	Low	53.9	Low	55 Å²	55	97.8 Å²	97.8	46%	0.455	51%	0.511	S	S	.	.	H	α-helix	trans	-65	-40.8	177.6	0	0	0	0	0	111.8	S50 Y51 L57 C58	S50-A54 WeakPolarHBondContact O-CB 3.48Å; S50-A54 PolarHBondContact O-N 2.75Å; Y51-A54 PolarHBondContact O-N 3.43Å; A54-L57 PolarHBondContact O-N 3.43Å; A54-C58 VanDerWaalsContact O-CB 3.22Å; A54-C58 WeakPolarHBondContact O-CB 3.35Å; A54-C58 PolarHBondContact O-N 2.95Å
55	I	64.8	Low	53.9	Low	62 Å²	62	96.7 Å²	96.7	32%	0.318	51%	0.51	S	S	.	.	H	α-helix	trans	-62.5	-47.6	172	-65.4	161.7	0	0	0	110.2	Y51 L57 C58 T59	Y51-I55 HydrophobicContact CD1-CD1 3.65Å; Y51-I55 HydrophobicContact CD2-CD1 4.16Å; Y51-I55 HydrophobicContact CD2-CG1 4.33Å; Y51-I55 HydrophobicContact CE1-CD1 3.16Å; Y51-I55 HydrophobicContact CE1-CG1 4.27Å; Y51-I55 HydrophobicContact CE2-CD1 3.72Å; Y51-I55 HydrophobicContact CE2-CG1 3.97Å; Y51-I55 HydrophobicContact CG-CD1 4.13Å; Y51-I55 VanDerWaalsContact O-CG1 3.31Å; Y51-I55 WeakPolarHBondContact O-CG1 3.43Å; Y51-I55 PolarHBondContact O-N 2.9Å; I55-L57 VanDerWaalsContact C-N 3.33Å; I55-L57 PolarHBondContact O-N 2.99Å; I55-C58 CarbonylContact O-C 3.55Å; I55-C58 WeakPolarHBondContact O-CB 3.34Å; I55-C58 PolarHBondContact O-N 3.06Å; I55-C58 VanDerWaalsContact O-N 3.08Å; I55-T59 WeakPolarHBondContact O-CB 3.37Å; I55-T59 PolarHBondContact O-N 3.08Å; I55-T59 PolarHBondContact O-OG1 2.93Å
56	S	54	Low	53.4	Low	73 Å²	73	97.7 Å²	97.7	51%	0.51	51%	0.508	S	S	.	.	H	α-helix	trans	-60.6	-40.9	179.3	178.3	0	0	0	0	112.6	K52 F53 T59 S60	K52-S56 WeakPolarHBondContact O-CB 3.49Å; K52-S56 PolarHBondContact O-N 3.44Å; F53-S56 PolarHBondContact O-N 2.94Å; S56-T59 PolarHBondContact O-N 3.24Å; S56-S60 WeakPolarHBondContact O-CB 3.38Å; S56-S60 PolarHBondContact O-N 3.3Å; S56-S60 PolarHBondContact O-OG 3.28Å
57	L	52.3	Low	53.2	Low	111 Å²	111	98.1 Å²	98.1	58%	0.581	51%	0.507	S	S	*	.	H	α-helix	trans	-65.5	-39.3	172.8	-75.1	168.6	0	0	0	111.5	F53 A54 I55 S60 Y61	F53-L57 WeakPolarHBondContact O-CB 3.37Å; F53-L57 WeakPolarHBondContact O-CG 3.18Å; F53-L57 PolarHBondContact O-N 2.99Å; A54-L57 PolarHBondContact O-N 3.43Å; I55-L57 VanDerWaalsContact C-N 3.33Å; I55-L57 PolarHBondContact O-N 2.99Å; L57-S60 VanDerWaalsContact CA-OG 3.31Å; L57-S60 WeakPolarHBondContact CA-OG 3.29Å; L57-S60 PolarHBondContact O-OG 3.36Å; L57-Y61 WeakPolarHBondContact O-CB 3.29Å; L57-Y61 PolarHBondContact O-N 2.92Å
58	C	51.3	Low	53.1	Low	71 Å²	71	99 Å²	99	48%	0.48	51%	0.51	S	S	.	.	H	α-helix	trans	-68.3	-42.8	177	-156.3	0	0	0	0	111.5	A54 I55 Y61 L62	A54-C58 VanDerWaalsContact O-CB 3.22Å; A54-C58 WeakPolarHBondContact O-CB 3.35Å; A54-C58 PolarHBondContact O-N 2.95Å; I55-C58 CarbonylContact O-C 3.55Å; I55-C58 WeakPolarHBondContact O-CB 3.34Å; I55-C58 PolarHBondContact O-N 3.06Å; I55-C58 VanDerWaalsContact O-N 3.08Å; C58-Y61 PolarHBondContact O-N 2.94Å; C58-L62 VanDerWaalsContact O-CB 3.31Å; C58-L62 WeakPolarHBondContact O-CB 3.27Å; C58-L62 WeakPolarHBondContact O-CD1 3.42Å; C58-L62 WeakPolarHBondContact O-CG 3.42Å; C58-L62 PolarHBondContact O-N 3.3Å
59	T	60	Low	52.8	Low	77 Å²	77	99.3 Å²	99.3	47%	0.472	52%	0.516	S	S	.	.	H	α-helix	trans	-64.5	-44.5	175.7	-55	0	0	0	0	111.3	I55 S56 L62 C63	I55-T59 WeakPolarHBondContact O-CB 3.37Å; I55-T59 PolarHBondContact O-N 3.08Å; I55-T59 PolarHBondContact O-OG1 2.93Å; S56-T59 PolarHBondContact O-N 3.24Å; T59-L62 PolarHBondContact O-N 3.26Å; T59-C63 WeakPolarHBondContact O-CB 3.47Å; T59-C63 PolarHBondContact O-N 3.01Å; T59-C63 PolarHBondContact O-SG 2.96Å
60	S	53.3	Low	52.3	Low	55 Å²	55	94.5 Å²	94.5	39%	0.385	50%	0.503	S	S	.	.	H	α-helix	trans	-66.5	-39.4	175.9	54.5	0	0	0	0	112	S56 L57 C63 V64	S56-S60 WeakPolarHBondContact O-CB 3.38Å; S56-S60 PolarHBondContact O-N 3.3Å; S56-S60 PolarHBondContact O-OG 3.28Å; L57-S60 VanDerWaalsContact CA-OG 3.31Å; L57-S60 WeakPolarHBondContact CA-OG 3.29Å; L57-S60 PolarHBondContact O-OG 3.36Å; S60-C63 WeakPolarHBondContact O-CB 3.3Å; S60-C63 PolarHBondContact O-N 3.05Å; S60-V64 VanDerWaalsContact O-CG2 3.32Å; S60-V64 WeakPolarHBondContact O-CG2 3.41Å; S60-V64 PolarHBondContact O-N 3.48Å
61	Y	53.8	Low	51.6	Low	174 Å²	174	98.6 Å²	98.6	68%	0.682	51%	0.513	S	S	*	.	H	α-helix	trans	-65.6	-39.2	175.3	-167.4	-96.4	0	0	0	112.4	L57 C58 V64 S65	L57-Y61 WeakPolarHBondContact O-CB 3.29Å; L57-Y61 PolarHBondContact O-N 2.92Å; C58-Y61 PolarHBondContact O-N 2.94Å; Y61-V64 PolarHBondContact O-N 3.5Å; Y61-S65 WeakPolarHBondContact O-CB 3.42Å; Y61-S65 PolarHBondContact O-N 2.96Å; Y61-S65 PolarHBondContact O-OG 3.47Å
62	L	57	Low	51	Low	74 Å²	74	98 Å²	98	39%	0.387	52%	0.523	S	S	.	.	H	α-helix	trans	-65.2	-40.3	171.6	-72.2	168.5	0	0	0	111.4	C58 T59 S65 F66	C58-L62 VanDerWaalsContact O-CB 3.31Å; C58-L62 WeakPolarHBondContact O-CB 3.27Å; C58-L62 WeakPolarHBondContact O-CD1 3.42Å; C58-L62 WeakPolarHBondContact O-CG 3.42Å; C58-L62 PolarHBondContact O-N 3.3Å; T59-L62 PolarHBondContact O-N 3.26Å; L62-S65 PolarHBondContact O-N 3.39Å; L62-F66 VanDerWaalsContact O-CB 3.31Å; L62-F66 WeakPolarHBondContact O-CB 3.47Å; L62-F66 PolarHBondContact O-N 3.06Å
63	C	52.2	Low	50	Low	69 Å²	69	95.8 Å²	95.8	47%	0.466	53%	0.527	S	S	.	.	H	α-helix	trans	-64.3	-43.1	174.5	-83.6	0	0	0	0	112.7	T59 S60 S65 F66 L67	T59-C63 WeakPolarHBondContact O-CB 3.47Å; T59-C63 PolarHBondContact O-N 3.01Å; T59-C63 PolarHBondContact O-SG 2.96Å; S60-C63 WeakPolarHBondContact O-CB 3.3Å; S60-C63 PolarHBondContact O-N 3.05Å; C63-S65 VanDerWaalsContact C-N 3.32Å; C63-F66 PolarHBondContact O-N 2.93Å; C63-L67 WeakPolarHBondContact O-CB 3.26Å; C63-L67 WeakPolarHBondContact O-CG 3.47Å; C63-L67 PolarHBondContact O-N 3.02Å
64	V	46.5	Very low	49.8	Very low	92 Å²	92	98.9 Å²	98.9	56%	0.558	54%	0.543	S	S	*	.	H	α-helix	trans	-66	-38.4	176.3	173.8	0	0	0	0	110.7	S60 Y61 F66 L67 K68	S60-V64 VanDerWaalsContact O-CG2 3.32Å; S60-V64 WeakPolarHBondContact O-CG2 3.41Å; S60-V64 PolarHBondContact O-N 3.48Å; Y61-V64 PolarHBondContact O-N 3.5Å; V64-F66 VanDerWaalsContact C-N 3.33Å; V64-L67 PolarHBondContact O-N 3.33Å; V64-K68 VanDerWaalsContact O-CB 3.3Å; V64-K68 WeakPolarHBondContact O-CB 3.36Å; V64-K68 PolarHBondContact O-N 3.01Å
65	S	55.1	Low	49.4	Very low	53 Å²	53	103.7 Å²	103.7	37%	0.371	56%	0.561	S	S	.	*	H	α-helix	trans	-64.1	-39.7	173.9	-57.8	0	0	0	0	111.6	Y61 L62 C63 K68 T69	Y61-S65 WeakPolarHBondContact O-CB 3.42Å; Y61-S65 PolarHBondContact O-N 2.96Å; Y61-S65 PolarHBondContact O-OG 3.47Å; L62-S65 PolarHBondContact O-N 3.39Å; C63-S65 VanDerWaalsContact C-N 3.32Å; S65-K68 PolarHBondContact O-N 3.15Å; S65-T69 WeakPolarHBondContact O-CG2 3.38Å; S65-T69 PolarHBondContact O-N 3.5Å
66	F	46.6	Very low	48.1	Very low	100 Å²	100	104.4 Å²	104.4	44%	0.439	58%	0.583	S	S	.	*	H	α-helix	trans	-70.4	-42.5	177.3	-164.8	-106.4	0	0	0	112.4	L62 C63 V64 K68 T69 I70 Q95	L62-F66 VanDerWaalsContact O-CB 3.31Å; L62-F66 WeakPolarHBondContact O-CB 3.47Å; L62-F66 PolarHBondContact O-N 3.06Å; C63-F66 PolarHBondContact O-N 2.93Å; V64-F66 VanDerWaalsContact C-N 3.33Å; F66-K68 VanDerWaalsContact C-N 3.28Å; F66-K68 PolarHBondContact O-N 3.37Å; F66-T69 WeakPolarHBondContact CA-OG1 3.28Å; F66-T69 PolarHBondContact O-N 3.11Å; F66-T69 PolarHBondContact O-OG1 3.29Å; F66-I70 HydrophobicContact CD1-CD1 3.5Å; F66-I70 VanDerWaalsContact CD1-CD1 3.5Å; F66-I70 HydrophobicContact CD1-CG1 4.35Å; F66-I70 HydrophobicContact CE1-CD1 3.23Å; F66-I70 HydrophobicContact CE1-CG1 4.26Å; F66-I70 HydrophobicContact CG-CD1 4.43Å; F66-I70 HydrophobicContact CZ-CD1 3.95Å; F66-I70 WeakPolarHBondContact O-CG1 3.28Å; F66-I70 PolarHBondContact O-N 3.44Å; F66-Q95 HydrophobicContact CE2-CG 4.15Å; F66-Q95 HydrophobicContact CZ-CG 4.36Å; F66-Q95 VanDerWaalsContact CZ-NE2 3.29Å
67	L	49.4	Very low	47.8	Very low	98 Å²	98	110 Å²	110	51%	0.513	60%	0.601	S	S	.	*	H	α-helix	trans	-61.5	-37.7	174.3	-77.6	164.6	0	0	0	111.7	C63 V64 T69 I70 F71	C63-L67 WeakPolarHBondContact O-CB 3.26Å; C63-L67 WeakPolarHBondContact O-CG 3.47Å; C63-L67 PolarHBondContact O-N 3.02Å; V64-L67 PolarHBondContact O-N 3.33Å; L67-T69 VanDerWaalsContact C-N 3.26Å; L67-T69 PolarHBondContact O-N 3.37Å; L67-I70 PolarHBondContact O-N 3.09Å; L67-F71 PolarHBondContact O-N 3.21Å
68	K	46.4	Very low	47.2	Very low	173 Å²	173	112.1 Å²	112.1	75%	0.752	61%	0.613	S	S	*	*	H	α-helix	trans	-68.4	-23.3	174.4	-166.4	163.3	-176.5	163.9	0	113.3	V64 S65 F66	V64-K68 VanDerWaalsContact O-CB 3.3Å; V64-K68 WeakPolarHBondContact O-CB 3.36Å; V64-K68 PolarHBondContact O-N 3.01Å; S65-K68 PolarHBondContact O-N 3.15Å; F66-K68 VanDerWaalsContact C-N 3.28Å; F66-K68 PolarHBondContact O-N 3.37Å
69	T	48.3	Very low	47.1	Very low	102 Å²	102	112.8 Å²	112.8	63%	0.626	63%	0.631	S	S	*	*	H	α-helix	trans	-85.2	-22.9	170.9	56.8	0	0	0	0	113.9	S65 F66 L67	S65-T69 WeakPolarHBondContact O-CG2 3.38Å; S65-T69 PolarHBondContact O-N 3.5Å; F66-T69 WeakPolarHBondContact CA-OG1 3.28Å; F66-T69 PolarHBondContact O-N 3.11Å; F66-T69 PolarHBondContact O-OG1 3.29Å; L67-T69 VanDerWaalsContact C-N 3.26Å; L67-T69 PolarHBondContact O-N 3.37Å
70	I	43.6	Very low	46.5	Very low	81 Å²	81	111.9 Å²	111.9	42%	0.415	63%	0.628	S	S	.	*	H	α-helix	trans	-87.2	-35.6	-179.7	-71.3	179	0	0	0	112.4	F66 L67 P72	F66-I70 HydrophobicContact CD1-CD1 3.5Å; F66-I70 VanDerWaalsContact CD1-CD1 3.5Å; F66-I70 HydrophobicContact CD1-CG1 4.35Å; F66-I70 HydrophobicContact CE1-CD1 3.23Å; F66-I70 HydrophobicContact CE1-CG1 4.26Å; F66-I70 HydrophobicContact CG-CD1 4.43Å; F66-I70 HydrophobicContact CZ-CD1 3.95Å; F66-I70 WeakPolarHBondContact O-CG1 3.28Å; F66-I70 PolarHBondContact O-N 3.44Å; L67-I70 PolarHBondContact O-N 3.09Å; I70-P72 VanDerWaalsContact C-CD 3.43Å; I70-P72 WeakPolarHBondContact O-CD 3.28Å
71	F	38	Very low	46.4	Very low	156 Å²	156	115 Å²	115	68%	0.684	65%	0.645	S	S	*	*			trans	-102.6	86.7	172.8	-76.3	-85.6	0	0	0	109.9	L67 S73	L67-F71 PolarHBondContact O-N 3.21Å; F71-S73 PolarHBondContact O-N 3.04Å; F71-S73 VanDerWaalsContact O-N 3.08Å
72	P	44.8	Very low	46.5	Very low	107 Å²	107	111.5 Å²	111.5	70%	0.695	64%	0.638	S	S	*	*			trans	-61.4	113.7	156.9	26.2	-28.1	0	0	0	106.2	I70 Q74	I70-P72 VanDerWaalsContact C-CD 3.43Å; I70-P72 WeakPolarHBondContact O-CD 3.28Å; P72-Q74 PolarHBondContact O-N 3.41Å
73	S	39.5	Very low	46.2	Very low	101 Å²	101	112.6 Å²	112.6	71%	0.706	65%	0.648	S	S	*	*			trans	-53.7	114.7	170.9	60	0	0	0	0	107.3	F71 N75	F71-S73 PolarHBondContact O-N 3.04Å; F71-S73 VanDerWaalsContact O-N 3.08Å; S73-N75 PolarHBondContact O-N 2.91Å
74	Q	39.8	Very low	46.1	Very low	193 Å²	193	115.8 Å²	115.8	90%	0.902	66%	0.656	S	S	*	*			trans	-54.1	103.3	169.3	-93.1	172.1	-14.3	0	0	107.7	P72	P72-Q74 PolarHBondContact O-N 3.41Å
75	N	40.8	Very low	46.2	Very low	156 Å²	156	116.4 Å²	116.4	83%	0.834	65%	0.653	S	S	*	*			trans	-149.6	114.6	162.4	-94.4	-17.7	0	0	0	107.1	S73	S73-N75 PolarHBondContact O-N 2.91Å
76	G	38.5	Very low	46.1	Very low	76 Å²	76	122.7 Å²	122.7	78%	0.784	67%	0.668	S	S	*	*			trans	103.2	94.4	173.9	0	0	0	0	0	113.2	D78	G76-D78 PolarHBondContact O-N 2.98Å
77	H	46.7	Very low	46.2	Very low	192 Å²	192	120.3 Å²	120.3	89%	0.889	67%	0.667	S	S	*	*			trans	-51.9	127.3	156	-84.4	-74.2	0	0	0	109.8
78	D	39.1	Very low	45.9	Very low	155 Å²	155	124.8 Å²	124.8	83%	0.829	68%	0.677	S	S	*	*			trans	-162.6	134.1	136.7	-103.7	-23.6	0	0	0	111.4	G76 S80	G76-D78 PolarHBondContact O-N 2.98Å; D78-S80 PolarHBondContact O-N 3.29Å
79	G	49.4	Very low	45.8	Very low	84 Å²	84	125 Å²	125	87%	0.866	67%	0.673	S	S	*	*			trans	-74.4	116.9	-167.7	0	0	0	0	0	113.5
80	S	48.3	Very low	45.6	Very low	59 Å²	59	123.2 Å²	123.2	41%	0.413	67%	0.665	S	S	.	*			trans	-156.7	94	151.7	-176.2	0	0	0	0	108.8	D78 D82 V83 Q84	D78-S80 PolarHBondContact O-N 3.29Å; S80-D82 VanDerWaalsContact C-N 3.3Å; S80-D82 PolarHBondContact O-N 2.83Å; S80-V83 WeakPolarHBondContact OG-CG2 3.46Å; S80-Q84 PolarHBondContact O-N 3.06Å
81	T	51.4	Low	45.8	Very low	120 Å²	120	123.4 Å²	123.4	74%	0.736	67%	0.667	S	S	*	*	H	α-helix	trans	-63.6	-32.2	-175.4	19.9	0	0	0	0	112.7	Q85	T81-Q85 VanDerWaalsContact O-CB 3.23Å; T81-Q85 WeakPolarHBondContact O-CB 3.37Å; T81-Q85 PolarHBondContact O-N 2.94Å; T81-Q85 VanDerWaalsContact O-N 3.14Å
82	D	54.8	Low	46.1	Very low	101 Å²	101	118.9 Å²	118.9	54%	0.54	65%	0.654	S	S	.	*	H	α-helix	trans	-74.6	-41.8	-177.5	-170.4	66.6	0	0	0	113.2	S80 Q85 R86	S80-D82 VanDerWaalsContact C-N 3.3Å; S80-D82 PolarHBondContact O-N 2.83Å; D82-Q85 PolarHBondContact O-N 2.88Å; D82-R86 WeakPolarHBondContact O-CB 3.32Å; D82-R86 PolarHBondContact O-N 3.42Å
83	V	50.8	Low	46.1	Very low	97 Å²	97	123.2 Å²	123.2	59%	0.588	66%	0.656	S	S	*	*	H	α-helix	trans	-69.3	-40.5	180	-179.8	0	0	0	0	111	S80 Q85 R86 A87	S80-V83 WeakPolarHBondContact OG-CG2 3.46Å; V83-Q85 VanDerWaalsContact C-N 3.35Å; V83-R86 PolarHBondContact O-N 2.96Å; V83-A87 WeakPolarHBondContact O-CB 3.39Å; V83-A87 PolarHBondContact O-N 3.46Å
84	Q	50.6	Low	46.2	Very low	135 Å²	135	124 Å²	124	63%	0.631	64%	0.644	S	S	*	*	H	α-helix	trans	-65	-38.7	175	-72.3	-163.7	-11.8	0	0	111.9	S80 A87 R88	S80-Q84 PolarHBondContact O-N 3.06Å; Q84-A87 PolarHBondContact O-N 3.05Å; Q84-R88 VanDerWaalsContact O-CB 3.26Å; Q84-R88 WeakPolarHBondContact O-CB 3.46Å; Q84-R88 PolarHBondContact O-N 3.46Å
85	Q	48.6	Very low	46.3	Very low	105 Å²	105	118.6 Å²	118.6	49%	0.491	62%	0.618	S	S	.	*	H	α-helix	trans	-72.2	-35.4	-179.7	-157.3	165.1	6.2	0	0	112.1	T81 D82 V83 R88 R89	T81-Q85 VanDerWaalsContact O-CB 3.23Å; T81-Q85 WeakPolarHBondContact O-CB 3.37Å; T81-Q85 PolarHBondContact O-N 2.94Å; T81-Q85 VanDerWaalsContact O-N 3.14Å; D82-Q85 PolarHBondContact O-N 2.88Å; V83-Q85 VanDerWaalsContact C-N 3.35Å; Q85-R88 PolarHBondContact O-N 2.93Å; Q85-R89 WeakPolarHBondContact O-CG 3.27Å; Q85-R89 PolarHBondContact O-N 3.32Å
86	R	52.8	Low	46.4	Very low	186 Å²	186	116.6 Å²	116.6	70%	0.702	60%	0.604	S	S	*	*	H	α-helix	trans	-68.6	-41	173.1	-163.4	-179.2	-81.5	-149	-1.6	112.1	D82 V83 S90	D82-R86 WeakPolarHBondContact O-CB 3.32Å; D82-R86 PolarHBondContact O-N 3.42Å; V83-R86 PolarHBondContact O-N 2.96Å; R86-S90 WeakPolarHBondContact O-CB 3.43Å; R86-S90 PolarHBondContact O-N 2.71Å; R86-S90 VanDerWaalsContact O-N 3.08Å
87	A	47.8	Very low	46.6	Very low	50 Å²	50	114.7 Å²	114.7	41%	0.413	58%	0.584	S	S	.	*	H	α-helix	trans	-64	-38	171.9	0	0	0	0	0	112.4	V83 Q84 S90 N91	V83-A87 WeakPolarHBondContact O-CB 3.39Å; V83-A87 PolarHBondContact O-N 3.46Å; Q84-A87 PolarHBondContact O-N 3.05Å; A87-S90 PolarHBondContact O-N 2.96Å; A87-N91 WeakPolarHBondContact O-CB 3.36Å; A87-N91 PolarHBondContact O-N 2.67Å; A87-N91 PolarHBondContact O-ND2 3.31Å
88	R	43.7	Very low	46.7	Very low	192 Å²	192	110.4 Å²	110.4	73%	0.725	57%	0.567	S	S	*	*	H	α-helix	trans	-67.3	-45.5	177.4	-156	174	-170.3	171.1	2	112	Q84 Q85 S90 N91 C92	Q84-R88 VanDerWaalsContact O-CB 3.26Å; Q84-R88 WeakPolarHBondContact O-CB 3.46Å; Q84-R88 PolarHBondContact O-N 3.46Å; Q85-R88 PolarHBondContact O-N 2.93Å; R88-S90 VanDerWaalsContact C-N 3.33Å; R88-S90 PolarHBondContact O-N 3.01Å; R88-N91 PolarHBondContact O-N 3.1Å; R88-C92 PolarHBondContact O-N 3.1Å; R88-C92 PolarHBondContact O-SG 3.37Å; R88-C92 VanDerWaalsContact O-SG 3.38Å
89	R	44.1	Very low	47.1	Very low	177 Å²	177	109 Å²	109	67%	0.668	55%	0.554	S	S	*	*	H	α-helix	trans	-62.5	-37.5	175.2	-74.4	-177.1	-175.8	-178.3	3.6	112.5	Q85 R93	Q85-R89 WeakPolarHBondContact O-CG 3.27Å; Q85-R89 PolarHBondContact O-N 3.32Å; R89-R93 PolarHBondContact O-N 3.42Å
90	S	45.3	Very low	47.3	Very low	64 Å²	64	109.8 Å²	109.8	45%	0.448	54%	0.537	S	S	.	.	H	α-helix	trans	-66.2	-41.7	175.2	169.2	0	0	0	0	112.6	R86 A87 R88 R94	R86-S90 WeakPolarHBondContact O-CB 3.43Å; R86-S90 PolarHBondContact O-N 2.71Å; R86-S90 VanDerWaalsContact O-N 3.08Å; A87-S90 PolarHBondContact O-N 2.96Å; R88-S90 VanDerWaalsContact C-N 3.33Å; R88-S90 PolarHBondContact O-N 3.01Å; S90-R94 PolarHBondContact O-N 3.44Å; S90-R94 VanDerWaalsContact O-N 3.11Å
91	N	47.3	Very low	47.3	Very low	86 Å²	86	111 Å²	111	46%	0.46	54%	0.542	S	S	.	.	H	α-helix	trans	-70.5	-34.5	178.4	-83.4	-30.8	0	0	0	113.1	A87 R88 R94 Q95	A87-N91 WeakPolarHBondContact O-CB 3.36Å; A87-N91 PolarHBondContact O-N 2.67Å; A87-N91 PolarHBondContact O-ND2 3.31Å; R88-N91 PolarHBondContact O-N 3.1Å; N91-R94 WeakPolarHBondContact O-CB 3.46Å; N91-R94 PolarHBondContact O-N 3.48Å; N91-Q95 PolarHBondContact O-N 3.46Å
92	C	44.7	Very low	47.1	Very low	61 Å²	61	110.1 Å²	110.1	41%	0.412	53%	0.532	S	S	.	.	H	α-helix	trans	-61.1	-47.1	173.1	-71.6	0	0	0	0	112	R88 R94 Q95 E96	R88-C92 PolarHBondContact O-N 3.1Å; R88-C92 PolarHBondContact O-SG 3.37Å; R88-C92 VanDerWaalsContact O-SG 3.38Å; C92-R94 VanDerWaalsContact C-N 3.3Å; C92-R94 PolarHBondContact O-N 3.19Å; C92-Q95 WeakPolarHBondContact O-CB 3.39Å; C92-Q95 PolarHBondContact O-N 2.99Å; C92-Q95 VanDerWaalsContact O-N 3.17Å; C92-E96 WeakPolarHBondContact O-CG 3.31Å; C92-E96 PolarHBondContact O-N 3.41Å
93	R	44.4	Very low	47	Very low	198 Å²	198	110.3 Å²	110.3	75%	0.747	53%	0.529	S	S	*	.	H	α-helix	trans	-63.9	-33.6	175.7	-71	-172.6	-173.2	-178.1	1.7	113.1	R89 E96 G97	R89-R93 PolarHBondContact O-N 3.42Å; R93-E96 PolarHBondContact O-N 3.42Å; R93-G97 PolarHBondContact O-N 2.93Å; R93-G97 VanDerWaalsContact O-N 3.11Å
94	R	42.2	Very low	47.1	Very low	117 Å²	117	110.7 Å²	110.7	44%	0.442	53%	0.528	S	S	.	.	H	α-helix	trans	-66.6	-40.3	172.7	-95.9	-179	166.2	177.9	-4.3	112.6	S90 N91 C92 E96 G97 I98	S90-R94 PolarHBondContact O-N 3.44Å; S90-R94 VanDerWaalsContact O-N 3.11Å; N91-R94 WeakPolarHBondContact O-CB 3.46Å; N91-R94 PolarHBondContact O-N 3.48Å; C92-R94 VanDerWaalsContact C-N 3.3Å; C92-R94 PolarHBondContact O-N 3.19Å; R94-E96 VanDerWaalsContact C-N 3.32Å; R94-G97 PolarHBondContact O-N 3.05Å; R94-I98 WeakPolarHBondContact O-CG1 3.4Å; R94-I98 PolarHBondContact O-N 3.17Å
95	Q	41.9	Very low	47.3	Very low	79 Å²	79	109.1 Å²	109.1	37%	0.369	52%	0.523	S	S	.	.	H	α-helix	trans	-64.1	-39.6	175.4	-106.9	175.9	-14.8	0	0	111.3	F66 N91 C92 I98 K99	F66-Q95 HydrophobicContact CE2-CG 4.15Å; F66-Q95 HydrophobicContact CZ-CG 4.36Å; F66-Q95 VanDerWaalsContact CZ-NE2 3.29Å; N91-Q95 PolarHBondContact O-N 3.46Å; C92-Q95 WeakPolarHBondContact O-CB 3.39Å; C92-Q95 PolarHBondContact O-N 2.99Å; C92-Q95 VanDerWaalsContact O-N 3.17Å; Q95-I98 PolarHBondContact O-N 3.02Å; Q95-K99 WeakPolarHBondContact O-CB 3.34Å; Q95-K99 PolarHBondContact O-N 3.39Å
96	E	42.4	Very low	47.5	Very low	114 Å²	114	110.1 Å²	110.1	53%	0.533	53%	0.526	S	S	.	.	H	α-helix	trans	-62.5	-46.9	175.1	-73.5	161.2	-175.9	0	0	111.7	C92 R93 R94 I98 K99 I100	C92-E96 WeakPolarHBondContact O-CG 3.31Å; C92-E96 PolarHBondContact O-N 3.41Å; R93-E96 PolarHBondContact O-N 3.42Å; R94-E96 VanDerWaalsContact C-N 3.32Å; E96-I98 PolarHBondContact O-N 3.42Å; E96-K99 PolarHBondContact O-N 3.35Å; E96-I100 WeakPolarHBondContact O-CD1 3.48Å; E96-I100 VanDerWaalsContact O-CG1 3.23Å; E96-I100 WeakPolarHBondContact O-CG1 3.49Å; E96-I100 PolarHBondContact O-N 2.94Å
97	G	43	Very low	48	Very low	36 Å²	36	105 Å²	105	37%	0.371	52%	0.515	S	S	.	.	H	α-helix	trans	-63.8	-39.9	177.6	0	0	0	0	0	113.9	R93 R94 V101	R93-G97 PolarHBondContact O-N 2.93Å; R93-G97 VanDerWaalsContact O-N 3.11Å; R94-G97 PolarHBondContact O-N 3.05Å; G97-V101 WeakPolarHBondContact O-CG2 3.31Å; G97-V101 PolarHBondContact O-N 3.34Å
98	I	47.6	Very low	48.3	Very low	102 Å²	102	107.7 Å²	107.7	52%	0.523	52%	0.523	S	S	.	.	H	α-helix	trans	-69.8	-38	176.5	-70.5	168.2	0	0	0	111	R94 Q95 E96 V101 L102	R94-I98 WeakPolarHBondContact O-CG1 3.4Å; R94-I98 PolarHBondContact O-N 3.17Å; Q95-I98 PolarHBondContact O-N 3.02Å; E96-I98 PolarHBondContact O-N 3.42Å; I98-V101 PolarHBondContact O-N 2.98Å; I98-L102 HydrophobicContact CG2-CD1 3.69Å; I98-L102 WeakPolarHBondContact O-CB 3.47Å; I98-L102 WeakPolarHBondContact O-CD1 3.49Å; I98-L102 PolarHBondContact O-N 3.18Å
99	K	47.1	Very low	48.8	Very low	127 Å²	127	104 Å²	104	55%	0.552	51%	0.509	S	S	*	.	H	α-helix	trans	-62.9	-44.7	176.3	-176.7	-178.4	174.3	-170.5	0	111.4	Q95 E96 L102 E103	Q95-K99 WeakPolarHBondContact O-CB 3.34Å; Q95-K99 PolarHBondContact O-N 3.39Å; E96-K99 PolarHBondContact O-N 3.35Å; K99-L102 PolarHBondContact O-N 2.78Å; K99-E103 WeakPolarHBondContact CE-OE1 3.47Å; K99-E103 WeakPolarHBondContact O-CB 3.47Å; K99-E103 WeakPolarHBondContact O-CG 3.3Å; K99-E103 PolarHBondContact O-N 2.95Å
100	I	55.2	Low	49.3	Very low	99 Å²	99	103.5 Å²	103.5	51%	0.508	51%	0.507	S	S	.	.	H	α-helix	trans	-61.8	-47.2	177.6	-67	162.2	0	0	0	110.7	E96 L102 E103 D104	E96-I100 WeakPolarHBondContact O-CD1 3.48Å; E96-I100 VanDerWaalsContact O-CG1 3.23Å; E96-I100 WeakPolarHBondContact O-CG1 3.49Å; E96-I100 PolarHBondContact O-N 2.94Å; I100-L102 VanDerWaalsContact C-N 3.3Å; I100-L102 PolarHBondContact O-N 3.1Å; I100-E103 PolarHBondContact O-N 2.9Å; I100-D104 PolarHBondContact O-N 3.47Å
101	V	47.2	Very low	49.7	Very low	85 Å²	85	106.1 Å²	106.1	52%	0.515	51%	0.512	S	S	.	.	H	α-helix	trans	-63	-37.2	178.6	173.2	0	0	0	0	111.8	G97 I98 I105	G97-V101 WeakPolarHBondContact O-CG2 3.31Å; G97-V101 PolarHBondContact O-N 3.34Å; I98-V101 PolarHBondContact O-N 2.98Å; V101-I105 HydrophobicContact CG1-CD1 3.85Å; V101-I105 WeakPolarHBondContact O-CB 3.36Å; V101-I105 WeakPolarHBondContact O-CD1 3.34Å; V101-I105 WeakPolarHBondContact O-CG1 3.34Å; V101-I105 PolarHBondContact O-N 2.91Å; V101-I105 VanDerWaalsContact O-N 3.08Å
102	L	47.3	Very low	49.9	Very low	101 Å²	101	104.8 Å²	104.8	53%	0.529	51%	0.507	S	S	.	.	H	α-helix	trans	-70.3	-38.8	175.9	-88.4	154	0	0	0	112.8	I98 K99 I100 I105 F106	I98-L102 HydrophobicContact CG2-CD1 3.69Å; I98-L102 WeakPolarHBondContact O-CB 3.47Å; I98-L102 WeakPolarHBondContact O-CD1 3.49Å; I98-L102 PolarHBondContact O-N 3.18Å; K99-L102 PolarHBondContact O-N 2.78Å; I100-L102 VanDerWaalsContact C-N 3.3Å; I100-L102 PolarHBondContact O-N 3.1Å; L102-I105 PolarHBondContact O-N 2.85Å; L102-F106 VanDerWaalsContact O-CB 3.29Å; L102-F106 WeakPolarHBondContact O-CB 3.15Å; L102-F106 PolarHBondContact O-N 2.87Å
103	E	52.6	Low	50.2	Low	105 Å²	105	104.7 Å²	104.7	49%	0.491	50%	0.5	S	S	.	.	H	α-helix	trans	-64.6	-41.6	175.6	-77.9	178.4	-178.2	0	0	111.4	K99 I100 F106 T107	K99-E103 WeakPolarHBondContact CE-OE1 3.47Å; K99-E103 WeakPolarHBondContact O-CB 3.47Å; K99-E103 WeakPolarHBondContact O-CG 3.3Å; K99-E103 PolarHBondContact O-N 2.95Å; I100-E103 PolarHBondContact O-N 2.9Å; E103-F106 PolarHBondContact O-N 3.28Å; E103-T107 WeakPolarHBondContact O-CB 3.48Å; E103-T107 VanDerWaalsContact O-CG2 3.26Å; E103-T107 WeakPolarHBondContact O-CG2 3.45Å; E103-T107 PolarHBondContact O-N 2.98Å; E103-T107 PolarHBondContact O-OG1 3.43Å
104	D	53.5	Low	50.9	Low	105 Å²	105	98.8 Å²	98.8	56%	0.561	49%	0.486	S	S	*	.	H	α-helix	trans	-65	-40.8	175.1	-79.8	-11.4	0	0	0	112.3	I100 F106 T107 L108	I100-D104 PolarHBondContact O-N 3.47Å; D104-F106 VanDerWaalsContact C-N 3.35Å; D104-T107 WeakPolarHBondContact CA-OG1 3.31Å; D104-T107 PolarHBondContact O-OG1 3.3Å; D104-L108 VanDerWaalsContact O-CB 3.31Å; D104-L108 WeakPolarHBondContact O-CB 3.22Å; D104-L108 PolarHBondContact O-N 2.91Å
105	I	54.6	Low	52	Low	103 Å²	103	100.2 Å²	100.2	53%	0.528	50%	0.496	S	S	.	.	H	α-helix	trans	-65.9	-40.5	175.3	-69.7	166.1	0	0	0	110.7	V101 L102 W109	V101-I105 HydrophobicContact CG1-CD1 3.85Å; V101-I105 WeakPolarHBondContact O-CB 3.36Å; V101-I105 WeakPolarHBondContact O-CD1 3.34Å; V101-I105 WeakPolarHBondContact O-CG1 3.34Å; V101-I105 PolarHBondContact O-N 2.91Å; V101-I105 VanDerWaalsContact O-N 3.08Å; L102-I105 PolarHBondContact O-N 2.85Å; I105-W109 VanDerWaalsContact O-CB 3.29Å; I105-W109 WeakPolarHBondContact O-CB 3.34Å; I105-W109 PolarHBondContact O-N 3.35Å
106	F	53.5	Low	52.6	Low	125 Å²	125	100 Å²	100	55%	0.548	50%	0.5	S	S	.	.	H	α-helix	trans	-70.7	-37.5	-178.6	-157.6	-93.6	0	0	0	112.1	L102 E103 D104 W109 R110	L102-F106 VanDerWaalsContact O-CB 3.29Å; L102-F106 WeakPolarHBondContact O-CB 3.15Å; L102-F106 PolarHBondContact O-N 2.87Å; E103-F106 PolarHBondContact O-N 3.28Å; D104-F106 VanDerWaalsContact C-N 3.35Å; F106-W109 HydrophobicContact CE2-CE3 4.42Å; F106-W109 HydrophobicContact CZ-CZ3 4.44Å; F106-W109 PolarHBondContact O-N 3.41Å; F106-R110 WeakPolarHBondContact O-CB 3.46Å; F106-R110 PolarHBondContact O-N 3.18Å
107	T	62.1	Low	52.8	Low	78 Å²	78	100 Å²	100	48%	0.479	50%	0.495	S	S	.	.	H	α-helix	trans	-67.7	-43.7	175	52.3	0	0	0	0	111.4	E103 D104 W109 R110 Q111	E103-T107 WeakPolarHBondContact O-CB 3.48Å; E103-T107 VanDerWaalsContact O-CG2 3.26Å; E103-T107 WeakPolarHBondContact O-CG2 3.45Å; E103-T107 PolarHBondContact O-N 2.98Å; E103-T107 PolarHBondContact O-OG1 3.43Å; D104-T107 WeakPolarHBondContact CA-OG1 3.31Å; D104-T107 PolarHBondContact O-OG1 3.3Å; T107-W109 VanDerWaalsContact C-N 3.34Å; T107-W109 PolarHBondContact O-N 2.94Å; T107-R110 PolarHBondContact O-N 3.39Å; T107-Q111 WeakPolarHBondContact O-CG 3.39Å; T107-Q111 PolarHBondContact O-N 3.31Å
108	L	54.4	Low	53.7	Low	108 Å²	108	100.5 Å²	100.5	57%	0.565	50%	0.495	S	S	*	.	H	α-helix	trans	-61.2	-43.2	174.5	-167.2	71.4	0	0	0	111.4	D104 R110 Q111 V112	D104-L108 VanDerWaalsContact O-CB 3.31Å; D104-L108 WeakPolarHBondContact O-CB 3.22Å; D104-L108 PolarHBondContact O-N 2.91Å; L108-R110 PolarHBondContact O-N 2.93Å; L108-Q111 PolarHBondContact O-N 2.93Å; L108-V112 WeakPolarHBondContact O-CG2 3.49Å; L108-V112 PolarHBondContact O-N 2.97Å; L108-V112 VanDerWaalsContact O-N 3.08Å
109	W	54.6	Low	54.5	Low	114 Å²	114	101 Å²	101	43%	0.432	49%	0.494	S	S	.	.	H	α-helix	trans	-60.7	-44.9	175.7	-175.2	72	0	0	0	112.1	I105 F106 T107 Q111 V112 E113	I105-W109 VanDerWaalsContact O-CB 3.29Å; I105-W109 WeakPolarHBondContact O-CB 3.34Å; I105-W109 PolarHBondContact O-N 3.35Å; F106-W109 HydrophobicContact CE2-CE3 4.42Å; F106-W109 HydrophobicContact CZ-CZ3 4.44Å; F106-W109 PolarHBondContact O-N 3.41Å; T107-W109 VanDerWaalsContact C-N 3.34Å; T107-W109 PolarHBondContact O-N 2.94Å; W109-Q111 VanDerWaalsContact C-N 3.31Å; W109-Q111 PolarHBondContact O-N 3.28Å; W109-V112 PolarHBondContact O-N 3.4Å; W109-E113 WeakPolarHBondContact O-CB 3.46Å; W109-E113 PolarHBondContact O-N 3.42Å
110	R	53.6	Low	55	Low	167 Å²	167	99.9 Å²	99.9	63%	0.63	49%	0.493	S	S	*	.	H	α-helix	trans	-65.3	-33.4	178.6	-161.6	172.7	-179	-170.4	-0.5	112.3	F106 T107 L108 T114	F106-R110 WeakPolarHBondContact O-CB 3.46Å; F106-R110 PolarHBondContact O-N 3.18Å; T107-R110 PolarHBondContact O-N 3.39Å; L108-R110 PolarHBondContact O-N 2.93Å; R110-T114 VanDerWaalsContact O-CG2 3.28Å; R110-T114 WeakPolarHBondContact O-CG2 3.43Å; R110-T114 PolarHBondContact O-N 3.31Å; R110-T114 VanDerWaalsContact O-N 3.13Å; R110-T114 PolarHBondContact O-OG1 3.39Å
111	Q	53.7	Low	55	Low	118 Å²	118	104 Å²	104	55%	0.551	50%	0.502	S	S	*	.	H	α-helix	trans	-68	-43.6	173.6	-76.2	-168.3	-1.1	0	0	112.4	T107 L108 W109 T114 K115	T107-Q111 WeakPolarHBondContact O-CG 3.39Å; T107-Q111 PolarHBondContact O-N 3.31Å; L108-Q111 PolarHBondContact O-N 2.93Å; W109-Q111 VanDerWaalsContact C-N 3.31Å; W109-Q111 PolarHBondContact O-N 3.28Å; Q111-T114 PolarHBondContact O-N 3.14Å; Q111-T114 PolarHBondContact O-OG1 2.93Å; Q111-K115 WeakPolarHBondContact O-CG 3.46Å; Q111-K115 PolarHBondContact O-N 2.96Å; Q111-K115 VanDerWaalsContact O-N 3.13Å
112	V	53	Low	55.7	Low	59 Å²	59	107.4 Å²	107.4	36%	0.358	51%	0.51	S	S	.	.	H	α-helix	trans	-66.9	-43	177.9	174.9	0	0	0	0	110.5	L108 W109 T114 K115 V116	L108-V112 WeakPolarHBondContact O-CG2 3.49Å; L108-V112 PolarHBondContact O-N 2.97Å; L108-V112 VanDerWaalsContact O-N 3.08Å; W109-V112 PolarHBondContact O-N 3.4Å; V112-T114 VanDerWaalsContact C-N 3.29Å; V112-T114 PolarHBondContact O-N 3.37Å; V112-K115 PolarHBondContact O-N 3.29Å; V112-V116 HydrophobicContact CG1-CG2 4.28Å; V112-V116 WeakPolarHBondContact O-CG2 3.39Å; V112-V116 PolarHBondContact O-N 2.96Å
113	E	50.8	Low	56.1	Low	58 Å²	58	109.2 Å²	109.2	27%	0.271	52%	0.517	S	S	.	.	H	α-helix	trans	-63.6	-33.9	-179.9	-155.8	-167.4	169.3	0	0	112.4	W109 R117	W109-E113 WeakPolarHBondContact O-CB 3.46Å; W109-E113 PolarHBondContact O-N 3.42Å; E113-R117 VanDerWaalsContact O-CB 3.3Å; E113-R117 WeakPolarHBondContact O-CB 3.33Å; E113-R117 VanDerWaalsContact O-CG 3.31Å; E113-R117 WeakPolarHBondContact O-CG 3.17Å; E113-R117 PolarHBondContact O-N 2.96Å; E113-R117 PolarHBondContact O-NE 3.27Å; E113-R117 IonicContact OE1-CZ 3.37Å; E113-R117 IonicContact OE1-NE 3.3Å; E113-R117 IonicContact OE1-NH1 3.59Å; E113-R117 PolarHBondContact OE1-NH1 3.42Å; E113-R117 VanDerWaalsContact OE1-NH1 3.1Å; E113-R117 IonicContact OE1-NH2 2.91Å; E113-R117 PolarHBondContact OE1-NH2 3.01Å; E113-R117 IonicContact OE2-CZ 2.77Å; E113-R117 IonicContact OE2-NH2 3.68Å; E113-R117 PolarHBondContact OE2-NH2 3.4Å
114	T	57.8	Low	56.1	Low	75 Å²	75	111.8 Å²	111.8	46%	0.46	53%	0.527	S	S	.	.	H	α-helix	trans	-72.9	-40.6	175	51.4	0	0	0	0	112.1	R110 Q111 V112 R117 A118	R110-T114 VanDerWaalsContact O-CG2 3.28Å; R110-T114 WeakPolarHBondContact O-CG2 3.43Å; R110-T114 PolarHBondContact O-N 3.31Å; R110-T114 VanDerWaalsContact O-N 3.13Å; R110-T114 PolarHBondContact O-OG1 3.39Å; Q111-T114 PolarHBondContact O-N 3.14Å; Q111-T114 PolarHBondContact O-OG1 2.93Å; V112-T114 VanDerWaalsContact C-N 3.29Å; V112-T114 PolarHBondContact O-N 3.37Å; T114-R117 PolarHBondContact O-N 2.96Å; T114-A118 WeakPolarHBondContact O-CB 3.48Å; T114-A118 PolarHBondContact O-N 3.06Å
115	K	66.9	Low	55.9	Low	147 Å²	147	111.2 Å²	111.2	64%	0.639	53%	0.527	S	S	*	.	H	α-helix	trans	-61.2	-45.9	174.3	-76.2	-178.3	178.5	179.5	0	112.1	Q111 V112 A118 K119	Q111-K115 WeakPolarHBondContact O-CG 3.46Å; Q111-K115 PolarHBondContact O-N 2.96Å; Q111-K115 VanDerWaalsContact O-N 3.13Å; V112-K115 PolarHBondContact O-N 3.29Å; K115-A118 PolarHBondContact O-N 2.87Å; K115-K119 PolarHBondContact O-N 2.94Å
116	V	53	Low	55.6	Low	74 Å²	74	111 Å²	111	45%	0.448	53%	0.531	S	S	.	.	H	α-helix	trans	-64	-45.2	177	173	0	0	0	0	110.7	V112 A118 K119 I120	V112-V116 HydrophobicContact CG1-CG2 4.28Å; V112-V116 WeakPolarHBondContact O-CG2 3.39Å; V112-V116 PolarHBondContact O-N 2.96Å; V116-A118 VanDerWaalsContact C-N 3.32Å; V116-A118 PolarHBondContact O-N 3.49Å; V116-K119 PolarHBondContact O-N 3.34Å; V116-I120 HydrophobicContact CG1-CD1 3.86Å; V116-I120 HydrophobicContact CG1-CG1 4.49Å; V116-I120 VanDerWaalsContact O-CG1 3.32Å; V116-I120 WeakPolarHBondContact O-CG1 3.29Å; V116-I120 PolarHBondContact O-N 3.35Å
117	R	48.4	Very low	55.2	Low	113 Å²	113	110.4 Å²	110.4	43%	0.426	54%	0.537	S	S	.	.	H	α-helix	trans	-63.5	-35.9	176.3	-79.6	-170.5	-85	-146.9	1	113	E113 T114 I120 R121	E113-R117 VanDerWaalsContact O-CB 3.3Å; E113-R117 WeakPolarHBondContact O-CB 3.33Å; E113-R117 VanDerWaalsContact O-CG 3.31Å; E113-R117 WeakPolarHBondContact O-CG 3.17Å; E113-R117 PolarHBondContact O-N 2.96Å; E113-R117 PolarHBondContact O-NE 3.27Å; E113-R117 IonicContact OE1-CZ 3.37Å; E113-R117 IonicContact OE1-NE 3.3Å; E113-R117 IonicContact OE1-NH1 3.59Å; E113-R117 PolarHBondContact OE1-NH1 3.42Å; E113-R117 VanDerWaalsContact OE1-NH1 3.1Å; E113-R117 IonicContact OE1-NH2 2.91Å; E113-R117 PolarHBondContact OE1-NH2 3.01Å; E113-R117 IonicContact OE2-CZ 2.77Å; E113-R117 IonicContact OE2-NH2 3.68Å; E113-R117 PolarHBondContact OE2-NH2 3.4Å; T114-R117 PolarHBondContact O-N 2.96Å; R117-I120 PolarHBondContact O-N 2.8Å; R117-R121 WeakPolarHBondContact O-CB 2.96Å; R117-R121 WeakPolarHBondContact O-CG 3.35Å; R117-R121 PolarHBondContact O-N 3.23Å
118	A	60.8	Low	54.5	Low	47 Å²	47	115.6 Å²	115.6	39%	0.388	55%	0.553	S	S	.	*	H	α-helix	trans	-66.8	-43.8	174.9	0	0	0	0	0	111.7	T114 K115 V116 R121 K122	T114-A118 WeakPolarHBondContact O-CB 3.48Å; T114-A118 PolarHBondContact O-N 3.06Å; K115-A118 PolarHBondContact O-N 2.87Å; V116-A118 VanDerWaalsContact C-N 3.32Å; V116-A118 PolarHBondContact O-N 3.49Å; A118-R121 PolarHBondContact O-N 3.3Å; A118-K122 WeakPolarHBondContact O-CG 3.48Å; A118-K122 PolarHBondContact O-N 2.98Å
119	K	64.3	Low	54.1	Low	114 Å²	114	115.8 Å²	115.8	50%	0.496	56%	0.559	S	S	.	*	H	α-helix	trans	-57.6	-47.9	172.6	-82.5	-173.8	169.4	-172.8	0	111.1	K115 V116 R121 K122 M123 D173	K115-K119 PolarHBondContact O-N 2.94Å; V116-K119 PolarHBondContact O-N 3.34Å; K119-R121 PolarHBondContact O-N 2.97Å; K119-K122 PolarHBondContact O-N 3.43Å; K119-M123 WeakPolarHBondContact O-CB 3.31Å; K119-M123 PolarHBondContact O-N 3.49Å; K119-D173 IonicContact NZ-OD1 2.78Å; K119-D173 PolarHBondContact NZ-OD1 3.18Å; K119-D173 IonicContact NZ-OD2 3.04Å
120	I	56.8	Low	53.7	Low	103 Å²	103	117.2 Å²	117.2	53%	0.528	58%	0.575	S	S	.	*	H	α-helix	trans	-61.2	-43.5	178	-67.8	167.6	0	0	0	111.8	V116 R117 M123 K124	V116-I120 HydrophobicContact CG1-CD1 3.86Å; V116-I120 HydrophobicContact CG1-CG1 4.49Å; V116-I120 VanDerWaalsContact O-CG1 3.32Å; V116-I120 WeakPolarHBondContact O-CG1 3.29Å; V116-I120 PolarHBondContact O-N 3.35Å; R117-I120 PolarHBondContact O-N 2.8Å; I120-M123 PolarHBondContact O-N 2.96Å; I120-K124 WeakPolarHBondContact O-CB 3.32Å; I120-K124 PolarHBondContact O-N 2.98Å
121	R	56.7	Low	53.5	Low	186 Å²	186	120.6 Å²	120.6	70%	0.702	59%	0.588	S	S	*	*	H	α-helix	trans	-64.1	-43.2	177.6	-76.2	177.9	-177.2	-177.8	0.8	111.8	R117 A118 K119 K124 V125	R117-R121 WeakPolarHBondContact O-CB 2.96Å; R117-R121 WeakPolarHBondContact O-CG 3.35Å; R117-R121 PolarHBondContact O-N 3.23Å; A118-R121 PolarHBondContact O-N 3.3Å; K119-R121 PolarHBondContact O-N 2.97Å; R121-K124 PolarHBondContact O-N 3.02Å; R121-V125 VanDerWaalsContact O-CG2 3.27Å; R121-V125 WeakPolarHBondContact O-CG2 3.28Å; R121-V125 PolarHBondContact O-N 3.4Å
122	K	62	Low	53.5	Low	156 Å²	156	122.4 Å²	122.4	68%	0.678	60%	0.596	S	S	*	*	H	α-helix	trans	-59.9	-46.8	175.7	-74.6	-177.7	178.6	-172.9	0	111.3	A118 K119 K124 V125 T126	A118-K122 WeakPolarHBondContact O-CG 3.48Å; A118-K122 PolarHBondContact O-N 2.98Å; K119-K122 PolarHBondContact O-N 3.43Å; K122-K124 VanDerWaalsContact C-N 3.33Å; K122-K124 PolarHBondContact O-N 3.33Å; K122-V125 PolarHBondContact O-N 2.97Å; K122-T126 PolarHBondContact O-N 3.5Å; K122-T126 PolarHBondContact O-OG1 3.22Å
123	M	54.2	Low	53.4	Low	139 Å²	139	126.6 Å²	126.6	69%	0.685	62%	0.616	S	S	*	*	H	α-helix	trans	-63	-37.8	177.6	-164.2	147.5	122	0	0	112.6	K119 I120 T126 T127	K119-M123 WeakPolarHBondContact O-CB 3.31Å; K119-M123 PolarHBondContact O-N 3.49Å; I120-M123 PolarHBondContact O-N 2.96Å; M123-T126 WeakPolarHBondContact CA-OG1 3.36Å; M123-T126 PolarHBondContact O-OG1 3.49Å; M123-T127 WeakPolarHBondContact O-CB 3.34Å; M123-T127 PolarHBondContact O-N 3.23Å; M123-T127 VanDerWaalsContact O-N 3.1Å; M123-T127 PolarHBondContact O-OG1 3.31Å
124	K	53.2	Low	53.6	Low	158 Å²	158	132 Å²	132	69%	0.687	64%	0.638	S	S	*	*	H	α-helix	trans	-69	-34.6	175	-168.1	175	-176.2	177.6	0	112.8	I120 R121 K122 K128	I120-K124 WeakPolarHBondContact O-CB 3.32Å; I120-K124 PolarHBondContact O-N 2.98Å; R121-K124 PolarHBondContact O-N 3.02Å; K122-K124 VanDerWaalsContact C-N 3.33Å; K122-K124 PolarHBondContact O-N 3.33Å; K124-K128 PolarHBondContact O-N 3.02Å
125	V	50.1	Low	53.2	Low	94 Å²	94	136 Å²	136	57%	0.57	66%	0.655	S	S	*	*	H	α-helix	trans	-71.6	-44.5	177.4	169.8	0	0	0	0	110.8	R121 K122 T127 K128 V129	R121-V125 VanDerWaalsContact O-CG2 3.27Å; R121-V125 WeakPolarHBondContact O-CG2 3.28Å; R121-V125 PolarHBondContact O-N 3.4Å; K122-V125 PolarHBondContact O-N 2.97Å; V125-T127 VanDerWaalsContact C-N 3.31Å; V125-T127 PolarHBondContact O-N 3.13Å; V125-K128 PolarHBondContact O-N 3.32Å; V125-K128 VanDerWaalsContact O-N 3.1Å; V125-V129 WeakPolarHBondContact O-CG2 3.47Å
126	T	46.8	Very low	52.4	Low	98 Å²	98	136 Å²	136	60%	0.601	66%	0.663	S	S	*	*	H	α-helix	trans	-64.9	-35.8	177.3	52.4	0	0	0	0	112.1	K122 M123 K128 V129	K122-T126 PolarHBondContact O-N 3.5Å; K122-T126 PolarHBondContact O-OG1 3.22Å; M123-T126 WeakPolarHBondContact CA-OG1 3.36Å; M123-T126 PolarHBondContact O-OG1 3.49Å; T126-K128 PolarHBondContact O-N 3.27Å; T126-V129 PolarHBondContact O-N 2.93Å
127	T	46.1	Very low	52.3	Low	112 Å²	112	136 Å²	136	69%	0.687	68%	0.677	S	S	*	*	H	α-helix	trans	-64.6	-26.7	174.2	-52.5	0	0	0	0	112.8	M123 V125	M123-T127 WeakPolarHBondContact O-CB 3.34Å; M123-T127 PolarHBondContact O-N 3.23Å; M123-T127 VanDerWaalsContact O-N 3.1Å; M123-T127 PolarHBondContact O-OG1 3.31Å; V125-T127 VanDerWaalsContact C-N 3.31Å; V125-T127 PolarHBondContact O-N 3.13Å
128	K	46.9	Very low	52.3	Low	187 Å²	187	139.7 Å²	139.7	81%	0.813	70%	0.696	S	S	*	*	H	α-helix	trans	-85.3	-11.7	-176.2	-134.6	-174.7	-178.1	-168	0	114.1	K124 V125 T126	K124-K128 PolarHBondContact O-N 3.02Å; V125-K128 PolarHBondContact O-N 3.32Å; V125-K128 VanDerWaalsContact O-N 3.1Å; T126-K128 PolarHBondContact O-N 3.27Å
129	V	45.6	Very low	52	Low	112 Å²	112	149 Å²	149	68%	0.679	72%	0.722	S	S	*	*	S	Bend	trans	-88.6	-11.4	-169.3	168.9	0	0	0	0	114.2	V125 T126	V125-V129 WeakPolarHBondContact O-CG2 3.47Å; T126-V129 PolarHBondContact O-N 2.93Å
130	N	47.5	Very low	51.2	Low	145 Å²	145	150.6 Å²	150.6	78%	0.775	73%	0.728	S	S	*	*			trans	-115.9	57.4	-166.9	-134.1	3.6	0	0	0	115.5
131	R	49.5	Very low	51.4	Low	238 Å²	238	150 Å²	150	90%	0.898	73%	0.73	S	S	*	*			trans	-140.5	88.6	159.8	-76.2	-169.7	-175.4	168.2	1.4	109.8
132	H	52.8	Low	51.4	Low	156 Å²	156	145.1 Å²	145.1	72%	0.722	73%	0.729	S	S	*	*			trans	-136.7	62.5	162.8	-145.3	-21.2	0	0	0	111.4	K134	H132-K134 PolarHBondContact O-N 2.96Å; H132-K134 VanDerWaalsContact O-N 3.15Å
133	D	52.4	Low	51.4	Low	146 Å²	146	143.9 Å²	143.9	78%	0.781	73%	0.726	S	S	*	*			trans	-81.8	96.4	171.8	-58.3	-25.4	0	0	0	108.4	I135	D133-I135 PolarHBondContact O-N 3.4Å; D133-I135 VanDerWaalsContact O-N 3.09Å
134	K	53.5	Low	51.7	Low	171 Å²	171	139.9 Å²	139.9	74%	0.743	71%	0.706	S	S	*	*			trans	-69.8	99.6	165.1	-85.9	-178.5	176.7	176.8	0	108.2	H132 N136	H132-K134 PolarHBondContact O-N 2.96Å; H132-K134 VanDerWaalsContact O-N 3.15Å; K134-N136 VanDerWaalsContact C-N 3.34Å; K134-N136 PolarHBondContact O-N 3.32Å
135	I	49.1	Very low	52.2	Low	159 Å²	159	136.6 Å²	136.6	82%	0.815	69%	0.693	S	S	*	*			trans	-75.4	88	172.9	-56.8	174.8	0	0	0	108.2	D133	D133-I135 PolarHBondContact O-N 3.4Å; D133-I135 VanDerWaalsContact O-N 3.09Å
136	N	50.4	Low	52.9	Low	149 Å²	149	138 Å²	138	80%	0.797	70%	0.696	S	S	*	*			trans	-80.7	114.9	168	-91.1	-10.4	0	0	0	109.5	K134 K138	K134-N136 VanDerWaalsContact C-N 3.34Å; K134-N136 PolarHBondContact O-N 3.32Å; N136-K138 PolarHBondContact O-N 2.87Å
137	G	51	Low	53.7	Low	73 Å²	73	141.2 Å²	141.2	75%	0.753	70%	0.697	S	S	*	*			trans	-73	115.6	175.6	0	0	0	0	0	111.9
138	K	47.9	Very low	54.9	Low	190 Å²	190	140.1 Å²	140.1	83%	0.826	68%	0.683	S	S	*	*			trans	-140.3	148.8	158.5	-80.4	-168.8	176	178	0	110.8	N136	N136-K138 PolarHBondContact O-N 2.87Å
139	R	54.4	Low	55.8	Low	244 Å²	244	136.1 Å²	136.1	92%	0.921	67%	0.67	S	S	*	*			trans	-60.7	137.7	-169.4	-73	175.1	175.4	160.3	-2.4	112.5
140	K	48.3	Very low	56.8	Low	146 Å²	146	133.8 Å²	133.8	64%	0.635	66%	0.658	S	S	*	*			trans	-73.6	123.3	-173.2	-65.7	175.4	170.1	-171.7	0	112.8	E144	K140-E144 WeakPolarHBondContact CA-OE2 3.46Å
141	T	60.4	Low	57.8	Low	92 Å²	92	132.3 Å²	132.3	56%	0.564	65%	0.648	S	S	*	*			trans	-105.8	156.3	159.3	49.3	0	0	0	0	110.4	Q143 E144 H145	T141-Q143 PolarHBondContact O-N 3Å; T141-Q143 VanDerWaalsContact O-N 3.17Å; T141-E144 VanDerWaalsContact O-CB 3.25Å; T141-E144 WeakPolarHBondContact O-CB 3.16Å; T141-E144 PolarHBondContact O-N 3.39Å; T141-H145 PolarHBondContact O-N 2.86Å
142	A	57.8	Low	58.7	Low	83 Å²	83	128.1 Å²	128.1	69%	0.686	64%	0.637	S	S	*	*	H	α-helix	trans	-58.1	-30.1	-176.7	0	0	0	0	0	113.7	E144 H145 L146	A142-E144 VanDerWaalsContact C-N 3.3Å; A142-E144 PolarHBondContact O-N 3.08Å; A142-H145 PolarHBondContact O-N 2.86Å; A142-L146 PolarHBondContact O-N 3.26Å
143	Q	62.2	Low	59.3	Low	130 Å²	130	127.4 Å²	127.4	61%	0.607	63%	0.634	S	S	*	*	H	α-helix	trans	-67.1	-30	174.6	-165.2	-178.1	32.1	0	0	112.8	T141 R147	T141-Q143 PolarHBondContact O-N 3Å; T141-Q143 VanDerWaalsContact O-N 3.17Å; Q143-R147 PolarHBondContact O-N 3.49Å; Q143-R147 VanDerWaalsContact O-N 3.12Å
144	E	60.4	Low	59.9	Low	55 Å²	55	129.5 Å²	129.5	26%	0.257	63%	0.631	S	S	.	*	H	α-helix	trans	-73.2	-31	177.2	-156.9	-169.1	153.7	0	0	111.6	K140 T141 A142 K148	K140-E144 WeakPolarHBondContact CA-OE2 3.46Å; T141-E144 VanDerWaalsContact O-CB 3.25Å; T141-E144 WeakPolarHBondContact O-CB 3.16Å; T141-E144 PolarHBondContact O-N 3.39Å; A142-E144 VanDerWaalsContact C-N 3.3Å; A142-E144 PolarHBondContact O-N 3.08Å; E144-K148 WeakPolarHBondContact O-CB 3.47Å; E144-K148 VanDerWaalsContact O-CG 3.26Å; E144-K148 WeakPolarHBondContact O-CG 3.46Å; E144-K148 PolarHBondContact O-N 2.75Å; E144-K148 WeakPolarHBondContact OE1-CE 3.39Å; E144-K148 IonicContact OE1-NZ 3.75Å; E144-K148 PolarHBondContact OE1-NZ 2.85Å
145	H	63.1	Low	60.6	Low	89 Å²	89	125.8 Å²	125.8	41%	0.412	62%	0.616	S	S	.	*	H	α-helix	trans	-66.6	-42.2	174.1	-98.1	-89.8	0	0	0	112.1	T141 A142 K148 L149	T141-H145 PolarHBondContact O-N 2.86Å; A142-H145 PolarHBondContact O-N 2.86Å; H145-K148 PolarHBondContact O-N 3.41Å; H145-L149 PolarHBondContact O-N 2.83Å
146	L	63.8	Low	60.7	Low	124 Å²	124	123.5 Å²	123.5	65%	0.649	60%	0.601	S	S	*	*	H	α-helix	trans	-64.6	-43	174.2	-80.1	160.8	0	0	0	112	A142 K148 L149 S150	A142-L146 PolarHBondContact O-N 3.26Å; L146-K148 VanDerWaalsContact C-N 3.35Å; L146-K148 PolarHBondContact O-N 2.96Å; L146-L149 PolarHBondContact O-N 3.41Å; L146-S150 PolarHBondContact O-N 2.94Å
147	R	65.6	Low	61.5	Low	164 Å²	164	117.6 Å²	117.6	62%	0.619	58%	0.576	S	S	*	*	H	α-helix	trans	-65.1	-34.9	174.5	-75.3	-176.4	175.9	-175.7	-0.1	113.1	Q143 S150 M151	Q143-R147 PolarHBondContact O-N 3.49Å; Q143-R147 VanDerWaalsContact O-N 3.12Å; R147-S150 PolarHBondContact O-OG 2.99Å; R147-M151 WeakPolarHBondContact O-CB 3.31Å; R147-M151 WeakPolarHBondContact O-CG 3.49Å; R147-M151 PolarHBondContact O-N 2.83Å
148	K	69.8	Low	62.1	Low	90 Å²	90	119.2 Å²	119.2	39%	0.391	56%	0.564	S	S	.	*	H	α-helix	trans	-68.3	-36.5	174.8	-80.4	172.5	-177.1	166.1	0	112.3	E144 H145 L146 K152	E144-K148 WeakPolarHBondContact O-CB 3.47Å; E144-K148 VanDerWaalsContact O-CG 3.26Å; E144-K148 WeakPolarHBondContact O-CG 3.46Å; E144-K148 PolarHBondContact O-N 2.75Å; E144-K148 WeakPolarHBondContact OE1-CE 3.39Å; E144-K148 IonicContact OE1-NZ 3.75Å; E144-K148 PolarHBondContact OE1-NZ 2.85Å; H145-K148 PolarHBondContact O-N 3.41Å; L146-K148 VanDerWaalsContact C-N 3.35Å; L146-K148 PolarHBondContact O-N 2.96Å; K148-K152 WeakPolarHBondContact O-CB 3.29Å; K148-K152 WeakPolarHBondContact O-CG 3.48Å; K148-K152 PolarHBondContact O-N 3.44Å
149	L	67.2	Low	62.9	Low	102 Å²	102	115.7 Å²	115.7	53%	0.534	55%	0.549	S	S	.	.	H	α-helix	trans	-64.8	-49.3	173.5	-86	156.4	0	0	0	111	H145 L146 M151 K152 E153	H145-L149 PolarHBondContact O-N 2.83Å; L146-L149 PolarHBondContact O-N 3.41Å; L149-M151 VanDerWaalsContact C-N 3.31Å; L149-M151 PolarHBondContact O-N 3.4Å; L149-K152 PolarHBondContact O-N 3.49Å; L149-K152 VanDerWaalsContact O-N 3.14Å; L149-E153 PolarHBondContact O-N 3.35Å
150	S	64.8	Low	63.1	Low	63 Å²	63	109.4 Å²	109.4	44%	0.441	53%	0.53	S	S	.	.	H	α-helix	trans	-64.1	-35.2	179.7	70.8	0	0	0	0	113.1	L146 R147 R154	L146-S150 PolarHBondContact O-N 2.94Å; R147-S150 PolarHBondContact O-OG 2.99Å; S150-R154 PolarHBondContact O-N 3.39Å; S150-R154 VanDerWaalsContact O-N 3.14Å
151	M	69.1	Low	63.9	Low	115 Å²	115	111.4 Å²	111.4	57%	0.567	53%	0.533	S	S	*	.	H	α-helix	trans	-68.8	-38.7	174.8	-73.2	-69.4	-68	0	0	111.9	R147 L149 R154 E155	R147-M151 WeakPolarHBondContact O-CB 3.31Å; R147-M151 WeakPolarHBondContact O-CG 3.49Å; R147-M151 PolarHBondContact O-N 2.83Å; L149-M151 VanDerWaalsContact C-N 3.31Å; L149-M151 PolarHBondContact O-N 3.4Å; M151-R154 PolarHBondContact O-N 2.96Å; M151-E155 PolarHBondContact O-N 2.83Å
152	K	69.3	Low	63.7	Low	149 Å²	149	112.9 Å²	112.9	65%	0.648	53%	0.534	S	S	*	.	H	α-helix	trans	-67.1	-39.1	175.8	-83.5	-176.9	174.2	-171.9	0	112.8	K148 L149 R154 E155 H156	K148-K152 WeakPolarHBondContact O-CB 3.29Å; K148-K152 WeakPolarHBondContact O-CG 3.48Å; K148-K152 PolarHBondContact O-N 3.44Å; L149-K152 PolarHBondContact O-N 3.49Å; L149-K152 VanDerWaalsContact O-N 3.14Å; K152-R154 VanDerWaalsContact C-N 3.31Å; K152-E155 PolarHBondContact O-N 2.89Å; K152-H156 WeakPolarHBondContact O-CB 3.45Å; K152-H156 PolarHBondContact O-N 2.9Å
153	E	65.6	Low	63.5	Low	142 Å²	142	113.6 Å²	113.6	66%	0.664	53%	0.529	S	S	*	.	H	α-helix	trans	-64.3	-39.1	174.7	-73.1	179.5	156.6	0	0	111.2	L149 H156 G157	L149-E153 PolarHBondContact O-N 3.35Å; E153-H156 PolarHBondContact O-N 3.1Å; E153-G157 PolarHBondContact O-N 3.17Å
154	R	64.1	Low	63.4	Low	189 Å²	189	110.8 Å²	110.8	71%	0.713	52%	0.524	S	S	*	.	H	α-helix	trans	-65	-45.6	174.2	-120.8	-176.9	166.8	105.2	-1.6	112.7	S150 M151 K152 H156 G157 E158	S150-R154 PolarHBondContact O-N 3.39Å; S150-R154 VanDerWaalsContact O-N 3.14Å; M151-R154 PolarHBondContact O-N 2.96Å; K152-R154 VanDerWaalsContact C-N 3.31Å; R154-H156 VanDerWaalsContact C-N 3.32Å; R154-H156 PolarHBondContact O-N 3.44Å; R154-G157 PolarHBondContact O-N 3.38Å; R154-E158 PolarHBondContact O-N 3.36Å
155	E	67.4	Low	63.4	Low	93 Å²	93	114.5 Å²	114.5	44%	0.435	54%	0.541	S	S	.	.	H	α-helix	trans	-64	-36.8	175.9	-82.6	-173.7	-164.4	0	0	112.7	M151 K152 K159	M151-E155 PolarHBondContact O-N 2.83Å; K152-E155 PolarHBondContact O-N 2.89Å; E155-K159 WeakPolarHBondContact O-CB 3.34Å; E155-K159 WeakPolarHBondContact O-CD 3.25Å; E155-K159 VanDerWaalsContact O-CG 3.23Å; E155-K159 WeakPolarHBondContact O-CG 3.49Å; E155-K159 PolarHBondContact O-N 3.34Å; E155-K159 IonicContact OE2-NZ 3.7Å; E155-K159 PolarHBondContact OE2-NZ 2.78Å
156	H	52.4	Low	62.9	Low	111 Å²	111	113.2 Å²	113.2	51%	0.514	55%	0.546	S	S	.	.	H	α-helix	trans	-64.4	-46.8	176.4	-170.3	-85.2	0	0	0	110.7	K152 E153 R154 E158 K159 E160	K152-H156 WeakPolarHBondContact O-CB 3.45Å; K152-H156 PolarHBondContact O-N 2.9Å; E153-H156 PolarHBondContact O-N 3.1Å; R154-H156 VanDerWaalsContact C-N 3.32Å; R154-H156 PolarHBondContact O-N 3.44Å; H156-E158 VanDerWaalsContact C-N 3.35Å; H156-E158 PolarHBondContact O-N 2.91Å; H156-K159 PolarHBondContact O-N 2.93Å; H156-E160 VanDerWaalsContact CE1-CD 3.41Å; H156-E160 IonicContact CE1-OE1 2.96Å; H156-E160 PolarHBondContact CE1-OE1 3.01Å; H156-E160 VanDerWaalsContact CE1-OE1 3.29Å; H156-E160 IonicContact CE1-OE2 3.29Å; H156-E160 IonicContact ND1-OE1 2.83Å; H156-E160 IonicContact ND1-OE2 3.92Å; H156-E160 PolarHBondContact O-N 3Å
157	G	67.8	Low	62.6	Low	25 Å²	25	112.7 Å²	112.7	26%	0.258	54%	0.54	S	S	.	.	H	α-helix	trans	-63.4	-36.8	177.1	0	0	0	0	0	113.5	E153 R154 R161	E153-G157 PolarHBondContact O-N 3.17Å; R154-G157 PolarHBondContact O-N 3.38Å; G157-R161 WeakPolarHBondContact O-CG 3.26Å; G157-R161 PolarHBondContact O-N 2.93Å; G157-R161 VanDerWaalsContact O-N 3.08Å
158	E	63.5	Low	62.1	Low	107 Å²	107	111 Å²	111	50%	0.5	54%	0.539	S	S	.	.	H	α-helix	trans	-69.7	-37.7	174.4	-79	179.9	176.5	0	0	112.6	R154 H156 R161 Q162	R154-E158 PolarHBondContact O-N 3.36Å; H156-E158 VanDerWaalsContact C-N 3.35Å; H156-E158 PolarHBondContact O-N 2.91Å; E158-R161 PolarHBondContact O-N 3.26Å; E158-Q162 WeakPolarHBondContact O-CG 3.3Å; E158-Q162 PolarHBondContact O-N 3.08Å
159	K	63.9	Low	61.4	Low	117 Å²	117	111.3 Å²	111.3	51%	0.509	55%	0.546	S	S	.	.	H	α-helix	trans	-65.6	-41.9	174.7	-74.4	165.5	-174.2	157.1	0	111.5	E155 H156 Q162 V163	E155-K159 WeakPolarHBondContact O-CB 3.34Å; E155-K159 WeakPolarHBondContact O-CD 3.25Å; E155-K159 VanDerWaalsContact O-CG 3.23Å; E155-K159 WeakPolarHBondContact O-CG 3.49Å; E155-K159 PolarHBondContact O-N 3.34Å; E155-K159 IonicContact OE2-NZ 3.7Å; E155-K159 PolarHBondContact OE2-NZ 2.78Å; H156-K159 PolarHBondContact O-N 2.93Å; K159-Q162 PolarHBondContact O-N 3.4Å; K159-V163 WeakPolarHBondContact O-CB 3.35Å; K159-V163 VanDerWaalsContact O-CG2 3.25Å; K159-V163 WeakPolarHBondContact O-CG2 3.4Å; K159-V163 PolarHBondContact O-N 2.99Å
160	E	57.8	Low	60.8	Low	112 Å²	112	108.4 Å²	108.4	52%	0.523	54%	0.54	S	S	.	.	H	α-helix	trans	-64.5	-38.7	175.6	-77	-173.1	144	0	0	112.8	H156 V163 S164	H156-E160 VanDerWaalsContact CE1-CD 3.41Å; H156-E160 IonicContact CE1-OE1 2.96Å; H156-E160 PolarHBondContact CE1-OE1 3.01Å; H156-E160 VanDerWaalsContact CE1-OE1 3.29Å; H156-E160 IonicContact CE1-OE2 3.29Å; H156-E160 IonicContact ND1-OE1 2.83Å; H156-E160 IonicContact ND1-OE2 3.92Å; H156-E160 PolarHBondContact O-N 3Å; E160-V163 PolarHBondContact O-N 3.24Å; E160-S164 WeakPolarHBondContact O-CB 3.39Å; E160-S164 PolarHBondContact O-N 2.96Å; E160-S164 PolarHBondContact O-OG 2.9Å
161	R	66	Low	60.2	Low	188 Å²	188	111.2 Å²	111.2	71%	0.709	55%	0.545	S	S	*	.	H	α-helix	trans	-63.7	-44	173.3	-74.8	178.6	-170.5	173.6	2.6	112.2	G157 E158 S164 E165	G157-R161 WeakPolarHBondContact O-CG 3.26Å; G157-R161 PolarHBondContact O-N 2.93Å; G157-R161 VanDerWaalsContact O-N 3.08Å; E158-R161 PolarHBondContact O-N 3.26Å; R161-S164 PolarHBondContact O-N 3.27Å; R161-E165 PolarHBondContact O-N 3.46Å
162	Q	57.3	Low	59.4	Low	123 Å²	123	110.8 Å²	110.8	58%	0.575	54%	0.544	S	S	*	.	H	α-helix	trans	-66.2	-36.9	177.4	-72.8	179.3	33.6	0	0	112.6	E158 K159 S164 A166	E158-Q162 WeakPolarHBondContact O-CG 3.3Å; E158-Q162 PolarHBondContact O-N 3.08Å; K159-Q162 PolarHBondContact O-N 3.4Å; Q162-S164 VanDerWaalsContact C-N 3.35Å; Q162-A166 WeakPolarHBondContact O-CB 3.36Å; Q162-A166 PolarHBondContact O-N 3.29Å
163	V	51.9	Low	58.6	Low	97 Å²	97	107 Å²	107	59%	0.588	53%	0.53	S	S	*	.	H	α-helix	trans	-65.9	-40.4	174	170.8	0	0	0	0	110.7	K159 E160 A166 E167	K159-V163 WeakPolarHBondContact O-CB 3.35Å; K159-V163 VanDerWaalsContact O-CG2 3.25Å; K159-V163 WeakPolarHBondContact O-CG2 3.4Å; K159-V163 PolarHBondContact O-N 2.99Å; E160-V163 PolarHBondContact O-N 3.24Å; V163-A166 PolarHBondContact O-N 3.48Å; V163-E167 PolarHBondContact O-N 3.03Å
164	S	59.7	Low	57.9	Low	71 Å²	71	106.4 Å²	106.4	50%	0.497	53%	0.53	S	S	.	.	H	α-helix	trans	-65	-45	178.2	-57.7	0	0	0	0	112.1	E160 R161 Q162 A166 E167 E168	E160-S164 WeakPolarHBondContact O-CB 3.39Å; E160-S164 PolarHBondContact O-N 2.96Å; E160-S164 PolarHBondContact O-OG 2.9Å; R161-S164 PolarHBondContact O-N 3.27Å; Q162-S164 VanDerWaalsContact C-N 3.35Å; S164-A166 VanDerWaalsContact C-N 3.34Å; S164-A166 PolarHBondContact O-N 2.96Å; S164-E167 PolarHBondContact O-N 3.47Å; S164-E168 PolarHBondContact O-N 2.91Å
165	E	60.8	Low	57.8	Low	134 Å²	134	104.9 Å²	104.9	63%	0.626	53%	0.528	S	S	*	.	H	α-helix	trans	-62.7	-39.2	173.5	-86.1	-177.1	160.5	0	0	112.2	R161 E167 E168 N169	R161-E165 PolarHBondContact O-N 3.46Å; E165-E167 VanDerWaalsContact C-N 3.33Å; E165-E167 PolarHBondContact O-N 3.13Å; E165-E168 PolarHBondContact O-N 3.12Å; E165-N169 VanDerWaalsContact O-CB 3.29Å; E165-N169 WeakPolarHBondContact O-CB 3.45Å; E165-N169 PolarHBondContact O-N 3.48Å; E165-N169 PolarHBondContact O-ND2 2.88Å
166	A	53.7	Low	57.3	Low	62 Å²	62	104.7 Å²	104.7	51%	0.512	53%	0.527	S	S	.	.	H	α-helix	trans	-66.9	-34.3	176.9	0	0	0	0	0	112.4	Q162 V163 S164 G170	Q162-A166 WeakPolarHBondContact O-CB 3.36Å; Q162-A166 PolarHBondContact O-N 3.29Å; V163-A166 PolarHBondContact O-N 3.48Å; S164-A166 VanDerWaalsContact C-N 3.34Å; S164-A166 PolarHBondContact O-N 2.96Å; A166-G170 PolarHBondContact O-N 2.73Å
167	E	56.7	Low	57.6	Low	113 Å²	113	104.3 Å²	104.3	53%	0.528	53%	0.528	S	S	.	.	H	α-helix	trans	-69.3	-42.9	175.9	-164.3	-166.7	140.6	0	0	111.9	V163 S164 E165 G170 K171	V163-E167 PolarHBondContact O-N 3.03Å; S164-E167 PolarHBondContact O-N 3.47Å; E165-E167 VanDerWaalsContact C-N 3.33Å; E165-E167 PolarHBondContact O-N 3.13Å; E167-G170 PolarHBondContact O-N 3.42Å; E167-K171 PolarHBondContact O-N 2.97Å; E167-K171 IonicContact OE1-NZ 3.57Å; E167-K171 PolarHBondContact OE1-NZ 2.87Å
168	E	55.9	Low	57	Low	127 Å²	127	108.6 Å²	108.6	59%	0.593	54%	0.541	S	S	*	.	H	α-helix	trans	-63.7	-46.1	176.5	-126.9	-97.6	139.5	0	0	110.9	S164 E165 G170 K171 L172	S164-E168 PolarHBondContact O-N 2.91Å; E165-E168 PolarHBondContact O-N 3.12Å; E168-G170 VanDerWaalsContact C-N 3.33Å; E168-G170 PolarHBondContact O-N 2.84Å; E168-K171 WeakPolarHBondContact O-CB 3.31Å; E168-K171 PolarHBondContact O-N 3.4Å; E168-L172 PolarHBondContact O-N 3.49Å
169	N	54.7	Low	57.1	Low	98 Å²	98	107.1 Å²	107.1	52%	0.524	54%	0.539	S	S	.	.	H	α-helix	trans	-62.4	-38.1	174.1	-74.2	-46.7	0	0	0	112.3	E165 L172 D173	E165-N169 VanDerWaalsContact O-CB 3.29Å; E165-N169 WeakPolarHBondContact O-CB 3.45Å; E165-N169 PolarHBondContact O-N 3.48Å; E165-N169 PolarHBondContact O-ND2 2.88Å; N169-L172 PolarHBondContact O-N 2.96Å; N169-D173 PolarHBondContact O-N 3.5Å
170	G	54	Low	56.5	Low	41 Å²	41	107.3 Å²	107.3	42%	0.423	54%	0.538	S	S	.	.	H	α-helix	trans	-64.7	-38.1	174.8	0	0	0	0	0	113.2	A166 E167 E168 L172 M174	A166-G170 PolarHBondContact O-N 2.73Å; E167-G170 PolarHBondContact O-N 3.42Å; E168-G170 VanDerWaalsContact C-N 3.33Å; E168-G170 PolarHBondContact O-N 2.84Å; G170-L172 VanDerWaalsContact C-N 3.34Å; G170-M174 WeakPolarHBondContact O-CB 3.39Å; G170-M174 PolarHBondContact O-N 3.22Å
171	K	51.8	Low	56.5	Low	122 Å²	122	106.3 Å²	106.3	53%	0.53	53%	0.534	S	S	.	.	H	α-helix	trans	-65	-38	173.1	-82.1	171.4	178.9	150	0	111.9	E167 E168 M174 K175	E167-K171 PolarHBondContact O-N 2.97Å; E167-K171 IonicContact OE1-NZ 3.57Å; E167-K171 PolarHBondContact OE1-NZ 2.87Å; E168-K171 WeakPolarHBondContact O-CB 3.31Å; E168-K171 PolarHBondContact O-N 3.4Å; K171-M174 PolarHBondContact O-N 2.82Å; K171-K175 PolarHBondContact O-N 2.85Å; K171-K175 VanDerWaalsContact O-N 3.11Å
172	L	54.2	Low	56.2	Low	106 Å²	106	101.1 Å²	101.1	56%	0.555	52%	0.518	S	S	*	.	H	α-helix	trans	-71	-44.7	-179.5	-149.7	136.5	0	0	0	111.7	E168 N169 G170 M174 K175 E176	E168-L172 PolarHBondContact O-N 3.49Å; N169-L172 PolarHBondContact O-N 2.96Å; G170-L172 VanDerWaalsContact C-N 3.34Å; L172-M174 VanDerWaalsContact C-N 3.29Å; L172-M174 PolarHBondContact O-N 3.4Å; L172-K175 PolarHBondContact O-N 3.47Å; L172-E176 PolarHBondContact O-N 2.84Å; L172-E176 VanDerWaalsContact O-N 3.1Å
173	D	52.3	Low	56.2	Low	68 Å²	68	100.5 Å²	100.5	36%	0.364	52%	0.516	S	S	.	.	H	α-helix	trans	-62.3	-35.4	173	-93.8	3.7	0	0	0	111.2	K119 N169 E176 I177	K119-D173 IonicContact NZ-OD1 2.78Å; K119-D173 PolarHBondContact NZ-OD1 3.18Å; K119-D173 IonicContact NZ-OD2 3.04Å; N169-D173 PolarHBondContact O-N 3.5Å; D173-E176 PolarHBondContact O-N 3.04Å; D173-I177 VanDerWaalsContact O-CG1 3.28Å; D173-I177 WeakPolarHBondContact O-CG1 3.44Å; D173-I177 PolarHBondContact O-N 3.11Å
174	M	50.5	Low	56.5	Low	131 Å²	131	101.5 Å²	101.5	65%	0.645	51%	0.513	S	S	*	.	H	α-helix	trans	-68.5	-38	177.2	-163.6	70.2	95.7	0	0	112.8	G170 K171 L172 E176 I177 H178	G170-M174 WeakPolarHBondContact O-CB 3.39Å; G170-M174 PolarHBondContact O-N 3.22Å; K171-M174 PolarHBondContact O-N 2.82Å; L172-M174 VanDerWaalsContact C-N 3.29Å; L172-M174 PolarHBondContact O-N 3.4Å; M174-E176 VanDerWaalsContact C-N 3.34Å; M174-I177 PolarHBondContact O-N 3.34Å; M174-H178 WeakPolarHBondContact O-CB 3.23Å; M174-H178 PolarHBondContact O-N 3.36Å
175	K	62.2	Low	56.3	Low	157 Å²	157	103.6 Å²	103.6	68%	0.683	52%	0.515	S	S	*	.	H	α-helix	trans	-63.9	-39.6	172.6	-77.1	179.2	178.5	177.1	0	111.6	K171 L172 H178 T179	K171-K175 PolarHBondContact O-N 2.85Å; K171-K175 VanDerWaalsContact O-N 3.11Å; L172-K175 PolarHBondContact O-N 3.47Å; K175-H178 PolarHBondContact O-N 2.98Å; K175-T179 PolarHBondContact O-N 2.97Å; K175-T179 PolarHBondContact O-OG1 3.05Å
176	E	57.3	Low	56.1	Low	89 Å²	89	105 Å²	105	42%	0.416	52%	0.515	S	S	.	.	H	α-helix	trans	-63.6	-46.9	176.1	-162.7	179.6	175.1	0	0	110.6	L172 D173 M174 H178 T179 Y180	L172-E176 PolarHBondContact O-N 2.84Å; L172-E176 VanDerWaalsContact O-N 3.1Å; D173-E176 PolarHBondContact O-N 3.04Å; M174-E176 VanDerWaalsContact C-N 3.34Å; E176-H178 PolarHBondContact O-N 3.08Å; E176-T179 WeakPolarHBondContact O-CB 3.36Å; E176-T179 PolarHBondContact O-N 2.96Å; E176-Y180 HydrophobicContact CG-CD2 4.09Å; E176-Y180 HydrophobicContact CG-CE2 3.86Å; E176-Y180 VanDerWaalsContact O-CD2 3.26Å; E176-Y180 WeakPolarHBondContact O-CD2 3.32Å; E176-Y180 PolarHBondContact O-N 3.4Å
177	I	58.3	Low	56.3	Low	102 Å²	102	104.8 Å²	104.8	52%	0.523	51%	0.513	S	S	.	.	H	α-helix	trans	-60.3	-41.7	176.1	-68.6	165.8	0	0	0	112	D173 M174 T179 Y180 M181	D173-I177 VanDerWaalsContact O-CG1 3.28Å; D173-I177 WeakPolarHBondContact O-CG1 3.44Å; D173-I177 PolarHBondContact O-N 3.11Å; M174-I177 PolarHBondContact O-N 3.34Å; I177-T179 VanDerWaalsContact C-N 3.33Å; I177-T179 PolarHBondContact O-N 2.91Å; I177-Y180 PolarHBondContact O-N 3.15Å; I177-M181 PolarHBondContact O-N 3.29Å
178	H	54.1	Low	56.2	Low	115 Å²	115	103.4 Å²	103.4	53%	0.532	51%	0.506	S	S	.	.	H	α-helix	trans	-60.7	-43.9	176.1	-176.7	-84.2	0	0	0	111.6	M174 K175 E176 Y180 M181 E182	M174-H178 WeakPolarHBondContact O-CB 3.23Å; M174-H178 PolarHBondContact O-N 3.36Å; K175-H178 PolarHBondContact O-N 2.98Å; E176-H178 PolarHBondContact O-N 3.08Å; H178-Y180 VanDerWaalsContact C-N 3.34Å; H178-Y180 PolarHBondContact O-N 2.87Å; H178-M181 WeakPolarHBondContact O-CB 3.41Å; H178-M181 PolarHBondContact O-N 3.29Å; H178-E182 IonicContact CE1-OE1 2.68Å; H178-E182 PolarHBondContact CE1-OE1 3.41Å; H178-E182 PolarHBondContact O-N 2.89Å
179	T	65	Low	56.4	Low	76 Å²	76	99.6 Å²	99.6	47%	0.466	50%	0.496	S	S	.	.	H	α-helix	trans	-62.8	-41.7	178.5	-51.8	0	0	0	0	111.4	K175 E176 I177 E182 M183	K175-T179 PolarHBondContact O-N 2.97Å; K175-T179 PolarHBondContact O-OG1 3.05Å; E176-T179 WeakPolarHBondContact O-CB 3.36Å; E176-T179 PolarHBondContact O-N 2.96Å; I177-T179 VanDerWaalsContact C-N 3.33Å; I177-T179 PolarHBondContact O-N 2.91Å; T179-E182 PolarHBondContact O-N 2.86Å; T179-M183 PolarHBondContact O-N 3.2Å; T179-M183 VanDerWaalsContact O-N 3.14Å
180	Y	53.1	Low	56.6	Low	121 Å²	121	100.3 Å²	100.3	48%	0.475	50%	0.499	S	S	.	.	H	α-helix	trans	-64.7	-39.2	173.5	-85.2	-73.9	0	0	0	112.9	E176 I177 H178 M183 F184	E176-Y180 HydrophobicContact CG-CD2 4.09Å; E176-Y180 HydrophobicContact CG-CE2 3.86Å; E176-Y180 VanDerWaalsContact O-CD2 3.26Å; E176-Y180 WeakPolarHBondContact O-CD2 3.32Å; E176-Y180 PolarHBondContact O-N 3.4Å; I177-Y180 PolarHBondContact O-N 3.15Å; H178-Y180 VanDerWaalsContact C-N 3.34Å; H178-Y180 PolarHBondContact O-N 2.87Å; Y180-M183 HydrophobicContact CD1-CE 4.42Å; Y180-M183 HydrophobicContact CE1-CE 4.46Å; Y180-M183 PolarHBondContact O-N 3.38Å; Y180-F184 WeakPolarHBondContact O-CB 3.48Å; Y180-F184 PolarHBondContact O-N 3.5Å
181	M	56.1	Low	56.8	Low	91 Å²	91	104.9 Å²	104.9	45%	0.448	50%	0.504	S	S	.	.	H	α-helix	trans	-61.9	-40.4	175.5	-94.6	-63.5	-57.1	0	0	112.4	I177 H178 F184 Q185	I177-M181 PolarHBondContact O-N 3.29Å; H178-M181 WeakPolarHBondContact O-CB 3.41Å; H178-M181 PolarHBondContact O-N 3.29Å; M181-F184 PolarHBondContact O-N 2.98Å; M181-Q185 HydrophobicContact CE-CG 4.36Å; M181-Q185 WeakPolarHBondContact O-CG 3.45Å; M181-Q185 PolarHBondContact O-N 3.25Å
182	E	60.7	Low	57	Low	79 Å²	79	106.7 Å²	106.7	37%	0.369	51%	0.507	S	S	.	.	H	α-helix	trans	-64.2	-43.8	174.1	-76.7	-163.2	171.9	0	0	112.3	H178 T179 F184 Q185 R186	H178-E182 IonicContact CE1-OE1 2.68Å; H178-E182 PolarHBondContact CE1-OE1 3.41Å; H178-E182 PolarHBondContact O-N 2.89Å; T179-E182 PolarHBondContact O-N 2.86Å; E182-F184 VanDerWaalsContact C-N 3.28Å; E182-F184 PolarHBondContact O-N 2.81Å; E182-Q185 PolarHBondContact O-N 3.05Å; E182-R186 WeakPolarHBondContact O-CG 3.12Å; E182-R186 PolarHBondContact O-N 2.86Å; E182-R186 IonicContact OE2-NH2 3.18Å
183	M	58	Low	57.4	Low	111 Å²	111	110.3 Å²	110.3	55%	0.547	51%	0.514	S	S	.	.	H	α-helix	trans	-61.6	-39.2	176.5	-70.9	-147.3	-87.6	0	0	111.6	T179 Y180 R186 A187	T179-M183 PolarHBondContact O-N 3.2Å; T179-M183 VanDerWaalsContact O-N 3.14Å; Y180-M183 HydrophobicContact CD1-CE 4.42Å; Y180-M183 HydrophobicContact CE1-CE 4.46Å; Y180-M183 PolarHBondContact O-N 3.38Å; M183-R186 PolarHBondContact O-N 3.05Å; M183-A187 WeakPolarHBondContact O-CB 3.41Å; M183-A187 PolarHBondContact O-N 3.45Å
184	F	57.7	Low	57.5	Low	118 Å²	118	109.2 Å²	109.2	52%	0.518	51%	0.514	S	S	.	.	H	α-helix	trans	-64.9	-43.3	175.7	-177.3	-110.3	0	0	0	112.6	Y180 M181 E182 A187 Q188	Y180-F184 WeakPolarHBondContact O-CB 3.48Å; Y180-F184 PolarHBondContact O-N 3.5Å; M181-F184 PolarHBondContact O-N 2.98Å; E182-F184 VanDerWaalsContact C-N 3.28Å; E182-F184 PolarHBondContact O-N 2.81Å; F184-A187 PolarHBondContact O-N 3.3Å; F184-Q188 HydrophobicContact CE1-CG 4.44Å; F184-Q188 HydrophobicContact CZ-CG 4.45Å; F184-Q188 PolarHBondContact O-N 3.47Å
185	Q	56.1	Low	57.7	Low	114 Å²	114	107.1 Å²	107.1	53%	0.533	50%	0.503	S	S	.	.	H	α-helix	trans	-63.5	-40.5	175.4	-73.9	179	-0.5	0	0	112	M181 E182 Q188 A189	M181-Q185 HydrophobicContact CE-CG 4.36Å; M181-Q185 WeakPolarHBondContact O-CG 3.45Å; M181-Q185 PolarHBondContact O-N 3.25Å; E182-Q185 PolarHBondContact O-N 3.05Å; Q185-Q188 PolarHBondContact O-N 3.02Å; Q185-A189 PolarHBondContact O-N 3.2Å
186	R	55.6	Low	57.6	Low	165 Å²	165	104 Å²	104	62%	0.623	49%	0.493	S	S	*	.	H	α-helix	trans	-62.8	-42.5	174.9	-72.3	177.9	-171	-179.6	7.5	111.9	E182 M183 A189 L190	E182-R186 WeakPolarHBondContact O-CG 3.12Å; E182-R186 PolarHBondContact O-N 2.86Å; E182-R186 IonicContact OE2-NH2 3.18Å; M183-R186 PolarHBondContact O-N 3.05Å; R186-A189 PolarHBondContact O-N 3.5Å; R186-L190 WeakPolarHBondContact O-CG 3.48Å; R186-L190 PolarHBondContact O-N 2.96Å
187	A	57.8	Low	57.5	Low	57 Å²	57	106.3 Å²	106.3	47%	0.471	50%	0.499	S	S	.	.	H	α-helix	trans	-62.9	-41.3	175.5	0	0	0	0	0	112	M183 F184 A189 L190 R191	M183-A187 WeakPolarHBondContact O-CB 3.41Å; M183-A187 PolarHBondContact O-N 3.45Å; F184-A187 PolarHBondContact O-N 3.3Å; A187-A189 PolarHBondContact O-N 3.18Å; A187-L190 PolarHBondContact O-N 2.88Å; A187-R191 PolarHBondContact O-N 2.88Å
188	Q	54.6	Low	57.1	Low	84 Å²	84	107.1 Å²	107.1	39%	0.393	50%	0.497	S	S	.	.	H	α-helix	trans	-63.7	-38.7	173.4	-74.7	-167.4	9.1	0	0	112.8	F184 Q185 R191 R192	F184-Q188 HydrophobicContact CE1-CG 4.44Å; F184-Q188 HydrophobicContact CZ-CG 4.45Å; F184-Q188 PolarHBondContact O-N 3.47Å; Q185-Q188 PolarHBondContact O-N 3.02Å; Q188-R191 WeakPolarHBondContact O-CB 3.48Å; Q188-R191 PolarHBondContact O-N 3.47Å; Q188-R192 PolarHBondContact O-N 3.23Å
189	A	59.9	Low	57.1	Low	46 Å²	46	110 Å²	110	38%	0.38	50%	0.503	S	S	.	.	H	α-helix	trans	-65.6	-40.7	177.1	0	0	0	0	0	112	Q185 R186 A187 R191 R192 R193	Q185-A189 PolarHBondContact O-N 3.2Å; R186-A189 PolarHBondContact O-N 3.5Å; A187-A189 PolarHBondContact O-N 3.18Å; A189-R191 VanDerWaalsContact C-N 3.33Å; A189-R191 PolarHBondContact O-N 3.11Å; A189-R192 PolarHBondContact O-N 3.26Å; A189-R193 WeakPolarHBondContact O-CG 3.48Å; A189-R193 PolarHBondContact O-N 3.49Å
190	L	58.6	Low	56.5	Low	113 Å²	113	111.4 Å²	111.4	59%	0.592	52%	0.515	S	S	*	.	H	α-helix	trans	-61.8	-41.8	173.3	-74.2	170.4	0	0	0	111.6	R186 A187 R193 A194	R186-L190 WeakPolarHBondContact O-CG 3.48Å; R186-L190 PolarHBondContact O-N 2.96Å; A187-L190 PolarHBondContact O-N 2.88Å; L190-R193 PolarHBondContact O-N 3.39Å; L190-A194 PolarHBondContact O-N 3.4Å
191	R	59.3	Low	56.4	Low	137 Å²	137	112.6 Å²	112.6	52%	0.517	52%	0.522	S	S	.	.	H	α-helix	trans	-60	-46.6	174.2	-176.4	-176.9	163.9	-164.8	-5	111.9	A187 Q188 A189 R193 A194 E195	A187-R191 PolarHBondContact O-N 2.88Å; Q188-R191 WeakPolarHBondContact O-CB 3.48Å; Q188-R191 PolarHBondContact O-N 3.47Å; A189-R191 VanDerWaalsContact C-N 3.33Å; A189-R191 PolarHBondContact O-N 3.11Å; R191-R193 PolarHBondContact O-N 3.2Å; R191-A194 PolarHBondContact O-N 3Å; R191-E195 IonicContact CZ-OE1 2.9Å; R191-E195 VanDerWaalsContact CZ-OE1 3.3Å; R191-E195 IonicContact NE-OE1 3.82Å; R191-E195 PolarHBondContact NE-OE1 3.28Å; R191-E195 IonicContact NH2-OE1 3.1Å; R191-E195 PolarHBondContact NH2-OE1 2.91Å; R191-E195 WeakPolarHBondContact O-CG 3.12Å; R191-E195 PolarHBondContact O-N 3.04Å
192	R	56.3	Low	55.9	Low	161 Å²	161	112.7 Å²	112.7	61%	0.608	52%	0.524	S	S	*	.	H	α-helix	trans	-61	-43.6	176.8	-72.3	-176.6	-174.8	173.8	3.5	112	Q188 A189 A194 E195 D196	Q188-R192 PolarHBondContact O-N 3.23Å; A189-R192 PolarHBondContact O-N 3.26Å; R192-A194 VanDerWaalsContact C-N 3.31Å; R192-A194 PolarHBondContact O-N 3.08Å; R192-E195 PolarHBondContact O-N 2.99Å; R192-D196 WeakPolarHBondContact O-CB 3.02Å; R192-D196 VanDerWaalsContact O-CG 3.3Å; R192-D196 PolarHBondContact O-N 3.17Å
193	R	61.3	Low	55	Low	181 Å²	181	113.7 Å²	113.7	68%	0.683	54%	0.535	S	S	*	.	H	α-helix	trans	-60.8	-39.7	175.5	-74.9	-178.3	-176.1	173.4	1.5	112.6	A189 L190 R191 D196 Y197	A189-R193 WeakPolarHBondContact O-CG 3.48Å; A189-R193 PolarHBondContact O-N 3.49Å; L190-R193 PolarHBondContact O-N 3.39Å; R191-R193 PolarHBondContact O-N 3.2Å; R193-D196 PolarHBondContact O-N 3.29Å; R193-Y197 WeakPolarHBondContact O-CB 3.36Å; R193-Y197 PolarHBondContact O-N 3.34Å
194	A	55.3	Low	54.6	Low	45 Å²	45	113.5 Å²	113.5	37%	0.372	54%	0.542	S	S	.	.	H	α-helix	trans	-64.8	-45.8	174.6	0	0	0	0	0	111	L190 R191 R192 D196 Y197 Y198	L190-A194 PolarHBondContact O-N 3.4Å; R191-A194 PolarHBondContact O-N 3Å; R192-A194 VanDerWaalsContact C-N 3.31Å; R192-A194 PolarHBondContact O-N 3.08Å; A194-D196 VanDerWaalsContact C-N 3.33Å; A194-D196 PolarHBondContact O-N 3.11Å; A194-Y197 PolarHBondContact O-N 3.02Å; A194-Y198 WeakPolarHBondContact O-CD2 3.46Å; A194-Y198 PolarHBondContact O-N 2.65Å
195	E	55.2	Low	54	Low	88 Å²	88	113.6 Å²	113.6	41%	0.411	56%	0.557	S	S	.	*	H	α-helix	trans	-59.7	-41	175.8	-72.4	175.6	-174.8	0	0	112.2	R191 R192 Y198 R199	R191-E195 IonicContact CZ-OE1 2.9Å; R191-E195 VanDerWaalsContact CZ-OE1 3.3Å; R191-E195 IonicContact NE-OE1 3.82Å; R191-E195 PolarHBondContact NE-OE1 3.28Å; R191-E195 IonicContact NH2-OE1 3.1Å; R191-E195 PolarHBondContact NH2-OE1 2.91Å; R191-E195 WeakPolarHBondContact O-CG 3.12Å; R191-E195 PolarHBondContact O-N 3.04Å; R192-E195 PolarHBondContact O-N 2.99Å; E195-Y198 PolarHBondContact O-N 3.47Å; E195-R199 PolarHBondContact O-N 3Å
196	D	60.2	Low	53.6	Low	91 Å²	91	111.4 Å²	111.4	49%	0.487	56%	0.559	S	S	.	*	H	α-helix	trans	-68.6	-43	177.1	-71.1	-27.2	0	0	0	112.2	R192 R193 A194 Y198 R199 C200	R192-D196 WeakPolarHBondContact O-CB 3.02Å; R192-D196 VanDerWaalsContact O-CG 3.3Å; R192-D196 PolarHBondContact O-N 3.17Å; R193-D196 PolarHBondContact O-N 3.29Å; A194-D196 VanDerWaalsContact C-N 3.33Å; A194-D196 PolarHBondContact O-N 3.11Å; D196-Y198 VanDerWaalsContact C-N 3.25Å; D196-Y198 PolarHBondContact O-N 3.37Å; D196-R199 WeakPolarHBondContact O-CB 3.26Å; D196-R199 PolarHBondContact O-N 2.9Å; D196-R199 VanDerWaalsContact O-N 3.11Å; D196-C200 PolarHBondContact O-N 2.96Å; D196-C200 PolarHBondContact O-SG 2.97Å; D196-C200 VanDerWaalsContact O-SG 3.38Å
197	Y	53.8	Low	53.3	Low	138 Å²	138	110.8 Å²	110.8	54%	0.541	56%	0.556	S	S	.	*	H	α-helix	trans	-56.6	-42	172.6	177.1	-100.2	0	0	0	111.4	R193 A194 C200 K201	R193-Y197 WeakPolarHBondContact O-CB 3.36Å; R193-Y197 PolarHBondContact O-N 3.34Å; A194-Y197 PolarHBondContact O-N 3.02Å; Y197-C200 PolarHBondContact O-N 2.89Å; Y197-K201 HydrophobicContact CE1-CG 4.26Å; Y197-K201 WeakPolarHBondContact O-CG 3.42Å; Y197-K201 PolarHBondContact O-N 3.48Å; Y197-K201 VanDerWaalsContact O-N 3.15Å; Y197-K201 VanDerWaalsContact OH-CE 3.25Å; Y197-K201 WeakPolarHBondContact OH-CE 3.49Å
198	Y	51	Low	52.4	Low	118 Å²	118	117.1 Å²	117.1	46%	0.463	57%	0.573	S	S	.	*	H	α-helix	trans	-70	-35.7	175.1	-73.4	-60.8	0	0	0	113.2	A194 E195 D196 C200 K201 I202	A194-Y198 WeakPolarHBondContact O-CD2 3.46Å; A194-Y198 PolarHBondContact O-N 2.65Å; E195-Y198 PolarHBondContact O-N 3.47Å; D196-Y198 VanDerWaalsContact C-N 3.25Å; D196-Y198 PolarHBondContact O-N 3.37Å; Y198-C200 VanDerWaalsContact C-N 3.28Å; Y198-C200 PolarHBondContact O-N 3.49Å; Y198-K201 PolarHBondContact O-N 3.49Å; Y198-I202 WeakPolarHBondContact O-CG1 3.23Å; Y198-I202 PolarHBondContact O-N 3.47Å
199	R	52.8	Low	51.7	Low	176 Å²	176	118.2 Å²	118.2	66%	0.664	59%	0.588	S	S	*	*	H	α-helix	trans	-62.3	-34.2	172.5	-83.9	-164	179	-152.7	3.6	112.9	E195 D196 R207	E195-R199 PolarHBondContact O-N 3Å; D196-R199 WeakPolarHBondContact O-CB 3.26Å; D196-R199 PolarHBondContact O-N 2.9Å; D196-R199 VanDerWaalsContact O-N 3.11Å; R199-R207 PolarHBondContact O-NH2 3.38Å
200	C	52.9	Low	50.8	Low	106 Å²	106	124.7 Å²	124.7	72%	0.716	62%	0.615	S	S	*	*	H	α-helix	trans	-79.3	-24.7	179.4	-68.1	0	0	0	0	113.2	D196 Y197 Y198	D196-C200 PolarHBondContact O-N 2.96Å; D196-C200 PolarHBondContact O-SG 2.97Å; D196-C200 VanDerWaalsContact O-SG 3.38Å; Y197-C200 PolarHBondContact O-N 2.89Å; Y198-C200 VanDerWaalsContact C-N 3.28Å; Y198-C200 PolarHBondContact O-N 3.49Å
201	K	51.8	Low	49.8	Very low	146 Å²	146	124.2 Å²	124.2	64%	0.635	62%	0.62	S	S	*	*	H	α-helix	trans	-81.8	-10.9	175.1	-75.9	-80	-174.3	177	0	113.9	Y197 Y198	Y197-K201 HydrophobicContact CE1-CG 4.26Å; Y197-K201 WeakPolarHBondContact O-CG 3.42Å; Y197-K201 PolarHBondContact O-N 3.48Å; Y197-K201 VanDerWaalsContact O-N 3.15Å; Y197-K201 VanDerWaalsContact OH-CE 3.25Å; Y197-K201 WeakPolarHBondContact OH-CE 3.49Å; Y198-K201 PolarHBondContact O-N 3.49Å
202	I	45.9	Very low	48.6	Very low	93 Å²	93	124.6 Å²	124.6	48%	0.477	63%	0.632	S	S	.	*	S	Bend	trans	-79.4	120	170	-62.9	170.2	0	0	0	108.1	Y198 A206	Y198-I202 WeakPolarHBondContact O-CG1 3.23Å; Y198-I202 PolarHBondContact O-N 3.47Å; I202-A206 HydrophobicContact CG2-CB 4.06Å
203	T	41.7	Very low	47.8	Very low	99 Å²	99	128.9 Å²	128.9	61%	0.607	65%	0.649	S	S	*	*			trans	-55.1	137.8	178.2	24.6	0	0	0	0	111.6	S205 A206	T203-S205 PolarHBondContact O-N 2.96Å; T203-A206 PolarHBondContact O-N 3.4Å
204	P	47.7	Very low	46.2	Very low	108 Å²	108	124.2 Å²	124.2	70%	0.701	64%	0.643	S	S	*	*	G	3₁₀ helix	trans	-54	-30.6	-178.8	-25.8	32.9	0	0	0	113.8	A206 R207	P204-A206 PolarHBondContact O-N 3.08Å; P204-R207 WeakPolarHBondContact O-CB 3.44Å; P204-R207 PolarHBondContact O-N 3.43Å
205	S	46.5	Very low	45.1	Very low	119 Å²	119	127.3 Å²	127.3	83%	0.832	66%	0.657	S	S	*	*	G	3₁₀ helix	trans	-63.3	-17.6	178.6	-171.7	0	0	0	0	114.8	T203	T203-S205 PolarHBondContact O-N 2.96Å
206	A	46.3	Very low	43.8	Very low	68 Å²	68	134.1 Å²	134.1	56%	0.562	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-92.4	-5.4	175.7	0	0	0	0	0	113	I202 T203 P204 K208	I202-A206 HydrophobicContact CG2-CB 4.06Å; T203-A206 PolarHBondContact O-N 3.4Å; P204-A206 PolarHBondContact O-N 3.08Å; A206-K208 PolarHBondContact O-N 3.02Å
207	R	49.2	Very low	42.4	Very low	152 Å²	152	136.1 Å²	136.1	57%	0.574	69%	0.691	S	S	*	*			trans	-85.3	85	171.6	-65.7	-178.3	-172.6	170.7	2.9	108.5	R199 P204	R199-R207 PolarHBondContact O-NH2 3.38Å; P204-R207 WeakPolarHBondContact O-CB 3.44Å; P204-R207 PolarHBondContact O-N 3.43Å
208	K	40.9	Very low	41.5	Very low	190 Å²	190	137.3 Å²	137.3	83%	0.826	71%	0.706	S	S	*	*			trans	-54.4	131.5	162.2	-76.7	-174.8	177.3	-178.2	0	108	A206 L210	A206-K208 PolarHBondContact O-N 3.02Å; K208-L210 PolarHBondContact O-N 3.45Å; K208-L210 VanDerWaalsContact O-N 3.12Å
209	P	38.5	Very low	40.6	Very low	107 Å²	107	137.4 Å²	137.4	70%	0.695	72%	0.719	S	S	*	*			trans	-67.8	116.4	176.4	27.4	-29.8	0	0	0	107.4	C211	P209-C211 HydrophobicContact CB-CB 4.36Å; P209-C211 PolarHBondContact O-N 3.44Å
210	L	41.7	Very low	39.6	Very low	182 Å²	182	135.9 Å²	135.9	95%	0.953	72%	0.723	S	S	*	*			trans	-72.6	39.7	160.2	-76.4	166.6	0	0	0	110.4	K208	K208-L210 PolarHBondContact O-N 3.45Å; K208-L210 VanDerWaalsContact O-N 3.12Å
211	C	37.1	Very low	38.6	Very low	104 Å²	104	137 Å²	137	70%	0.703	73%	0.729	S	S	*	*			trans	-120.9	78	172.6	-75.2	0	0	0	0	107.3	P209	P209-C211 HydrophobicContact CB-CB 4.36Å; P209-C211 PolarHBondContact O-N 3.44Å
212	N	33.5	Very low	38	Very low	144 Å²	144	133.8 Å²	133.8	77%	0.77	74%	0.737	S	S	*	*			trans	-142.5	93.5	138	-108.9	-1.7	0	0	0	108.1	C214	N212-C214 PolarHBondContact O-N 3.14Å
213	R	40.2	Very low	37.4	Very low	252 Å²	252	134 Å²	134	95%	0.951	75%	0.747	S	S	*	*			trans	-58.7	88.6	149.3	-177.5	-177.7	-172.7	-169.6	1.7	106.6
214	C	28.3	Very low	37.2	Very low	83 Å²	83	138.3 Å²	138.3	56%	0.561	76%	0.761	S	S	*	*			trans	-127.3	95.4	168.7	-68.6	0	0	0	0	108	N212	N212-C214 PolarHBondContact O-N 3.14Å
215	T	31.3	Very low	36.6	Very low	109 Å²	109	142.1 Å²	142.1	67%	0.669	77%	0.766	S	S	*	*			trans	18.3	115.5	137.9	45.7	0	0	0	0	116.1	N217	T215-N217 VanDerWaalsContact C-N 3.32Å; T215-N217 PolarHBondContact O-N 3.36Å
216	Y	28.5	Very low	36.1	Very low	232 Å²	232	144.9 Å²	144.9	91%	0.91	76%	0.763	S	S	*	*			trans	-54.5	94.8	158.9	-63.5	-88.4	0	0	0	109.5	L218	Y216-L218 PolarHBondContact O-N 3.33Å
217	N	31.3	Very low	35.5	Very low	133 Å²	133	152 Å²	152	71%	0.711	78%	0.777	S	S	*	*			trans	-84.6	102.5	160.6	-75.8	-23.1	0	0	0	106.6	T215 V219	T215-N217 VanDerWaalsContact C-N 3.32Å; T215-N217 PolarHBondContact O-N 3.36Å; N217-V219 PolarHBondContact O-N 3.4Å
218	L	34.3	Very low	34.6	Very low	162 Å²	162	154.4 Å²	154.4	85%	0.848	79%	0.787	S	S	*	*			trans	-55.2	106.6	156.6	-107.1	92.4	0	0	0	107	Y216	Y216-L218 PolarHBondContact O-N 3.33Å
219	V	32.2	Very low	34.4	Very low	121 Å²	121	151 Å²	151	73%	0.733	79%	0.787	S	S	*	*			trans	-99.4	104.2	165.1	178.1	0	0	0	0	106.1	N217	N217-V219 PolarHBondContact O-N 3.4Å
220	L	32.7	Very low	34.1	Very low	143 Å²	143	154.7 Å²	154.7	75%	0.749	80%	0.795	S	S	*	*			trans	-58.4	143	166	-82.2	153.1	0	0	0	109.5	G222	L220-G222 PolarHBondContact O-N 2.95Å
221	P	30.4	Very low	33.9	Very low	129 Å²	129	154.3 Å²	154.3	84%	0.838	82%	0.818	S	S	*	*	S	Bend	trans	-77.3	111.6	-176.7	31.4	-29.8	0	0	0	109
222	G	39.5	Very low	33.7	Very low	79 Å²	79	156.9 Å²	156.9	81%	0.814	82%	0.824	S	S	*	*			trans	161.7	27.6	173.7	0	0	0	0	0	119.4	L220	L220-G222 PolarHBondContact O-N 2.95Å
223	S	32.8	Very low	33.7	Very low	98 Å²	98	157.5 Å²	157.5	69%	0.685	83%	0.827	S	S	*	*			trans	-138.8	112.8	173.1	64	0	0	0	0	112.4
224	E	38.1	Very low	33.3	Very low	190 Å²	190	152.3 Å²	152.3	89%	0.888	82%	0.82	S	S	*	*			trans	-51.6	134.6	172.6	-68.5	179.4	146.3	0	0	111.7
225	K	36.3	Very low	33.6	Very low	188 Å²	188	156.4 Å²	156.4	82%	0.817	84%	0.835	S	S	*	*			trans	-95	108.6	172.7	-68.9	-175.4	179.7	179.9	0	109.3
226	K	35.1	Very low	33.8	Very low	176 Å²	176	159.3 Å²	159.3	77%	0.765	85%	0.846	S	S	*	*			trans	-72	129.4	161.7	-72.1	-175.6	177.2	-179.6	0	108.9
227	Y	33.6	Very low	34.1	Very low	219 Å²	219	154.5 Å²	154.5	86%	0.859	84%	0.842	S	S	*	*			trans	-83.5	128.2	172.3	-71	-90.2	0	0	0	109.5
228	Y	31.2	Very low	34.3	Very low	202 Å²	202	156 Å²	156	79%	0.792	85%	0.851	S	S	*	*			trans	-113.2	116.6	157.8	-80.7	-80.9	0	0	0	108.5
229	S	34.8	Very low	34.3	Very low	118 Å²	118	155.5 Å²	155.5	83%	0.825	85%	0.851	S	S	*	*			trans	-76.5	122.3	165.1	50	0	0	0	0	108.6
230	H	33.7	Very low	34.5	Very low	184 Å²	184	158.4 Å²	158.4	85%	0.852	86%	0.861	S	S	*	*			trans	-90	126.1	162.5	-89.2	-85.9	0	0	0	108.7
231	A	36	Very low	34.7	Very low	175 Å²	175	159.8 Å²	159.8	100%	1.446	87%	0.871	S	S	*	*			trans	-66.8	0	171.6	0	0	0	0	0	111.9

Retrieved 231 of 231 residues in 52.3 ms (Link to these results)

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