A0A077ZAH0_TRITR Loading...

Sorting nexin 2

AlphaFold DB , UniProt , Accession A0A077ZAH0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 556 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	50.5	Low	43.1	Very low	249 Å²	249	148 Å²	148	100%	1.227	86%	0.857	S	S	*	*				0	97	0	-88.8	173.5	165.6	0	0	106.8
2	E	42.5	Very low	42.7	Very low	171 Å²	171	150.2 Å²	150.2	80%	0.799	85%	0.849	S	S	*	*			trans	-65.2	160	159.3	-109.5	-178.5	176.4	0	0	109.3
3	P	51.6	Low	42.4	Very low	122 Å²	122	150.7 Å²	150.7	79%	0.792	85%	0.849	S	S	*	*				-147.9	174.3	55.2	35.5	-11.8	0	0	0	118.8
4	T	39.2	Very low	42.4	Very low	111 Å²	111	153.9 Å²	153.9	68%	0.681	85%	0.853	S	S	*	*			trans	-57.3	157.5	-177.7	42.7	0	0	0	0	119.1
5	K	52.8	Low	42.4	Very low	214 Å²	214	156.4 Å²	156.4	93%	0.93	86%	0.856	S	S	*	*			trans	-162.2	127.5	135.9	-107.8	178.3	-175.8	-176	0	111.7
6	E	41.8	Very low	42.3	Very low	197 Å²	197	156.8 Å²	156.8	92%	0.921	86%	0.857	S	S	*	*			trans	-89.7	151.3	-176.7	-70.3	179.2	143.6	0	0	114.6
7	G	41.8	Very low	42.3	Very low	72 Å²	72	157.4 Å²	157.4	74%	0.742	86%	0.859	S	S	*	*			trans	110.1	150.7	134.6	0	0	0	0	0	117.9
8	P	41.5	Very low	42.1	Very low	133 Å²	133	157.5 Å²	157.5	86%	0.864	86%	0.858	S	S	*	*			cis	-138.4	164.7	-24.4	38	-20.3	0	0	0	114.9
9	G	36.5	Very low	41.8	Very low	82 Å²	82	160 Å²	160	85%	0.845	86%	0.86	S	S	*	*			trans	91	102.3	145.8	0	0	0	0	0	119
10	S	38.8	Very low	41.7	Very low	102 Å²	102	164.3 Å²	164.3	71%	0.713	86%	0.863	S	S	*	*			trans	-147.9	110.9	151.1	172.5	0	0	0	0	108.9	F12	S10-F12 PolarHBondContact O-N 3.36Å
11	L	37	Very low	41.5	Very low	175 Å²	175	162.5 Å²	162.5	92%	0.916	86%	0.862	S	S	*	*			trans	-72.3	92.6	177.9	-172.2	84.8	0	0	0	109.2
12	F	38.5	Very low	40.9	Very low	174 Å²	174	155.5 Å²	155.5	76%	0.763	84%	0.843	S	S	*	*			trans	-138.5	132.3	161.6	-85.9	-86.2	0	0	0	106	S10	S10-F12 PolarHBondContact O-N 3.36Å
13	D	38.4	Very low	40.6	Very low	157 Å²	157	154.8 Å²	154.8	84%	0.84	84%	0.844	S	S	*	*			trans	128	89.1	168.3	-65.9	-17.4	0	0	0	110
14	E	43.2	Very low	39.8	Very low	195 Å²	195	158.2 Å²	158.2	91%	0.911	85%	0.849	S	S	*	*			trans	161.2	76.1	150.1	-90.6	173.2	-170.8	0	0	109.9
15	E	41.9	Very low	39.6	Very low	192 Å²	192	159.7 Å²	159.7	90%	0.897	86%	0.858	S	S	*	*			trans	-163.5	59.8	162.2	-114.9	175.8	-151.1	0	0	110.7
16	D	40.8	Very low	38.7	Very low	163 Å²	163	152.4 Å²	152.4	87%	0.872	84%	0.843	S	S	*	*			trans	-133.8	74.1	170.5	-96.8	-28.8	0	0	0	108.2
17	D	41.9	Very low	38.3	Very low	167 Å²	167	150.5 Å²	150.5	89%	0.893	84%	0.84	S	S	*	*			trans	-164	34.7	167.4	-112.8	-14.6	0	0	0	115.4
18	L	39.1	Very low	38	Very low	159 Å²	159	155.4 Å²	155.4	83%	0.832	84%	0.841	S	S	*	*			trans	-122.6	39.6	178.4	-78.9	166.9	0	0	0	113.6
19	F	37	Very low	37.8	Very low	205 Å²	205	155.9 Å²	155.9	90%	0.899	84%	0.835	S	S	*	*			trans	-145.4	85.2	170	-77.9	-81	0	0	0	112.5
20	R	38.1	Very low	38	Very low	245 Å²	245	155.4 Å²	155.4	93%	0.925	82%	0.815	S	S	*	*			trans	-141.8	110.9	156.7	-86.7	-167.9	178	-163.9	1.3	111.1	A22	R20-A22 PolarHBondContact O-N 3.36Å
21	P	38.9	Very low	38	Very low	128 Å²	128	153.9 Å²	153.9	83%	0.831	80%	0.803	S	S	*	*			trans	-78.7	113.2	157.8	-7.9	25.5	0	0	0	108.6	L23	P21-L23 PolarHBondContact O-N 3.34Å
22	A	38	Very low	38.1	Very low	101 Å²	101	152.1 Å²	152.1	84%	0.835	80%	0.795	S	S	*	*			trans	-71.3	114	170.6	0	0	0	0	0	109.8	R20 E24	R20-A22 PolarHBondContact O-N 3.36Å; A22-E24 PolarHBondContact O-N 3.4Å
23	L	35.2	Very low	38.1	Very low	157 Å²	157	151.8 Å²	151.8	82%	0.822	80%	0.795	S	S	*	*			trans	-71.2	110.7	159.4	-90.2	153.8	0	0	0	108.7	P21	P21-L23 PolarHBondContact O-N 3.34Å
24	E	35.3	Very low	38.2	Very low	193 Å²	193	150.4 Å²	150.4	90%	0.902	79%	0.787	S	S	*	*			trans	-142.2	100.6	146.9	-74.2	-165	165.4	0	0	108.6	A22 G26	A22-E24 PolarHBondContact O-N 3.4Å; E24-G26 VanDerWaalsContact C-N 3.34Å; E24-G26 PolarHBondContact O-N 3.43Å; E24-G26 VanDerWaalsContact O-N 3.13Å
25	V	35.1	Very low	38	Very low	142 Å²	142	145.1 Å²	145.1	86%	0.861	77%	0.765	S	S	*	*			trans	-76	91.6	166.2	179	0	0	0	0	106.3
26	G	34.1	Very low	37.7	Very low	61 Å²	61	141.3 Å²	141.3	63%	0.629	75%	0.747	S	S	*	*			trans	-88	138.9	167.7	0	0	0	0	0	110.6	E24 F28	E24-G26 VanDerWaalsContact C-N 3.34Å; E24-G26 PolarHBondContact O-N 3.43Å; E24-G26 VanDerWaalsContact O-N 3.13Å; G26-F28 PolarHBondContact O-N 3.16Å
27	D	32.4	Very low	37.3	Very low	158 Å²	158	144.4 Å²	144.4	85%	0.845	75%	0.746	S	S	*	*			trans	-45.9	118.8	178.9	-73.1	-41.1	0	0	0	112.6	I29	D27-I29 PolarHBondContact O-N 3.14Å
28	F	35.9	Very low	37	Very low	175 Å²	175	141 Å²	141	77%	0.768	74%	0.735	S	S	*	*			trans	-76.7	93.5	172.2	-171.7	-100.5	0	0	0	109.4	G26 V30	G26-F28 PolarHBondContact O-N 3.16Å; F28-V30 HydrophobicContact CD1-CG2 4.15Å; F28-V30 HydrophobicContact CE1-CG2 3.99Å; F28-V30 PolarHBondContact O-N 3.2Å
29	I	38	Very low	37	Very low	142 Å²	142	143.6 Å²	143.6	73%	0.728	73%	0.734	S	S	*	*			trans	-73.8	114.3	164.3	-61.4	174.3	0	0	0	106.9	D27 P31	D27-I29 PolarHBondContact O-N 3.14Å; I29-P31 WeakPolarHBondContact O-CD 3.45Å
30	V	39.7	Very low	36.8	Very low	73 Å²	73	141 Å²	141	44%	0.442	73%	0.725	S	S	.	*			trans	-61.2	123	172.1	-178.3	0	0	0	0	108.1	F28 D32 L34	F28-V30 HydrophobicContact CD1-CG2 4.15Å; F28-V30 HydrophobicContact CE1-CG2 3.99Å; F28-V30 PolarHBondContact O-N 3.2Å; V30-D32 PolarHBondContact O-N 3.35Å; V30-L34 HydrophobicContact CG1-CB 4.23Å
31	P	39.2	Very low	36.4	Very low	69 Å²	69	132.7 Å²	132.7	45%	0.448	72%	0.716	S	S	.	*			trans	-59.2	135.7	177.1	-21.6	32	0	0	0	111.1	I29 E33 L34	I29-P31 WeakPolarHBondContact O-CD 3.45Å; P31-E33 PolarHBondContact O-N 2.8Å; P31-L34 PolarHBondContact O-N 2.98Å
32	D	39.9	Very low	36.1	Very low	139 Å²	139	134.7 Å²	134.7	74%	0.743	72%	0.718	S	S	*	*	H	α-helix	trans	-54.2	-19.1	-179.2	-104.1	-19.8	0	0	0	113.8	V30 L34 L35	V30-D32 PolarHBondContact O-N 3.35Å; D32-L34 PolarHBondContact O-N 3.47Å; D32-L35 PolarHBondContact O-N 2.89Å
33	E	38.8	Very low	35.7	Very low	167 Å²	167	134.8 Å²	134.8	78%	0.78	71%	0.713	S	S	*	*	H	α-helix	trans	-70.8	-23.7	177.2	-70.1	-174.8	154.5	0	0	114	P31	P31-E33 PolarHBondContact O-N 2.8Å
34	L	38.8	Very low	35.7	Very low	128 Å²	128	134.5 Å²	134.5	67%	0.67	71%	0.712	S	S	*	*	H	α-helix	trans	-87.3	-14.5	174.2	-80.6	167.3	0	0	0	113.3	V30 P31 D32	V30-L34 HydrophobicContact CG1-CB 4.23Å; P31-L34 PolarHBondContact O-N 2.98Å; D32-L34 PolarHBondContact O-N 3.47Å
35	L	40.2	Very low	35.6	Very low	83 Å²	83	134.3 Å²	134.3	44%	0.435	71%	0.711	S	S	.	*	H	α-helix	trans	-82.6	-13.1	171.2	-80.8	163.4	0	0	0	112.9	D32 W37	D32-L35 PolarHBondContact O-N 2.89Å; L35-W37 VanDerWaalsContact C-N 3.31Å; L35-W37 PolarHBondContact O-N 2.79Å
36	H	34.3	Very low	35.6	Very low	112 Å²	112	134.6 Å²	134.6	52%	0.519	71%	0.706	S	S	.	*	G	3₁₀ helix	trans	-68.9	-28.3	176.3	-176.3	-60.6	0	0	0	112.4	S38 Q40	H36-S38 VanDerWaalsContact C-N 3.34Å; H36-S38 PolarHBondContact O-N 3.24Å; H36-Q40 PolarHBondContact CE1-OE1 3.28Å
37	W	33.7	Very low	35.5	Very low	228 Å²	228	138.4 Å²	138.4	86%	0.864	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-82.3	-7.9	-175.4	-73.6	52.3	0	0	0	113.9	L35	L35-W37 VanDerWaalsContact C-N 3.31Å; L35-W37 PolarHBondContact O-N 2.79Å
38	S	35.5	Very low	35.6	Very low	95 Å²	95	138.3 Å²	138.3	66%	0.664	71%	0.71	S	S	*	*	G	3₁₀ helix	trans	-100.3	0.4	176.7	90.1	0	0	0	0	114.7	H36	H36-S38 VanDerWaalsContact C-N 3.34Å; H36-S38 PolarHBondContact O-N 3.24Å
39	R	37.8	Very low	35.6	Very low	215 Å²	215	137.2 Å²	137.2	81%	0.811	71%	0.713	S	S	*	*	S	Bend	trans	-112.8	-1	-174.3	-73	-175	-178.6	-119.8	4	115.8
40	Q	34.9	Very low	35.4	Very low	149 Å²	149	134.2 Å²	134.2	70%	0.696	72%	0.716	S	S	*	*	S	Bend	trans	-107.2	107.6	171.2	-90.6	168.2	-23.2	0	0	109.8	H36	H36-Q40 PolarHBondContact CE1-OE1 3.28Å
41	G	29.1	Very low	35.1	Very low	72 Å²	72	138.8 Å²	138.8	74%	0.742	74%	0.738	S	S	*	*			trans	-62.5	135.3	178.4	0	0	0	0	0	111.9	S43	G41-S43 VanDerWaalsContact C-N 3.26Å; G41-S43 PolarHBondContact O-N 2.9Å
42	I	31.3	Very low	35	Very low	169 Å²	169	144.9 Å²	144.9	87%	0.867	76%	0.761	S	S	*	*			trans	-83.9	83.7	157.9	-59.5	172.7	0	0	0	105.4
43	S	29.8	Very low	34.7	Very low	104 Å²	104	147.7 Å²	147.7	73%	0.727	77%	0.77	S	S	*	*			trans	-99.1	109.2	146.6	-62.8	0	0	0	0	104.4	G41	G41-S43 VanDerWaalsContact C-N 3.26Å; G41-S43 PolarHBondContact O-N 2.9Å
44	D	36.1	Very low	34.6	Very low	150 Å²	150	144.3 Å²	144.3	80%	0.802	77%	0.77	S	S	*	*			trans	-177.6	141.7	139.8	-85.3	-17.4	0	0	0	108.8
45	E	33.3	Very low	34.2	Very low	189 Å²	189	143 Å²	143	88%	0.883	78%	0.778	S	S	*	*			trans	-54	135.3	-168.4	-61.4	164.6	136.6	0	0	113.8
46	I	35.7	Very low	33.9	Very low	149 Å²	149	146.1 Å²	146.1	76%	0.764	80%	0.8	S	S	*	*			trans	-121.9	101.4	155.7	-58.5	-179.7	0	0	0	107.7	L48	I46-L48 HydrophobicContact CG2-CD2 4.36Å; I46-L48 HydrophobicContact CG2-CG 4.26Å
47	N	30.5	Very low	33.7	Very low	140 Å²	140	150.7 Å²	150.7	75%	0.749	82%	0.818	S	S	*	*			trans	-67.3	125.5	168.5	-162.8	6.1	0	0	0	108.9
48	L	34.7	Very low	33.6	Very low	156 Å²	156	143.4 Å²	143.4	82%	0.817	81%	0.814	S	S	*	*			trans	-122.7	71.6	177.3	-74	172	0	0	0	109.6	I46	I46-L48 HydrophobicContact CG2-CD2 4.36Å; I46-L48 HydrophobicContact CG2-CG 4.26Å
49	D	35.8	Very low	33.4	Very low	153 Å²	153	143.9 Å²	143.9	82%	0.818	82%	0.824	S	S	*	*			trans	-119.7	117.8	157.4	-79.1	-36	0	0	0	107
50	G	33.6	Very low	32.9	Very low	78 Å²	78	143.7 Å²	143.7	80%	0.804	82%	0.823	S	S	*	*			trans	165.7	88.8	180	0	0	0	0	0	112.6	E52	G50-E52 PolarHBondContact O-N 3.44Å
51	D	34.2	Very low	32.8	Very low	169 Å²	169	144.6 Å²	144.6	90%	0.904	83%	0.832	S	S	*	*			trans	-60.2	120.2	163.1	-70.7	-50.6	0	0	0	110.2
52	E	37.7	Very low	32.8	Very low	198 Å²	198	148.1 Å²	148.1	93%	0.925	83%	0.829	S	S	*	*			trans	-144.1	108.7	155.7	-97.4	-168.5	169.6	0	0	111.3	G50	G50-E52 PolarHBondContact O-N 3.44Å
53	E	33.4	Very low	33	Very low	198 Å²	198	148.2 Å²	148.2	93%	0.925	83%	0.83	S	S	*	*			trans	-92.3	110.4	167.6	180	-175.6	-162.1	0	0	108.4
54	A	35.7	Very low	33	Very low	95 Å²	95	151 Å²	151	79%	0.785	84%	0.837	S	S	*	*			trans	-171.4	109.3	156.2	0	0	0	0	0	114.5
55	A	30.7	Very low	32.9	Very low	100 Å²	100	151.5 Å²	151.5	83%	0.826	84%	0.84	S	S	*	*			trans	43.4	110.6	134.3	0	0	0	0	0	121.6
56	V	34.4	Very low	33	Very low	149 Å²	149	147.4 Å²	147.4	90%	0.903	83%	0.832	S	S	*	*			trans	-136.6	120.8	140.5	-178.8	0	0	0	0	110.6
57	K	30.8	Very low	33	Very low	208 Å²	208	145.2 Å²	145.2	90%	0.904	83%	0.83	S	S	*	*			trans	-67.1	144.7	172.6	-67.6	168	174	172.7	0	111.2
58	G	31.3	Very low	33.3	Very low	76 Å²	76	145.1 Å²	145.1	78%	0.784	83%	0.834	S	S	*	*			trans	167.1	114.9	157.8	0	0	0	0	0	116.3
59	A	31	Very low	33.1	Very low	105 Å²	105	144.1 Å²	144.1	87%	0.868	83%	0.83	S	S	*	*			trans	67.2	84.4	157.5	0	0	0	0	0	119.1
60	R	26.9	Very low	33.1	Very low	211 Å²	211	144.5 Å²	144.5	80%	0.796	83%	0.832	S	S	*	*			trans	-70.3	119	150.9	-178.1	-177	-172.7	162.4	-0.1	109	Q62	R60-Q62 HydrophobicContact CG-CG 4.09Å
61	L	32.8	Very low	32.8	Very low	168 Å²	168	149.2 Å²	149.2	88%	0.88	83%	0.833	S	S	*	*			trans	-96.9	105.1	159.5	-81.1	168.4	0	0	0	108.1
62	Q	29	Very low	32.7	Very low	146 Å²	146	145.8 Å²	145.8	68%	0.682	83%	0.828	S	S	*	*			trans	-77.5	118.3	163.5	-73.7	176.3	-62.4	0	0	107.6	R60	R60-Q62 HydrophobicContact CG-CG 4.09Å
63	L	36	Very low	32.4	Very low	170 Å²	170	141.8 Å²	141.8	89%	0.89	82%	0.817	S	S	*	*			trans	-96.9	102.8	157.9	-73.9	169.9	0	0	0	106.8	N65	L63-N65 PolarHBondContact O-N 2.99Å
64	D	28.4	Very low	32.4	Very low	163 Å²	163	139.5 Å²	139.5	87%	0.872	81%	0.81	S	S	*	*			trans	-63.3	124.4	159.3	-109.4	-20.6	0	0	0	107.5
65	N	35.3	Very low	32.1	Very low	160 Å²	160	140 Å²	140	86%	0.856	81%	0.808	S	S	*	*			trans	-136.8	104.2	155.3	-131.8	3.7	0	0	0	108.7	L63	L63-N65 PolarHBondContact O-N 2.99Å
66	S	36.1	Very low	32.2	Very low	103 Å²	103	143 Å²	143	72%	0.72	81%	0.809	S	S	*	*			trans	-58.7	129.7	173.7	45.4	0	0	0	0	112
67	S	33.9	Very low	32.2	Very low	104 Å²	104	140.6 Å²	140.6	73%	0.727	81%	0.805	S	S	*	*			trans	47.6	95.9	138.4	-178.1	0	0	0	0	118
68	V	37.4	Very low	32.2	Very low	137 Å²	137	133.9 Å²	133.9	83%	0.83	79%	0.794	S	S	*	*			trans	-140.4	107.2	138.4	-172.2	0	0	0	0	108.4
69	D	30.5	Very low	32.2	Very low	135 Å²	135	138 Å²	138	72%	0.722	80%	0.798	S	S	*	*			trans	-58.4	132.5	167.5	-77.3	-52.1	0	0	0	110.7
70	N	35.2	Very low	32.2	Very low	162 Å²	162	140.7 Å²	140.7	87%	0.866	80%	0.798	S	S	*	*			trans	-147.5	99	149.6	-99.5	-25.9	0	0	0	109
71	Q	28.6	Very low	32.7	Very low	176 Å²	176	137 Å²	137	82%	0.822	80%	0.8	S	S	*	*			trans	-66.8	124.3	167.8	-71.1	174.4	-4.9	0	0	109.6
72	A	32.6	Very low	32.6	Very low	97 Å²	97	134 Å²	134	80%	0.802	79%	0.793	S	S	*	*			trans	-132.6	78	157.3	0	0	0	0	0	108.4	I74	A72-I74 PolarHBondContact O-N 2.82Å
73	T	30.2	Very low	33	Very low	115 Å²	115	135 Å²	135	71%	0.706	80%	0.803	S	S	*	*			trans	-74.7	112	166.8	-53.3	0	0	0	0	108.2
74	I	33.9	Very low	32.9	Very low	150 Å²	150	131.3 Å²	131.3	77%	0.769	80%	0.796	S	S	*	*			trans	-98.2	98.5	164.2	-64.3	178.2	0	0	0	107.3	A72 L76	A72-I74 PolarHBondContact O-N 2.82Å; I74-L76 HydrophobicContact CG2-CD1 4.49Å; I74-L76 HydrophobicContact CG2-CG 4.47Å
75	S	28.4	Very low	33.3	Very low	105 Å²	105	130.5 Å²	130.5	73%	0.734	80%	0.797	S	S	*	*			trans	-83	119.9	163.6	-65	0	0	0	0	109.2
76	L	34.4	Very low	33.3	Very low	162 Å²	162	129 Å²	129	85%	0.848	79%	0.789	S	S	*	*			trans	-106	98.3	160.7	-83.3	157.7	0	0	0	107.8	I74	I74-L76 HydrophobicContact CG2-CD1 4.49Å; I74-L76 HydrophobicContact CG2-CG 4.47Å
77	A	34.4	Very low	33.2	Very low	99 Å²	99	131.9 Å²	131.9	82%	0.818	79%	0.791	S	S	*	*			trans	-57.4	148.4	149.6	0	0	0	0	0	108.1
78	G	30.3	Very low	33.4	Very low	67 Å²	67	135.1 Å²	135.1	69%	0.691	80%	0.799	S	S	*	*			cis	166.4	137.3	7.6	0	0	0	0	0	103.8
79	D	31.7	Very low	33.3	Very low	162 Å²	162	136.1 Å²	136.1	87%	0.866	80%	0.799	S	S	*	*			trans	-159.8	116.3	154	-126	-10.7	0	0	0	108.8
80	N	30.9	Very low	33.3	Very low	162 Å²	162	132.7 Å²	132.7	87%	0.866	80%	0.796	S	S	*	*			trans	-88.3	121.6	172.8	-78.1	-35.8	0	0	0	107.7
81	T	36.5	Very low	33.5	Very low	135 Å²	135	132.9 Å²	132.9	83%	0.828	80%	0.795	S	S	*	*			trans	-136	113.3	152.6	45.2	0	0	0	0	109.2
82	S	30.6	Very low	33.9	Very low	104 Å²	104	130.8 Å²	130.8	73%	0.727	80%	0.795	S	S	*	*			trans	-64.3	142.5	165.2	57.3	0	0	0	0	110
83	D	37.4	Very low	33.7	Very low	168 Å²	168	134.7 Å²	134.7	90%	0.898	80%	0.796	S	S	*	*			trans	-159.8	133.9	135.1	-91.3	-29.1	0	0	0	110.3
84	A	33.7	Very low	34.2	Very low	91 Å²	91	135.3 Å²	135.3	75%	0.752	80%	0.802	S	S	*	*			trans	-77.7	151.3	-173.3	0	0	0	0	0	113
85	V	37.6	Very low	34.1	Very low	147 Å²	147	136.9 Å²	136.9	89%	0.891	81%	0.806	S	S	*	*			trans	-153.6	142.4	137.2	-174.1	0	0	0	0	110.1
86	D	36.2	Very low	34.5	Very low	129 Å²	129	136.9 Å²	136.9	69%	0.69	81%	0.806	S	S	*	*			trans	-67.1	151.2	-164.6	-69.2	-66.2	0	0	0	121
87	Q	32.8	Very low	34.7	Very low	163 Å²	163	136.9 Å²	136.9	76%	0.762	81%	0.807	S	S	*	*			trans	16.4	127.3	134.7	-58.6	172.5	35.1	0	0	120.4
88	I	39.2	Very low	34.6	Very low	172 Å²	172	143.5 Å²	143.5	88%	0.882	81%	0.811	S	S	*	*			trans	-147.9	126.8	131.4	-59.8	-170.4	0	0	0	110.1
89	N	34	Very low	34.8	Very low	157 Å²	157	145.9 Å²	145.9	84%	0.84	82%	0.816	S	S	*	*			trans	-55.1	158.1	171.1	-65.5	-39.4	0	0	0	112.8
90	G	30.1	Very low	35	Very low	64 Å²	64	145.4 Å²	145.4	66%	0.66	81%	0.812	S	S	*	*			cis	143.2	158.3	33.4	0	0	0	0	0	107.1
91	I	40.5	Very low	35.1	Very low	165 Å²	165	142.5 Å²	142.5	85%	0.846	80%	0.804	S	S	*	*			trans	143.8	89.7	163.3	-72.3	153.2	0	0	0	108
92	T	36.3	Very low	35	Very low	132 Å²	132	141.8 Å²	141.8	81%	0.81	80%	0.804	S	S	*	*				74.1	106.7	90.9	-37.8	0	0	0	0	115.9
93	E	29.1	Very low	35.2	Very low	179 Å²	179	140 Å²	140	84%	0.836	80%	0.802	S	S	*	*			trans	-105.4	154.8	159.3	-80.9	-175.1	152.9	0	0	110.5
94	P	39.7	Very low	35.1	Very low	128 Å²	128	140.3 Å²	140.3	83%	0.831	80%	0.803	S	S	*	*			trans	-120.6	136.3	156	34.5	-20.7	0	0	0	113.6
95	Q	31.6	Very low	35.1	Very low	183 Å²	183	141.5 Å²	141.5	86%	0.855	81%	0.806	S	S	*	*			trans	-97.2	150	169	-67.7	-173.7	-52	0	0	112.1
96	S	37.6	Very low	34.7	Very low	105 Å²	105	143.6 Å²	143.6	73%	0.734	81%	0.806	S	S	*	*			trans	171.2	142.7	151.1	25.8	0	0	0	0	107.1
97	D	39.1	Very low	34.8	Very low	162 Å²	162	144.7 Å²	144.7	87%	0.866	82%	0.817	S	S	*	*			cis	-157.6	159.2	15.6	-92.7	-35	0	0	0	110.9
98	R	32.2	Very low	34.7	Very low	238 Å²	238	143.9 Å²	143.9	90%	0.898	82%	0.818	S	S	*	*			trans	-92	155	175.1	-79.8	173.9	163.2	179.1	-4.5	112.4
99	C	33.9	Very low	34.5	Very low	117 Å²	117	143.6 Å²	143.6	79%	0.791	82%	0.815	S	S	*	*			trans	155.5	149.8	135.9	-84.8	0	0	0	0	109.9
100	I	36.1	Very low	34.5	Very low	153 Å²	153	139.9 Å²	139.9	79%	0.785	80%	0.801	S	S	*	*			cis	-165.6	154	-3.2	-96.5	160	0	0	0	104.8
101	S	32.5	Very low	34.6	Very low	100 Å²	100	142 Å²	142	70%	0.699	81%	0.806	S	S	*	*			trans	-79	179.7	-175.7	64.1	0	0	0	0	116.6
102	S	35.1	Very low	34.4	Very low	120 Å²	120	143.6 Å²	143.6	84%	0.839	81%	0.81	S	S	*	*			trans	107.7	129.5	156	-34.3	0	0	0	0	113.7
103	G	34.9	Very low	34.2	Very low	66 Å²	66	143.3 Å²	143.3	68%	0.68	81%	0.808	S	S	*	*			cis	159.4	154.4	2.1	0	0	0	0	0	109.2
104	L	36	Very low	34.6	Very low	176 Å²	176	141.2 Å²	141.2	92%	0.921	81%	0.808	S	S	*	*			trans	74.3	143.5	161.7	-49.8	173.8	0	0	0	116.6
105	S	33.2	Very low	34.5	Very low	115 Å²	115	140.7 Å²	140.7	80%	0.804	80%	0.803	S	S	*	*			cis	-172.2	157.5	4.8	38.6	0	0	0	0	108.8
106	E	29.1	Very low	34.5	Very low	191 Å²	191	140.6 Å²	140.6	89%	0.893	80%	0.802	S	S	*	*			trans	-61.2	149.4	-179.9	-64.4	166.1	139.2	0	0	116
107	V	38.1	Very low	34.9	Very low	153 Å²	153	141.6 Å²	141.6	93%	0.927	81%	0.806	S	S	*	*			trans	-145.8	127	147.2	-178.6	0	0	0	0	109
108	D	29.8	Very low	34.6	Very low	145 Å²	145	139.2 Å²	139.2	78%	0.775	80%	0.802	S	S	*	*			trans	-99.1	147.8	177.6	-171.5	14.2	0	0	0	110.1
109	M	35.9	Very low	35	Very low	166 Å²	166	136.5 Å²	136.5	82%	0.818	80%	0.801	S	S	*	*			trans	177	110.8	149.6	-100.9	-155.5	76.6	0	0	113.3
110	S	33.5	Very low	35.3	Very low	79 Å²	79	136.1 Å²	136.1	55%	0.552	80%	0.797	S	S	*	*				70.5	102.6	121.3	-47.6	0	0	0	0	122.1
111	S	33.1	Very low	35.1	Very low	110 Å²	110	138.6 Å²	138.6	77%	0.769	80%	0.803	S	S	*	*				49.8	120.3	120.2	57.4	0	0	0	0	121.7
112	E	36.8	Very low	35.8	Very low	197 Å²	197	139.2 Å²	139.2	92%	0.921	81%	0.805	S	S	*	*			trans	-151.2	133.9	139.3	-117.1	172.4	-166.4	0	0	111.8
113	T	32	Very low	35.7	Very low	126 Å²	126	139.2 Å²	139.2	77%	0.773	81%	0.805	S	S	*	*			trans	-92.5	136.7	-175.5	-54.8	0	0	0	0	109.7
114	T	37.3	Very low	35.9	Very low	135 Å²	135	141 Å²	141	83%	0.828	81%	0.807	S	S	*	*			trans	-145.6	110.5	158	-37.2	0	0	0	0	112.8
115	T	36.8	Very low	36	Very low	118 Å²	118	138.9 Å²	138.9	72%	0.724	80%	0.801	S	S	*	*			trans	-20.2	139.4	159.5	39	0	0	0	0	121
116	H	32.1	Very low	36	Very low	180 Å²	180	141.4 Å²	141.4	83%	0.833	81%	0.805	S	S	*	*			trans	-56.6	163.2	162.5	-68.7	-91.2	0	0	0	114.9
117	P	44.7	Very low	36.4	Very low	126 Å²	126	140 Å²	140	82%	0.818	80%	0.803	S	S	*	*			trans	-131.4	126.6	131.8	25.5	-8.1	0	0	0	113.5
118	S	32.6	Very low	36	Very low	112 Å²	112	143.8 Å²	143.8	78%	0.783	80%	0.801	S	S	*	*			trans	-72.4	143.7	164.5	-20	0	0	0	0	110.7
119	M	42.3	Very low	36.2	Very low	181 Å²	181	142.8 Å²	142.8	89%	0.892	80%	0.803	S	S	*	*			trans	-148	155	164.6	-92.6	-121.6	-84	0	0	110.7
120	P	40	Very low	36.4	Very low	109 Å²	109	138.7 Å²	138.7	71%	0.708	80%	0.795	S	S	*	*			trans	-108.8	155.5	-133.1	17.8	1.3	0	0	0	114.8
121	F	31.4	Very low	36.7	Very low	206 Å²	206	141.4 Å²	141.4	90%	0.904	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-65.5	131.9	165.1	-81.7	-89.4	0	0	0	111.7
122	P	47.4	Very low	37	Very low	113 Å²	113	143.8 Å²	143.8	73%	0.734	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-95.7	117.2	158.1	28.9	-18.2	0	0	0	110.4	S124	P122-S124 PolarHBondContact O-N 3.34Å
123	S	33.4	Very low	36.7	Very low	120 Å²	120	139 Å²	139	84%	0.839	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-63.8	125.2	161.1	-57.4	0	0	0	0	109.5
124	S	37.9	Very low	36.9	Very low	103 Å²	103	139.5 Å²	139.5	72%	0.72	80%	0.802	S	S	*	*			trans	-148.5	99.7	166.2	-72.1	0	0	0	0	110	P122	P122-S124 PolarHBondContact O-N 3.34Å
125	T	38.7	Very low	36.9	Very low	132 Å²	132	137.6 Å²	137.6	81%	0.81	79%	0.794	S	S	*	*			trans	32.8	104.4	137.1	46.2	0	0	0	0	118.6
126	L	32.4	Very low	36.6	Very low	168 Å²	168	137.2 Å²	137.2	88%	0.88	80%	0.796	S	S	*	*				39.5	91	124.8	-156.3	76.4	0	0	0	116.1
127	N	37.4	Very low	36.8	Very low	161 Å²	161	136.3 Å²	136.3	86%	0.861	79%	0.792	S	S	*	*			trans	-149.8	112.7	145.4	-102.5	-13.3	0	0	0	110.5	P129	N127-P129 WeakPolarHBondContact O-CD 3.31Å
128	R	30.4	Very low	36.2	Very low	232 Å²	232	136 Å²	136	88%	0.875	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-49.7	120.3	170.9	173.9	-176.7	177.8	-175.3	-0.2	111.4
129	P	35	Very low	36.1	Very low	125 Å²	125	136.7 Å²	136.7	81%	0.812	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-82.4	125.2	157.4	2.8	16.1	0	0	0	107.8	N127	N127-P129 WeakPolarHBondContact O-CD 3.31Å
130	A	39.7	Very low	35.8	Very low	79 Å²	79	134.6 Å²	134.6	65%	0.653	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-54.2	139.5	172.3	0	0	0	0	0	110.6	L132	A130-L132 PolarHBondContact O-N 3.5Å
131	V	38.5	Very low	35.3	Very low	137 Å²	137	135 Å²	135	83%	0.83	79%	0.79	S	S	*	*			trans	-39.6	115.4	160.5	175.9	0	0	0	0	107.9	S133	V131-S133 VanDerWaalsContact C-N 3.26Å; V131-S133 PolarHBondContact O-N 3.44Å
132	L	39.4	Very low	35.2	Very low	160 Å²	160	128.6 Å²	128.6	84%	0.838	78%	0.775	S	S	*	*			trans	-60.8	99.9	166.3	-78.9	165.7	0	0	0	106.4	A130 V134	A130-L132 PolarHBondContact O-N 3.5Å; L132-V134 VanDerWaalsContact C-N 3.34Å; L132-V134 PolarHBondContact O-N 2.92Å
133	S	31.9	Very low	34.5	Very low	95 Å²	95	131 Å²	131	66%	0.664	78%	0.782	S	S	*	*			trans	-49.7	102	157.8	47.2	0	0	0	0	107.3	V131 S135	V131-S133 VanDerWaalsContact C-N 3.26Å; V131-S133 PolarHBondContact O-N 3.44Å; S133-S135 PolarHBondContact O-N 3.44Å
134	V	36.4	Very low	34.4	Very low	137 Å²	137	132.9 Å²	132.9	83%	0.83	78%	0.777	S	S	*	*			trans	-61.7	99.7	156.4	172.6	0	0	0	0	104.5	L132 S136	L132-V134 VanDerWaalsContact C-N 3.34Å; L132-V134 PolarHBondContact O-N 2.92Å; V134-S136 PolarHBondContact O-N 3.1Å
135	S	36.1	Very low	34.4	Very low	95 Å²	95	133.1 Å²	133.1	66%	0.664	78%	0.777	S	S	*	*			trans	-51.5	107.2	169.3	-61.1	0	0	0	0	107.4	S133 E137	S133-S135 PolarHBondContact O-N 3.44Å; S135-E137 VanDerWaalsContact C-N 3.32Å; S135-E137 PolarHBondContact O-N 3.26Å
136	S	32.1	Very low	34.5	Very low	110 Å²	110	134.4 Å²	134.4	77%	0.769	78%	0.778	S	S	*	*			trans	-61	96.5	162.6	49.2	0	0	0	0	107.4	V134	V134-S136 PolarHBondContact O-N 3.1Å
137	E	36.2	Very low	35.5	Very low	161 Å²	161	131.8 Å²	131.8	75%	0.752	76%	0.761	S	S	*	*			trans	-68.3	123.8	161.9	-71.8	-159.1	142.8	0	0	108.2	S135 D139	S135-E137 VanDerWaalsContact C-N 3.32Å; S135-E137 PolarHBondContact O-N 3.26Å; E137-D139 PolarHBondContact O-N 3.44Å
138	P	31.6	Very low	36.5	Very low	121 Å²	121	126.9 Å²	126.9	79%	0.786	73%	0.734	S	S	*	*			trans	-91	71.8	-179	36.9	-30.3	0	0	0	108.8
139	D	31	Very low	38.3	Very low	125 Å²	125	121 Å²	121	67%	0.668	71%	0.712	S	S	*	*			trans	-119.3	109.4	-177.4	-86.8	-26.6	0	0	0	113.5	E137	E137-D139 PolarHBondContact O-N 3.44Å
140	N	35	Very low	40.7	Very low	137 Å²	137	115.5 Å²	115.5	73%	0.733	68%	0.676	S	S	*	*			trans	76.9	69.8	160.9	-60.6	-54.2	0	0	0	118.7	A142	N140-A142 PolarHBondContact O-N 3.21Å; N140-A142 VanDerWaalsContact O-N 3.11Å
141	A	29.8	Very low	43.2	Very low	117 Å²	117	115.9 Å²	115.9	97%	0.967	67%	0.667	S	S	*	*			trans	-73.8	70.3	145.7	0	0	0	0	0	110.4
142	A	29.9	Very low	45.8	Very low	72 Å²	72	109.4 Å²	109.4	60%	0.595	63%	0.628	S	S	*	*	S	Bend	trans	-157.1	122.3	165.7	0	0	0	0	0	107.8	N140	N140-A142 PolarHBondContact O-N 3.21Å; N140-A142 VanDerWaalsContact O-N 3.11Å
143	D	31.2	Very low	48.4	Very low	163 Å²	163	103.9 Å²	103.9	87%	0.872	60%	0.599	S	S	*	*			trans	85.1	48.4	-175.6	-60.6	-22.6	0	0	0	118	P145	D143-P145 VanDerWaalsContact O-CD 3.28Å; D143-P145 WeakPolarHBondContact O-CD 3.3Å
144	E	33.1	Very low	51.4	Low	160 Å²	160	99.5 Å²	99.5	75%	0.748	57%	0.568	S	S	*	*			trans	-79.7	107.6	150.3	-96.3	-89.4	148.6	0	0	107.7	L146	E144-L146 PolarHBondContact O-N 2.8Å; E144-L146 VanDerWaalsContact O-N 3.1Å
145	P	36.9	Very low	54	Low	108 Å²	108	97.6 Å²	97.6	70%	0.701	55%	0.553	S	S	*	*			trans	-67.2	115.5	176.7	26.9	-29.6	0	0	0	107.5	D143 E147	D143-P145 VanDerWaalsContact O-CD 3.28Å; D143-P145 WeakPolarHBondContact O-CD 3.3Å; P145-E147 PolarHBondContact O-N 3.38Å
146	L	40.9	Very low	56.7	Low	159 Å²	159	97.9 Å²	97.9	83%	0.832	54%	0.542	S	S	*	.			trans	-28.9	101.7	174.2	-72	166	0	0	0	110.2	E144 L148	E144-L146 PolarHBondContact O-N 2.8Å; E144-L146 VanDerWaalsContact O-N 3.1Å; L146-L148 PolarHBondContact O-N 3.46Å
147	E	52.4	Low	59.5	Low	113 Å²	113	95.9 Å²	95.9	53%	0.528	52%	0.519	S	S	.	.			trans	-57.5	105.4	-176.9	-74.5	-175.4	126.2	0	0	107.3	P145 R149	P145-E147 PolarHBondContact O-N 3.38Å; E147-R149 HydrophobicContact CB-CG 4.37Å; E147-R149 PolarHBondContact O-N 2.88Å; E147-R149 IonicContact OE1-CZ 2.79Å; E147-R149 IonicContact OE1-NH2 2.69Å; E147-R149 PolarHBondContact OE1-NH2 2.83Å; E147-R149 IonicContact OE2-CZ 3.72Å; E147-R149 IonicContact OE2-NE 3.79Å; E147-R149 IonicContact OE2-NH1 3.49Å; E147-R149 PolarHBondContact OE2-NH1 3.3Å; E147-R149 IonicContact OE2-NH2 3.25Å; E147-R149 PolarHBondContact OE2-NH2 3.26Å
148	L	58.5	Low	62.1	Low	58 Å²	58	91.3 Å²	91.3	30%	0.304	50%	0.497	S	S	.	.			trans	-71.2	70.2	176.7	-62	167.4	0	0	0	107.9	L146 I150 V180 L267	L146-L148 PolarHBondContact O-N 3.46Å; L148-I150 PolarHBondContact O-N 2.89Å; L148-V180 HydrophobicContact CB-CG1 4.24Å; L148-V180 HydrophobicContact CB-CG2 4.12Å; L148-V180 HydrophobicContact CD1-CG1 4.13Å; L148-V180 HydrophobicContact CD2-CB 4.19Å; L148-V180 HydrophobicContact CD2-CG1 3.97Å; L148-V180 HydrophobicContact CD2-CG2 3.82Å; L148-V180 HydrophobicContact CG-CG1 4.32Å; L148-L267 HydrophobicContact CB-CD2 4.15Å
149	R	68.8	Low	64.9	Low	110 Å²	110	91.1 Å²	91.1	42%	0.415	48%	0.484	S	S	.	.			trans	-75.1	112.2	178.4	-84.3	-169	173.7	111.3	19.5	109.2	E147 P177	E147-R149 HydrophobicContact CB-CG 4.37Å; E147-R149 PolarHBondContact O-N 2.88Å; E147-R149 IonicContact OE1-CZ 2.79Å; E147-R149 IonicContact OE1-NH2 2.69Å; E147-R149 PolarHBondContact OE1-NH2 2.83Å; E147-R149 IonicContact OE2-CZ 3.72Å; E147-R149 IonicContact OE2-NE 3.79Å; E147-R149 IonicContact OE2-NH1 3.49Å; E147-R149 PolarHBondContact OE2-NH1 3.3Å; E147-R149 IonicContact OE2-NH2 3.25Å; E147-R149 PolarHBondContact OE2-NH2 3.26Å; R149-P177 VanDerWaalsContact O-CD 3.23Å; R149-P177 WeakPolarHBondContact O-CD 3.26Å; R149-P177 WeakPolarHBondContact O-CG 3.36Å
150	I	86.6	Confident	67.7	Low	8 Å²	8	88.6 Å²	88.6	4%	0.041	47%	0.465	C	S	.	.			trans	-104.3	134.2	166.7	-58.2	-172.5	0	0	0	107.1	L148 I152 T174 K175 I176 V180 F183 L267	L148-I150 PolarHBondContact O-N 2.89Å; I150-I152 HydrophobicContact CG2-CG1 4.09Å; I150-T174 HydrophobicContact CG2-CG2 3.4Å; I150-T174 VanDerWaalsContact CG2-CG2 3.4Å; I150-K175 WeakPolarHBondContact CG2-O 3.4Å; I150-I176 HydrophobicContact CD1-CD1 4.46Å; I150-I176 HydrophobicContact CD1-CG1 4.33Å; I150-I176 HydrophobicContact CG1-CG1 4.48Å; I150-I176 HydrophobicContact CG2-CG1 4.02Å; I150-V180 HydrophobicContact CD1-CG1 4.37Å; I150-V180 HydrophobicContact CD1-CG2 4.38Å; I150-V180 HydrophobicContact CG1-CG2 4.18Å; I150-F183 HydrophobicContact CD1-CD2 3.99Å; I150-F183 HydrophobicContact CD1-CE1 4.15Å; I150-F183 HydrophobicContact CD1-CE2 3.37Å; I150-F183 HydrophobicContact CD1-CZ 3.46Å; I150-F183 VanDerWaalsContact CD1-CZ 3.46Å; I150-L267 HydrophobicContact CD1-CD1 3.73Å; I150-L267 HydrophobicContact CD1-CD2 4.4Å
151	N	90.8	Very high	70.1	Confident	87 Å²	87	84.5 Å²	84.5	47%	0.465	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	120.1	177	-66.9	-15.2	0	0	0	108.5	K175	N151-K175 HydrophobicContact CB-CB 4.41Å; N151-K175 PolarHBondContact N-O 2.96Å; N151-K175 PolarHBondContact O-N 3.26Å
152	I	93.9	Very high	72.5	Confident	1 Å²	1	87.3 Å²	87.3	1%	0.005	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	126	177.4	-52.5	-176.1	0	0	0	108.6	I150 V172 V173 T174 I257 R258 A261 F272 I276	I150-I152 HydrophobicContact CG2-CG1 4.09Å; I152-V172 HydrophobicContact CG2-CG1 3.6Å; I152-V173 WeakPolarHBondContact CA-O 3.36Å; I152-T174 HydrophobicContact CG1-CG2 4.15Å; I152-I257 HydrophobicContact CB-CG2 4.21Å; I152-I257 HydrophobicContact CD1-CG1 4.04Å; I152-I257 HydrophobicContact CG2-CG1 4.18Å; I152-I257 HydrophobicContact CG2-CG2 3.58Å; I152-R258 HydrophobicContact CB-CG 4.45Å; I152-R258 VanDerWaalsContact O-CG 3.28Å; I152-R258 WeakPolarHBondContact O-CG 3.35Å; I152-R258 PolarHBondContact O-NE 3Å; I152-R258 PolarHBondContact O-NH2 3.48Å; I152-A261 HydrophobicContact CD1-CB 3.63Å; I152-A261 HydrophobicContact CG1-CB 4.37Å; I152-F272 HydrophobicContact CD1-CZ 4.16Å; I152-I276 HydrophobicContact CD1-CD1 4.47Å; I152-I276 HydrophobicContact CD1-CG2 4.16Å
153	D	94.5	Very high	74.8	Confident	45 Å²	45	87.1 Å²	87.1	24%	0.241	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	146.6	177.9	-56.5	-41.3	0	0	0	109.8	V173 K175 E254 R258	D153-V173 PolarHBondContact N-O 3.23Å; D153-V173 PolarHBondContact O-N 3.16Å; D153-K175 IonicContact OD2-NZ 3.3Å; D153-K175 PolarHBondContact OD2-NZ 3.12Å; D153-E254 WeakPolarHBondContact CA-OE1 3.44Å; D153-R258 IonicContact OD1-CZ 2.78Å; D153-R258 IonicContact OD1-NE 2.6Å; D153-R258 IonicContact OD1-NH2 2.66Å; D153-R258 PolarHBondContact OD1-NH2 2.92Å
154	I	94.8	Very high	77.1	Confident	3 Å²	3	86.9 Å²	86.9	2%	0.015	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	96.4	165.8	-58.9	-174.1	0	0	0	107.8	Y170 K171 V172 F197 R250 L253 E254	I154-Y170 HydrophobicContact CG2-CD1 4.09Å; I154-Y170 HydrophobicContact CG2-CG 4.43Å; I154-K171 WeakPolarHBondContact CA-O 3.28Å; I154-V172 HydrophobicContact CG1-CG2 4.44Å; I154-F197 HydrophobicContact CD1-CE1 4.35Å; I154-F197 HydrophobicContact CD1-CZ 4.02Å; I154-R250 HydrophobicContact CB-CG 4.05Å; I154-R250 HydrophobicContact CG2-CG 3.52Å; I154-R250 WeakPolarHBondContact O-CD 3.49Å; I154-R250 PolarHBondContact O-NH1 2.96Å; I154-L253 HydrophobicContact CD1-CB 3.48Å; I154-L253 VanDerWaalsContact CD1-CB 3.48Å; I154-E254 HydrophobicContact CB-CB 4.15Å; I154-E254 HydrophobicContact CB-CG 4.36Å; I154-E254 HydrophobicContact CD1-CB 3.96Å; I154-E254 HydrophobicContact CG1-CB 3.9Å; I154-E254 HydrophobicContact CG1-CG 4.19Å; I154-E254 PolarHBondContact N-OE1 2.94Å
155	D	90.6	Very high	79.3	Confident	96 Å²	96	82.9 Å²	82.9	51%	0.513	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	-49.3	-168.9	178.9	43.4	0	0	0	112.5	K171 V173	D155-K171 HydrophobicContact CB-CD 4.23Å; D155-K171 PolarHBondContact N-O 2.62Å; D155-K171 VanDerWaalsContact N-O 3.12Å; D155-K171 IonicContact OD2-NZ 2.88Å; D155-K171 PolarHBondContact OD2-NZ 3.43Å; D155-V173 HydrophobicContact CB-CG2 3.95Å
156	K	91.5	Very high	81.5	Confident	101 Å²	101	79.1 Å²	79.1	44%	0.439	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	166.2	179.3	62	178.2	178.4	168.4	0	112.2	K171 W191	K156-K171 HydrophobicContact CG-CB 4.04Å; K156-K171 HydrophobicContact CG-CD 4.04Å; K156-K171 PolarHBondContact O-N 3.34Å; K156-W191 HydrophobicContact CD-CH2 4.43Å; K156-W191 HydrophobicContact CG-CH2 4.19Å
157	Y	92.5	Very high	83.7	Confident	69 Å²	69	75.8 Å²	75.8	27%	0.271	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	149.1	169.9	51.5	-97.6	0	0	0	110.6	M168 V169 Y170 L246 R250	Y157-M168 HydrophobicContact CD2-CE 3.57Å; Y157-M168 HydrophobicContact CE2-CE 4.43Å; Y157-M168 HydrophobicContact CG-CE 4.32Å; Y157-V169 CarbonylContact C-O 3.53Å; Y157-V169 WeakPolarHBondContact CA-O 3.3Å; Y157-V169 WeakPolarHBondContact CB-O 3.13Å; Y157-Y170 HydrophobicContact CD1-CE1 4.36Å; Y157-Y170 HydrophobicContact CG-CE1 4.3Å; Y157-L246 HydrophobicContact CD2-CB 4.4Å; Y157-L246 HydrophobicContact CD2-CD1 4.3Å; Y157-L246 HydrophobicContact CE1-CB 4.31Å; Y157-L246 HydrophobicContact CE2-CB 3.8Å; Y157-L246 HydrophobicContact CE2-CD1 3.85Å; Y157-L246 HydrophobicContact CE2-CG 4.43Å; Y157-R250 HydrophobicContact CD1-CB 4.07Å; Y157-R250 HydrophobicContact CD1-CG 4.09Å; Y157-R250 HydrophobicContact CE1-CB 4.29Å
158	E	90.7	Very high	85.5	Confident	65 Å²	65	72 Å²	72	30%	0.304	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	150	176.1	67.3	-172.6	-165.2	0	0	110.2	R160 M168 V169 W191	E158-R160 HydrophobicContact CG-CG 4.31Å; E158-R160 IonicContact OE1-CZ 2.76Å; E158-R160 VanDerWaalsContact OE1-CZ 3.23Å; E158-R160 IonicContact OE1-NE 3.33Å; E158-R160 PolarHBondContact OE1-NE 2.89Å; E158-R160 IonicContact OE1-NH2 3.95Å; E158-R160 PolarHBondContact OE1-NH2 3.4Å; E158-M168 VanDerWaalsContact C-CE 3.45Å; E158-M168 WeakPolarHBondContact O-CA 3.5Å; E158-V169 HydrophobicContact CG-CG2 3.44Å; E158-V169 VanDerWaalsContact CG-CG2 3.44Å; E158-V169 PolarHBondContact N-O 3.32Å; E158-V169 PolarHBondContact O-N 3.01Å; E158-W191 HydrophobicContact CG-CE3 4.39Å; E158-W191 HydrophobicContact CG-CH2 3.96Å; E158-W191 HydrophobicContact CG-CZ3 3.62Å; E158-W191 WeakPolarHBondContact OE2-CH2 3.19Å
159	K	90	Very high	87.1	Confident	117 Å²	117	69.5 Å²	69.5	51%	0.509	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	124.8	172.2	-174.7	178.2	178.4	178.2	0	108.6	A166 M168 V236	K159-A166 HydrophobicContact CD-CB 4.32Å; K159-A166 HydrophobicContact CG-CB 4.18Å; K159-M168 HydrophobicContact CB-CE 4.37Å; K159-M168 HydrophobicContact CB-SD 3.67Å; K159-M168 HydrophobicContact CG-SD 4.13Å; K159-V236 HydrophobicContact CD-CG2 3.92Å
160	R	88.7	Confident	88.3	Confident	72 Å²	72	64.2 Å²	64.2	27%	0.272	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	144.6	171.4	-71.9	-168.6	-178.7	175.7	7.7	110.8	E158 A166 Y167 V169	E158-R160 HydrophobicContact CG-CG 4.31Å; E158-R160 IonicContact OE1-CZ 2.76Å; E158-R160 VanDerWaalsContact OE1-CZ 3.23Å; E158-R160 IonicContact OE1-NE 3.33Å; E158-R160 PolarHBondContact OE1-NE 2.89Å; E158-R160 IonicContact OE1-NH2 3.95Å; E158-R160 PolarHBondContact OE1-NH2 3.4Å; R160-A166 CarbonylContact O-C 3.58Å; R160-A166 VanDerWaalsContact O-CA 3.25Å; R160-A166 WeakPolarHBondContact O-CA 3.44Å; R160-Y167 HydrophobicContact CB-CE1 4.47Å; R160-Y167 HydrophobicContact CB-CE2 4.22Å; R160-Y167 PolarHBondContact N-O 2.96Å; R160-Y167 PolarHBondContact O-N 3.42Å; R160-V169 HydrophobicContact CG-CG1 4.39Å; R160-V169 HydrophobicContact CG-CG2 3.81Å
161	G	85.4	Confident	88.8	Confident	50 Å²	50	66 Å²	66	52%	0.515	36%	0.364	S	S	.	.	S	Bend	trans	84	172.1	-178.4	0	0	0	0	0	113.9	A166	G161-A166 WeakPolarHBondContact O-CB 3.42Å
162	E	80.6	Confident	89	Confident	177 Å²	177	61.9 Å²	61.9	83%	0.827	34%	0.341	S	S	*	.	S	Bend	trans	-122.3	153.1	-176.1	-65.9	-176.8	174.4	0	0	111.5	A165	E162-A165 PolarHBondContact O-N 3.05Å
163	G	79.5	Confident	89.1	Confident	67 Å²	67	62.2 Å²	62.2	69%	0.691	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	61	-138.2	176.5	0	0	0	0	0	113.9	A165 A166	G163-A165 PolarHBondContact O-N 3.26Å; G163-A166 WeakPolarHBondContact O-CB 3.41Å; G163-A166 PolarHBondContact O-N 3.2Å
164	V	77.9	Confident	89.1	Confident	158 Å²	158	60.1 Å²	60.1	96%	0.958	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-69.5	-21.2	-177.2	-174.8	0	0	0	0	112.3	A166	V164-A166 VanDerWaalsContact C-N 3.33Å
165	A	80	Confident	89	Confident	77 Å²	77	64.3 Å²	64.3	64%	0.636	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-88.1	0.9	-179.5	0	0	0	0	0	113.4	E162 G163 Y167	E162-A165 PolarHBondContact O-N 3.05Å; G163-A165 PolarHBondContact O-N 3.26Å; A165-Y167 WeakPolarHBondContact O-CD1 3.35Å
166	A	83.7	Confident	88.8	Confident	28 Å²	28	60.5 Å²	60.5	23%	0.231	33%	0.33	C	S	.	.			trans	-71.3	140.4	-178.7	0	0	0	0	0	112.3	K159 R160 G161 G163 V164	K159-A166 HydrophobicContact CD-CB 4.32Å; K159-A166 HydrophobicContact CG-CB 4.18Å; R160-A166 CarbonylContact O-C 3.58Å; R160-A166 VanDerWaalsContact O-CA 3.25Å; R160-A166 WeakPolarHBondContact O-CA 3.44Å; G161-A166 WeakPolarHBondContact O-CB 3.42Å; G163-A166 WeakPolarHBondContact O-CB 3.41Å; G163-A166 PolarHBondContact O-N 3.2Å; V164-A166 VanDerWaalsContact C-N 3.33Å
167	Y	86.7	Confident	88.2	Confident	89 Å²	89	59.7 Å²	59.7	35%	0.349	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	158.2	179.2	59.3	-84.5	0	0	0	111.2	R160 A165 V169 R193	R160-Y167 HydrophobicContact CB-CE1 4.47Å; R160-Y167 HydrophobicContact CB-CE2 4.22Å; R160-Y167 PolarHBondContact N-O 2.96Å; R160-Y167 PolarHBondContact O-N 3.42Å; A165-Y167 WeakPolarHBondContact O-CD1 3.35Å; Y167-V169 HydrophobicContact CD2-CG1 3.68Å; Y167-V169 HydrophobicContact CE2-CG1 3.35Å; Y167-R193 HydrophobicContact CD2-CB 3.97Å; Y167-R193 HydrophobicContact CE2-CB 4.36Å
168	M	90	Very high	87.3	Confident	34 Å²	34	60.6 Å²	60.6	17%	0.167	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	137.6	174.4	-60.2	-55.7	-61.6	0	0	110.5	Y157 E158 K159 Y170 L246	Y157-M168 HydrophobicContact CD2-CE 3.57Å; Y157-M168 HydrophobicContact CE2-CE 4.43Å; Y157-M168 HydrophobicContact CG-CE 4.32Å; E158-M168 VanDerWaalsContact C-CE 3.45Å; E158-M168 WeakPolarHBondContact O-CA 3.5Å; K159-M168 HydrophobicContact CB-CE 4.37Å; K159-M168 HydrophobicContact CB-SD 3.67Å; K159-M168 HydrophobicContact CG-SD 4.13Å; M168-Y170 HydrophobicContact CB-CE2 4.36Å; M168-L246 HydrophobicContact CE-CD1 4.09Å; M168-L246 HydrophobicContact CE-CD2 4.41Å; M168-L246 HydrophobicContact CG-CD2 3.86Å
169	V	92.3	Very high	86.3	Confident	5 Å²	5	63.3 Å²	63.3	3%	0.03	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	150.1	168	-62.9	0	0	0	0	110.4	Y157 E158 R160 Y167 W191 R192 R193	Y157-V169 CarbonylContact C-O 3.53Å; Y157-V169 WeakPolarHBondContact CA-O 3.3Å; Y157-V169 WeakPolarHBondContact CB-O 3.13Å; E158-V169 HydrophobicContact CG-CG2 3.44Å; E158-V169 VanDerWaalsContact CG-CG2 3.44Å; E158-V169 PolarHBondContact N-O 3.32Å; E158-V169 PolarHBondContact O-N 3.01Å; R160-V169 HydrophobicContact CG-CG1 4.39Å; R160-V169 HydrophobicContact CG-CG2 3.81Å; Y167-V169 HydrophobicContact CD2-CG1 3.68Å; Y167-V169 HydrophobicContact CE2-CG1 3.35Å; V169-W191 HydrophobicContact CB-CE3 4.12Å; V169-W191 HydrophobicContact CG2-CD2 4.48Å; V169-W191 HydrophobicContact CG2-CE3 3.54Å; V169-W191 HydrophobicContact CG2-CZ3 3.89Å; V169-R192 CarbonylContact C-O 3.59Å; V169-R192 WeakPolarHBondContact CA-O 3.26Å; V169-R193 HydrophobicContact CG1-CB 4.4Å
170	Y	94.6	Very high	85.5	Confident	0 Å²	0	58 Å²	58	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	130.7	-176.8	-60.2	-86.3	0	0	0	108.6	I154 Y157 M168 V172 W191 R192 F194 F197 R249 R250 L253	I154-Y170 HydrophobicContact CG2-CD1 4.09Å; I154-Y170 HydrophobicContact CG2-CG 4.43Å; Y157-Y170 HydrophobicContact CD1-CE1 4.36Å; Y157-Y170 HydrophobicContact CG-CE1 4.3Å; M168-Y170 HydrophobicContact CB-CE2 4.36Å; Y170-V172 PolarHBondContact O-N 2.85Å; Y170-W191 WeakPolarHBondContact O-CA 3.46Å; Y170-R192 WeakPolarHBondContact CD2-O 3.3Å; Y170-R192 PolarHBondContact N-O 2.95Å; Y170-R192 PolarHBondContact O-N 3.07Å; Y170-F194 HydrophobicContact CE2-CB 4.23Å; Y170-F197 HydrophobicContact CD2-CE2 4.37Å; Y170-R249 WeakPolarHBondContact OH-CD 3.49Å; Y170-R249 WeakPolarHBondContact OH-CG 3.33Å; Y170-R250 HydrophobicContact CD1-CB 4.42Å; Y170-R250 HydrophobicContact CD1-CG 4.35Å; Y170-R250 HydrophobicContact CE1-CB 4.22Å; Y170-L253 HydrophobicContact CD1-CD1 3.91Å; Y170-L253 HydrophobicContact CD2-CD1 3.64Å; Y170-L253 HydrophobicContact CE1-CD1 3.81Å; Y170-L253 HydrophobicContact CE2-CD1 3.54Å; Y170-L253 HydrophobicContact CG-CD1 3.84Å
171	K	95.4	Very high	84.8	Confident	45 Å²	45	59.4 Å²	59.4	20%	0.196	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	100.1	176.5	-173.2	-174.6	167.1	-155.7	0	109	I154 D155 K156 V173 V189 W191	I154-K171 WeakPolarHBondContact CA-O 3.28Å; D155-K171 HydrophobicContact CB-CD 4.23Å; D155-K171 PolarHBondContact N-O 2.62Å; D155-K171 VanDerWaalsContact N-O 3.12Å; D155-K171 IonicContact OD2-NZ 2.88Å; D155-K171 PolarHBondContact OD2-NZ 3.43Å; K156-K171 HydrophobicContact CG-CB 4.04Å; K156-K171 HydrophobicContact CG-CD 4.04Å; K156-K171 PolarHBondContact O-N 3.34Å; K171-V173 HydrophobicContact CD-CG2 4.33Å; K171-V173 HydrophobicContact CG-CG2 4.11Å; K171-V189 HydrophobicContact CD-CG1 4.26Å; K171-V189 HydrophobicContact CG-CG1 3.77Å; K171-W191 HydrophobicContact CB-CD2 4.16Å; K171-W191 HydrophobicContact CB-CE3 3.87Å; K171-W191 HydrophobicContact CB-CH2 3.8Å; K171-W191 HydrophobicContact CB-CZ2 4.02Å; K171-W191 HydrophobicContact CB-CZ3 3.68Å; K171-W191 HydrophobicContact CD-CH2 4.31Å; K171-W191 HydrophobicContact CD-CZ2 4Å; K171-W191 HydrophobicContact CG-CD2 4.43Å; K171-W191 HydrophobicContact CG-CH2 4.3Å; K171-W191 HydrophobicContact CG-CZ2 4.02Å
172	V	96.2	Very high	84.4	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	115.4	175.7	-174.7	0	0	0	0	108.4	I152 I154 Y170 V189 A190 R192 F197	I152-V172 HydrophobicContact CG2-CG1 3.6Å; I154-V172 HydrophobicContact CG1-CG2 4.44Å; Y170-V172 PolarHBondContact O-N 2.85Å; V172-V189 WeakPolarHBondContact O-CA 3.33Å; V172-A190 PolarHBondContact N-O 3.05Å; V172-A190 PolarHBondContact O-N 2.83Å; V172-R192 HydrophobicContact CG2-CB 4.26Å; V172-R192 HydrophobicContact CG2-CG 4.05Å; V172-F197 HydrophobicContact CG2-CE1 4.49Å; V172-F197 HydrophobicContact CG2-CZ 3.73Å
173	V	95.3	Very high	84.5	Confident	9 Å²	9	52.7 Å²	52.7	6%	0.055	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	117.6	178.8	-177.3	0	0	0	0	108.3	I152 D153 D155 K171 K175 E187 Y188 V189	I152-V173 WeakPolarHBondContact CA-O 3.36Å; D153-V173 PolarHBondContact N-O 3.23Å; D153-V173 PolarHBondContact O-N 3.16Å; D155-V173 HydrophobicContact CB-CG2 3.95Å; K171-V173 HydrophobicContact CD-CG2 4.33Å; K171-V173 HydrophobicContact CG-CG2 4.11Å; V173-K175 HydrophobicContact CG1-CG 4.3Å; V173-E187 HydrophobicContact CG1-CG 4.2Å; V173-Y188 WeakPolarHBondContact CA-O 3.42Å; V173-V189 HydrophobicContact CG2-CG2 4.41Å
174	T	94.2	Very high	84.6	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	112.9	-178.2	-58.9	0	0	0	0	108.9	I150 I152 I176 E187 Y188 I276	I150-T174 HydrophobicContact CG2-CG2 3.4Å; I150-T174 VanDerWaalsContact CG2-CG2 3.4Å; I152-T174 HydrophobicContact CG1-CG2 4.15Å; T174-I176 HydrophobicContact CG2-CG1 4.25Å; T174-E187 CarbonylContact O-C 3.57Å; T174-E187 VanDerWaalsContact O-CA 3.27Å; T174-E187 WeakPolarHBondContact O-CA 3.2Å; T174-Y188 PolarHBondContact N-O 3.47Å; T174-Y188 PolarHBondContact O-N 3.36Å; T174-I276 HydrophobicContact CG2-CD1 4.23Å
175	K	92.2	Very high	85	Confident	92 Å²	92	52 Å²	52	40%	0.4	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	128.8	179.4	-65.2	170.4	-173.2	152	0	110	I150 N151 D153 V173 P177 E187	I150-K175 WeakPolarHBondContact CG2-O 3.4Å; N151-K175 HydrophobicContact CB-CB 4.41Å; N151-K175 PolarHBondContact N-O 2.96Å; N151-K175 PolarHBondContact O-N 3.26Å; D153-K175 IonicContact OD2-NZ 3.3Å; D153-K175 PolarHBondContact OD2-NZ 3.12Å; V173-K175 HydrophobicContact CG1-CG 4.3Å; K175-P177 WeakPolarHBondContact O-CD 3.41Å; K175-E187 HydrophobicContact CG-CG 4.39Å
176	I	87.9	Confident	85.4	Confident	15 Å²	15	57 Å²	57	8%	0.077	33%	0.331	C	S	.	.			trans	-115.7	98.3	-172.3	-58.5	179.8	0	0	0	108.2	I150 T174 S178 V180 F183 K186 Y188	I150-I176 HydrophobicContact CD1-CD1 4.46Å; I150-I176 HydrophobicContact CD1-CG1 4.33Å; I150-I176 HydrophobicContact CG1-CG1 4.48Å; I150-I176 HydrophobicContact CG2-CG1 4.02Å; T174-I176 HydrophobicContact CG2-CG1 4.25Å; I176-S178 VanDerWaalsContact C-N 3.34Å; I176-S178 WeakPolarHBondContact CG2-O 3.31Å; I176-S178 PolarHBondContact O-N 3.05Å; I176-V180 HydrophobicContact CG2-CB 4.38Å; I176-V180 HydrophobicContact CG2-CG2 4.1Å; I176-F183 HydrophobicContact CD1-CB 3.34Å; I176-F183 HydrophobicContact CD1-CD1 3.27Å; I176-F183 HydrophobicContact CD1-CD2 4.12Å; I176-F183 HydrophobicContact CD1-CE1 4.04Å; I176-F183 HydrophobicContact CD1-CG 3.3Å; I176-K186 PolarHBondContact N-O 3.13Å; I176-Y188 HydrophobicContact CD1-CD2 3.94Å; I176-Y188 HydrophobicContact CD1-CE2 3.71Å
177	P	78.3	Confident	85.8	Confident	85 Å²	85	60.5 Å²	60.5	55%	0.552	34%	0.343	S	S	*	.	S	Bend	trans	-73.3	-24.8	-173	27.2	-33.7	0	0	0	113.4	R149 K175	R149-P177 VanDerWaalsContact O-CD 3.23Å; R149-P177 WeakPolarHBondContact O-CD 3.26Å; R149-P177 WeakPolarHBondContact O-CG 3.36Å; K175-P177 WeakPolarHBondContact O-CD 3.41Å
178	S	73.3	Confident	86.1	Confident	87 Å²	87	56.9 Å²	56.9	61%	0.608	33%	0.328	S	S	*	.	S	Bend	trans	-133.6	156.2	-178.4	-71	0	0	0	0	110.8	I176 V180	I176-S178 VanDerWaalsContact C-N 3.34Å; I176-S178 WeakPolarHBondContact CG2-O 3.31Å; I176-S178 PolarHBondContact O-N 3.05Å; S178-V180 VanDerWaalsContact C-N 3.32Å; S178-V180 WeakPolarHBondContact O-CG2 3.45Å; S178-V180 PolarHBondContact O-N 3.23Å
179	S	70.7	Confident	86.3	Confident	123 Å²	123	57.2 Å²	57.2	86%	0.86	33%	0.333	S	S	*	.			trans	-64.3	88.3	180	-179.6	0	0	0	0	111.3
180	V	73	Confident	86.4	Confident	5 Å²	5	57 Å²	57	3%	0.03	33%	0.331	C	S	.	.			trans	-82.2	126.9	174.1	178.2	0	0	0	0	108.8	L148 I150 I176 S178 G182 F183	L148-V180 HydrophobicContact CB-CG1 4.24Å; L148-V180 HydrophobicContact CB-CG2 4.12Å; L148-V180 HydrophobicContact CD1-CG1 4.13Å; L148-V180 HydrophobicContact CD2-CB 4.19Å; L148-V180 HydrophobicContact CD2-CG1 3.97Å; L148-V180 HydrophobicContact CD2-CG2 3.82Å; L148-V180 HydrophobicContact CG-CG1 4.32Å; I150-V180 HydrophobicContact CD1-CG1 4.37Å; I150-V180 HydrophobicContact CD1-CG2 4.38Å; I150-V180 HydrophobicContact CG1-CG2 4.18Å; I176-V180 HydrophobicContact CG2-CB 4.38Å; I176-V180 HydrophobicContact CG2-CG2 4.1Å; S178-V180 VanDerWaalsContact C-N 3.32Å; S178-V180 WeakPolarHBondContact O-CG2 3.45Å; S178-V180 PolarHBondContact O-N 3.23Å; V180-G182 PolarHBondContact O-N 3.46Å; V180-F183 HydrophobicContact CB-CD2 3.79Å; V180-F183 HydrophobicContact CB-CE2 4.33Å; V180-F183 HydrophobicContact CG1-CD2 3.61Å; V180-F183 HydrophobicContact CG1-CE2 3.73Å; V180-F183 PolarHBondContact O-N 2.87Å
181	P	74.2	Confident	86.4	Confident	101 Å²	101	59.9 Å²	59.9	66%	0.656	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	129.3	174.7	-24.7	33.8	0	0	0	111.7
182	G	76	Confident	86.3	Confident	61 Å²	61	57.7 Å²	57.7	63%	0.629	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	104.7	-10.7	-177.9	0	0	0	0	0	114.7	V180	V180-G182 PolarHBondContact O-N 3.46Å
183	F	82.3	Confident	86.1	Confident	25 Å²	25	60 Å²	60	11%	0.11	34%	0.341	C	S	.	.			trans	-116.4	132.8	178.5	-60	-88.1	0	0	0	111.6	I150 I176 V180 Y188 L267 Q273 I276 T277	I150-F183 HydrophobicContact CD1-CD2 3.99Å; I150-F183 HydrophobicContact CD1-CE1 4.15Å; I150-F183 HydrophobicContact CD1-CE2 3.37Å; I150-F183 HydrophobicContact CD1-CZ 3.46Å; I150-F183 VanDerWaalsContact CD1-CZ 3.46Å; I176-F183 HydrophobicContact CD1-CB 3.34Å; I176-F183 HydrophobicContact CD1-CD1 3.27Å; I176-F183 HydrophobicContact CD1-CD2 4.12Å; I176-F183 HydrophobicContact CD1-CE1 4.04Å; I176-F183 HydrophobicContact CD1-CG 3.3Å; V180-F183 HydrophobicContact CB-CD2 3.79Å; V180-F183 HydrophobicContact CB-CE2 4.33Å; V180-F183 HydrophobicContact CG1-CD2 3.61Å; V180-F183 HydrophobicContact CG1-CE2 3.73Å; V180-F183 PolarHBondContact O-N 2.87Å; F183-Y188 HydrophobicContact CB-CE2 4.26Å; F183-Y188 HydrophobicContact CD1-CD2 4.46Å; F183-Y188 AromaticContact CD1-CE2 3.89Å; F183-Y188 HydrophobicContact CD1-CE2 3.89Å; F183-L267 HydrophobicContact CE2-CD1 4.39Å; F183-L267 HydrophobicContact CZ-CD1 4.15Å; F183-Q273 HydrophobicContact CZ-CG 4.26Å; F183-I276 HydrophobicContact CE1-CD1 3.65Å; F183-I276 HydrophobicContact CE1-CG1 4.18Å; F183-I276 HydrophobicContact CZ-CD1 3.82Å; F183-T277 HydrophobicContact CD1-CG2 3.71Å; F183-T277 HydrophobicContact CE1-CG2 3.7Å
184	S	83.2	Confident	85.9	Confident	112 Å²	112	60.9 Å²	60.9	78%	0.783	34%	0.344	S	S	*	.			trans	-103.2	-29.4	-177.2	58.1	0	0	0	0	113.8	Y188	S184-Y188 PolarHBondContact N-OH 3.49Å; S184-Y188 PolarHBondContact OG-OH 2.75Å
185	K	86.3	Confident	85.7	Confident	98 Å²	98	61.9 Å²	61.9	43%	0.426	35%	0.352	S	S	.	.	S	Bend	trans	-102.3	154.8	178.5	-54.6	-175.9	-175.6	-178.5	0	110.3	E187 Y188 E279	K185-E187 VanDerWaalsContact C-N 3.31Å; K185-E187 WeakPolarHBondContact CB-O 3.33Å; K185-Y188 HydrophobicContact CB-CD1 4.43Å; K185-Y188 HydrophobicContact CB-CD2 4.29Å; K185-Y188 HydrophobicContact CB-CE1 3.93Å; K185-Y188 HydrophobicContact CB-CE2 3.76Å; K185-Y188 HydrophobicContact CD-CD1 4.06Å; K185-Y188 HydrophobicContact CD-CE1 3.77Å; K185-Y188 HydrophobicContact CG-CD1 4.5Å; K185-Y188 HydrophobicContact CG-CE1 3.82Å; K185-Y188 PolarHBondContact N-OH 3.38Å; K185-Y188 WeakPolarHBondContact O-CE2 3.12Å; K185-E279 IonicContact NZ-OE1 2.91Å; K185-E279 PolarHBondContact NZ-OE1 3Å; K185-E279 IonicContact NZ-OE2 2.76Å
186	K	87.7	Confident	85.7	Confident	184 Å²	184	58.3 Å²	58.3	80%	0.8	34%	0.337	S	S	*	.	S	Bend	trans	-75.1	-24.4	171.6	-66.1	-173.3	178.2	-175.5	0	112.7	I176	I176-K186 PolarHBondContact N-O 3.13Å
187	E	91.9	Very high	86	Confident	101 Å²	101	57.6 Å²	57.6	47%	0.472	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	137.9	-179.5	-171.1	176.3	147.4	0	0	109.9	V173 T174 K175 K185	V173-E187 HydrophobicContact CG1-CG 4.2Å; T174-E187 CarbonylContact O-C 3.57Å; T174-E187 VanDerWaalsContact O-CA 3.27Å; T174-E187 WeakPolarHBondContact O-CA 3.2Å; K175-E187 HydrophobicContact CG-CG 4.39Å; K185-E187 VanDerWaalsContact C-N 3.31Å; K185-E187 WeakPolarHBondContact CB-O 3.33Å
188	Y	93.4	Very high	86.7	Confident	12 Å²	12	55.4 Å²	55.4	5%	0.047	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	141.7	170.8	-64.5	-91.8	0	0	0	109.7	V173 T174 I176 F183 S184 K185 I276 T277	V173-Y188 WeakPolarHBondContact CA-O 3.42Å; T174-Y188 PolarHBondContact N-O 3.47Å; T174-Y188 PolarHBondContact O-N 3.36Å; I176-Y188 HydrophobicContact CD1-CD2 3.94Å; I176-Y188 HydrophobicContact CD1-CE2 3.71Å; F183-Y188 HydrophobicContact CB-CE2 4.26Å; F183-Y188 HydrophobicContact CD1-CD2 4.46Å; F183-Y188 AromaticContact CD1-CE2 3.89Å; F183-Y188 HydrophobicContact CD1-CE2 3.89Å; S184-Y188 PolarHBondContact N-OH 3.49Å; S184-Y188 PolarHBondContact OG-OH 2.75Å; K185-Y188 HydrophobicContact CB-CD1 4.43Å; K185-Y188 HydrophobicContact CB-CD2 4.29Å; K185-Y188 HydrophobicContact CB-CE1 3.93Å; K185-Y188 HydrophobicContact CB-CE2 3.76Å; K185-Y188 HydrophobicContact CD-CD1 4.06Å; K185-Y188 HydrophobicContact CD-CE1 3.77Å; K185-Y188 HydrophobicContact CG-CD1 4.5Å; K185-Y188 HydrophobicContact CG-CE1 3.82Å; K185-Y188 PolarHBondContact N-OH 3.38Å; K185-Y188 WeakPolarHBondContact O-CE2 3.12Å; Y188-I276 WeakPolarHBondContact CB-O 3.4Å; Y188-T277 HydrophobicContact CD1-CG2 3.98Å; Y188-T277 WeakPolarHBondContact CD1-O 3.34Å; Y188-T277 HydrophobicContact CD2-CG2 4.08Å; Y188-T277 HydrophobicContact CE1-CG2 3.87Å; Y188-T277 HydrophobicContact CE2-CG2 3.99Å; Y188-T277 HydrophobicContact CG-CG2 4.07Å
189	V	93.8	Very high	87.5	Confident	42 Å²	42	51.9 Å²	51.9	26%	0.255	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	115.8	175.7	-179.2	0	0	0	0	108.4	K171 V172 V173	K171-V189 HydrophobicContact CD-CG1 4.26Å; K171-V189 HydrophobicContact CG-CG1 3.77Å; V172-V189 WeakPolarHBondContact O-CA 3.33Å; V173-V189 HydrophobicContact CG2-CG2 4.41Å
190	A	93.9	Very high	88.7	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	135.7	178.9	0	0	0	0	0	110.5	V172 R192	V172-A190 PolarHBondContact N-O 3.05Å; V172-A190 PolarHBondContact O-N 2.83Å; A190-R192 HydrophobicContact CB-CG 4.46Å
191	W	94.4	Very high	89.7	Confident	60 Å²	60	46.9 Å²	46.9	23%	0.227	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	123.3	172	-70.2	93.7	0	0	0	109.6	K156 E158 V169 Y170 K171	K156-W191 HydrophobicContact CD-CH2 4.43Å; K156-W191 HydrophobicContact CG-CH2 4.19Å; E158-W191 HydrophobicContact CG-CE3 4.39Å; E158-W191 HydrophobicContact CG-CH2 3.96Å; E158-W191 HydrophobicContact CG-CZ3 3.62Å; E158-W191 WeakPolarHBondContact OE2-CH2 3.19Å; V169-W191 HydrophobicContact CB-CE3 4.12Å; V169-W191 HydrophobicContact CG2-CD2 4.48Å; V169-W191 HydrophobicContact CG2-CE3 3.54Å; V169-W191 HydrophobicContact CG2-CZ3 3.89Å; Y170-W191 WeakPolarHBondContact O-CA 3.46Å; K171-W191 HydrophobicContact CB-CD2 4.16Å; K171-W191 HydrophobicContact CB-CE3 3.87Å; K171-W191 HydrophobicContact CB-CH2 3.8Å; K171-W191 HydrophobicContact CB-CZ2 4.02Å; K171-W191 HydrophobicContact CB-CZ3 3.68Å; K171-W191 HydrophobicContact CD-CH2 4.31Å; K171-W191 HydrophobicContact CD-CZ2 4Å; K171-W191 HydrophobicContact CG-CD2 4.43Å; K171-W191 HydrophobicContact CG-CH2 4.3Å; K171-W191 HydrophobicContact CG-CZ2 4.02Å
192	R	94.2	Very high	90.6	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	134.1	-173.6	-61.2	-64.9	178.6	-128.1	8	110.9	V169 Y170 V172 A190 F197 N274 F275 F278 G280	V169-R192 CarbonylContact C-O 3.59Å; V169-R192 WeakPolarHBondContact CA-O 3.26Å; Y170-R192 WeakPolarHBondContact CD2-O 3.3Å; Y170-R192 PolarHBondContact N-O 2.95Å; Y170-R192 PolarHBondContact O-N 3.07Å; V172-R192 HydrophobicContact CG2-CB 4.26Å; V172-R192 HydrophobicContact CG2-CG 4.05Å; A190-R192 HydrophobicContact CB-CG 4.46Å; R192-F197 HydrophobicContact CB-CD2 4.23Å; R192-F197 HydrophobicContact CB-CE2 3.55Å; R192-F197 HydrophobicContact CB-CZ 4.08Å; R192-N274 PolarHBondContact NH2-O 2.98Å; R192-F275 HydrophobicContact CB-CE1 4.45Å; R192-F275 HydrophobicContact CB-CE2 4.31Å; R192-F275 HydrophobicContact CB-CZ 3.79Å; R192-F275 HydrophobicContact CG-CE1 3.84Å; R192-F275 HydrophobicContact CG-CE2 3.95Å; R192-F275 HydrophobicContact CG-CZ 3.52Å; R192-F275 VanDerWaalsContact CZ-O 3.22Å; R192-F275 PolarHBondContact NE-O 3.31Å; R192-F275 PolarHBondContact NH2-O 2.91Å; R192-F278 PolarHBondContact NH1-O 3.28Å; R192-F278 PolarHBondContact NH2-O 2.9Å; R192-G280 PolarHBondContact NH1-O 3.38Å
193	R	91.8	Very high	91.5	Very high	47 Å²	47	46.2 Å²	46.2	18%	0.177	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	158.3	170.4	54.5	170.9	-161	155.7	19.3	109.9	Y167 V169 S195 D196 F197	Y167-R193 HydrophobicContact CD2-CB 3.97Å; Y167-R193 HydrophobicContact CE2-CB 4.36Å; V169-R193 HydrophobicContact CG1-CB 4.4Å; R193-S195 WeakPolarHBondContact CD-OG 3.4Å; R193-S195 PolarHBondContact NE-OG 3.25Å; R193-S195 PolarHBondContact NH1-OG 3.39Å; R193-S195 PolarHBondContact NH2-OG 3.26Å; R193-S195 PolarHBondContact O-N 3.08Å; R193-S195 VanDerWaalsContact O-N 3.15Å; R193-D196 HydrophobicContact CG-CB 4.24Å; R193-D196 WeakPolarHBondContact CG-OD1 3.5Å; R193-D196 WeakPolarHBondContact CG-OD2 3.42Å; R193-D196 IonicContact CZ-OD1 3.14Å; R193-D196 PolarHBondContact N-OD2 3.34Å; R193-D196 IonicContact NE-OD1 3.62Å; R193-D196 PolarHBondContact NE-OD1 2.82Å; R193-D196 IonicContact NH2-OD1 3.62Å; R193-D196 WeakPolarHBondContact O-CB 3.48Å; R193-D196 PolarHBondContact O-N 2.9Å; R193-F197 WeakPolarHBondContact O-CD2 3.47Å
194	F	91	Very high	92.1	Very high	28 Å²	28	45 Å²	45	12%	0.123	22%	0.223	C	C	.	.	H	α-helix	trans	-50.4	-41.2	177.4	178.1	-102.2	0	0	0	113.3	Y170 D196 F197 L198 P219 K221 R249 L253	Y170-F194 HydrophobicContact CE2-CB 4.23Å; F194-D196 VanDerWaalsContact C-N 3.26Å; F194-D196 PolarHBondContact O-N 2.9Å; F194-F197 WeakPolarHBondContact O-CB 3.39Å; F194-F197 PolarHBondContact O-N 3.48Å; F194-L198 HydrophobicContact CD1-CD1 4.09Å; F194-L198 HydrophobicContact CD1-CG 4.36Å; F194-L198 HydrophobicContact CE1-CD1 3.58Å; F194-L198 HydrophobicContact CE1-CD2 4.29Å; F194-L198 HydrophobicContact CE1-CG 3.98Å; F194-L198 HydrophobicContact CZ-CD1 4.26Å; F194-L198 HydrophobicContact CZ-CD2 4.16Å; F194-L198 HydrophobicContact CZ-CG 4.31Å; F194-L198 PolarHBondContact O-N 3.04Å; F194-P219 HydrophobicContact CE2-CB 3.86Å; F194-P219 WeakPolarHBondContact CZ-O 3.44Å; F194-K221 HydrophobicContact CE1-CB 4.37Å; F194-K221 HydrophobicContact CE1-CG 4.41Å; F194-K221 HydrophobicContact CZ-CB 4.5Å; F194-R249 HydrophobicContact CD2-CG 4.09Å; F194-R249 HydrophobicContact CE2-CG 4.32Å; F194-L253 HydrophobicContact CD2-CD1 4.26Å; F194-L253 HydrophobicContact CD2-CD2 3.85Å; F194-L253 HydrophobicContact CD2-CG 4.39Å; F194-L253 HydrophobicContact CE2-CD2 4.23Å
195	S	90.6	Very high	92.7	Very high	22 Å²	22	42.1 Å²	42.1	15%	0.154	20%	0.195	C	C	.	.	H	α-helix	trans	-71.5	-15.9	178.8	37.6	0	0	0	0	114.5	R193 G199	R193-S195 WeakPolarHBondContact CD-OG 3.4Å; R193-S195 PolarHBondContact NE-OG 3.25Å; R193-S195 PolarHBondContact NH1-OG 3.39Å; R193-S195 PolarHBondContact NH2-OG 3.26Å; R193-S195 PolarHBondContact O-N 3.08Å; R193-S195 VanDerWaalsContact O-N 3.15Å; S195-G199 PolarHBondContact O-N 3.32Å; S195-G199 VanDerWaalsContact O-N 3.09Å
196	D	92.2	Very high	93	Very high	16 Å²	16	42.9 Å²	42.9	9%	0.086	20%	0.204	C	C	.	.	H	α-helix	trans	-73.5	-38.8	170	-55.5	-24.4	0	0	0	110.3	R193 F194 L198 G199 L200 F275 L282	R193-D196 HydrophobicContact CG-CB 4.24Å; R193-D196 WeakPolarHBondContact CG-OD1 3.5Å; R193-D196 WeakPolarHBondContact CG-OD2 3.42Å; R193-D196 IonicContact CZ-OD1 3.14Å; R193-D196 PolarHBondContact N-OD2 3.34Å; R193-D196 IonicContact NE-OD1 3.62Å; R193-D196 PolarHBondContact NE-OD1 2.82Å; R193-D196 IonicContact NH2-OD1 3.62Å; R193-D196 WeakPolarHBondContact O-CB 3.48Å; R193-D196 PolarHBondContact O-N 2.9Å; F194-D196 VanDerWaalsContact C-N 3.26Å; F194-D196 PolarHBondContact O-N 2.9Å; D196-L198 VanDerWaalsContact C-N 3.34Å; D196-L198 PolarHBondContact O-N 2.99Å; D196-G199 PolarHBondContact O-N 3.42Å; D196-L200 PolarHBondContact O-N 2.84Å; D196-F275 HydrophobicContact CB-CE2 3.78Å; D196-L282 HydrophobicContact CB-CD1 4.32Å
197	F	94.1	Very high	93.4	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-61.9	-42.3	174.3	-70.5	-96.8	0	0	0	111.4	I154 Y170 V172 R192 R193 F194 L200 H201 L253 Y256 I257 F275	I154-F197 HydrophobicContact CD1-CE1 4.35Å; I154-F197 HydrophobicContact CD1-CZ 4.02Å; Y170-F197 HydrophobicContact CD2-CE2 4.37Å; V172-F197 HydrophobicContact CG2-CE1 4.49Å; V172-F197 HydrophobicContact CG2-CZ 3.73Å; R192-F197 HydrophobicContact CB-CD2 4.23Å; R192-F197 HydrophobicContact CB-CE2 3.55Å; R192-F197 HydrophobicContact CB-CZ 4.08Å; R193-F197 WeakPolarHBondContact O-CD2 3.47Å; F194-F197 WeakPolarHBondContact O-CB 3.39Å; F194-F197 PolarHBondContact O-N 3.48Å; F197-L200 PolarHBondContact O-N 2.97Å; F197-H201 WeakPolarHBondContact O-CB 3.13Å; F197-H201 PolarHBondContact O-N 3.38Å; F197-L253 HydrophobicContact CB-CD2 3.74Å; F197-L253 HydrophobicContact CD1-CD2 3.75Å; F197-L253 HydrophobicContact CD2-CD1 4.47Å; F197-L253 HydrophobicContact CD2-CD2 3.65Å; F197-L253 HydrophobicContact CE1-CB 4.25Å; F197-L253 HydrophobicContact CE1-CD2 4.19Å; F197-L253 HydrophobicContact CE2-CD1 4.29Å; F197-L253 HydrophobicContact CE2-CD2 4.11Å; F197-L253 HydrophobicContact CG-CD2 3.45Å; F197-L253 VanDerWaalsContact CG-CD2 3.45Å; F197-L253 HydrophobicContact CZ-CB 4.35Å; F197-L253 HydrophobicContact CZ-CD2 4.36Å; F197-Y256 HydrophobicContact CD1-CD1 4.05Å; F197-Y256 HydrophobicContact CD1-CE1 4.25Å; F197-I257 HydrophobicContact CE1-CB 4.41Å; F197-I257 HydrophobicContact CE1-CD1 4.32Å; F197-F275 HydrophobicContact CD1-CE1 4.01Å; F197-F275 AromaticContact CD1-CZ 3.65Å; F197-F275 HydrophobicContact CD1-CZ 3.65Å; F197-F275 AromaticContact CD2-CZ 3.9Å; F197-F275 HydrophobicContact CD2-CZ 3.9Å; F197-F275 AromaticContact CE1-CE1 3.78Å; F197-F275 HydrophobicContact CE1-CE1 3.78Å; F197-F275 AromaticContact CE1-CZ 3.73Å; F197-F275 HydrophobicContact CE1-CZ 3.73Å; F197-F275 AromaticContact CE2-CZ 3.97Å; F197-F275 HydrophobicContact CE2-CZ 3.97Å; F197-F275 AromaticContact CG-CZ 3.75Å; F197-F275 HydrophobicContact CG-CZ 3.75Å; F197-F275 HydrophobicContact CZ-CE1 4.11Å; F197-F275 AromaticContact CZ-CZ 3.88Å; F197-F275 HydrophobicContact CZ-CZ 3.88Å
198	L	92.4	Very high	93.7	Very high	39 Å²	39	35 Å²	35	20%	0.204	17%	0.168	C	C	.	.	H	α-helix	trans	-62.7	-43.6	174.3	-63	-175.1	0	0	0	111.8	F194 D196 L200 H201 D202 A218	F194-L198 HydrophobicContact CD1-CD1 4.09Å; F194-L198 HydrophobicContact CD1-CG 4.36Å; F194-L198 HydrophobicContact CE1-CD1 3.58Å; F194-L198 HydrophobicContact CE1-CD2 4.29Å; F194-L198 HydrophobicContact CE1-CG 3.98Å; F194-L198 HydrophobicContact CZ-CD1 4.26Å; F194-L198 HydrophobicContact CZ-CD2 4.16Å; F194-L198 HydrophobicContact CZ-CG 4.31Å; F194-L198 PolarHBondContact O-N 3.04Å; D196-L198 VanDerWaalsContact C-N 3.34Å; D196-L198 PolarHBondContact O-N 2.99Å; L198-L200 VanDerWaalsContact C-N 3.3Å; L198-L200 PolarHBondContact O-N 2.77Å; L198-H201 PolarHBondContact O-N 3.25Å; L198-D202 VanDerWaalsContact O-CG 3.29Å; L198-D202 PolarHBondContact O-N 3.18Å; L198-A218 HydrophobicContact CD2-CB 4.15Å
199	G	91.5	Very high	93.8	Very high	13 Å²	13	34.9 Å²	34.9	13%	0.134	17%	0.168	C	C	.	.	H	α-helix	trans	-64	-35.1	177.3	0	0	0	0	0	113.2	S195 D196 K203	S195-G199 PolarHBondContact O-N 3.32Å; S195-G199 VanDerWaalsContact O-N 3.09Å; D196-G199 PolarHBondContact O-N 3.42Å; G199-K203 VanDerWaalsContact O-CG 3.3Å; G199-K203 WeakPolarHBondContact O-CG 3.2Å; G199-K203 PolarHBondContact O-N 3.12Å
200	L	94.5	Very high	93.8	Very high	7 Å²	7	35 Å²	35	4%	0.037	17%	0.169	C	C	.	.	H	α-helix	trans	-65.8	-48.7	171	172.2	67.2	0	0	0	110.9	D196 F197 L198 D202 K203 L204 Y256 I257 D271 F272 F275	D196-L200 PolarHBondContact O-N 2.84Å; F197-L200 PolarHBondContact O-N 2.97Å; L198-L200 VanDerWaalsContact C-N 3.3Å; L198-L200 PolarHBondContact O-N 2.77Å; L200-D202 PolarHBondContact O-N 2.81Å; L200-K203 PolarHBondContact O-N 2.78Å; L200-L204 HydrophobicContact CD1-CD1 3.88Å; L200-L204 HydrophobicContact CD1-CG 4Å; L200-L204 HydrophobicContact CG-CD1 3.97Å; L200-L204 HydrophobicContact CG-CG 4.4Å; L200-L204 WeakPolarHBondContact O-CG 3.41Å; L200-L204 PolarHBondContact O-N 3.39Å; L200-Y256 HydrophobicContact CD2-CE1 4.4Å; L200-I257 HydrophobicContact CD2-CD1 4.13Å; L200-D271 HydrophobicContact CD1-CB 4.28Å; L200-F272 HydrophobicContact CD1-CB 4.41Å; L200-F272 HydrophobicContact CD2-CD2 4Å; L200-F275 HydrophobicContact CB-CD2 4.07Å; L200-F275 HydrophobicContact CB-CE2 4.3Å; L200-F275 HydrophobicContact CD1-CB 4.31Å; L200-F275 HydrophobicContact CD2-CB 4.06Å; L200-F275 HydrophobicContact CD2-CD1 3.8Å; L200-F275 HydrophobicContact CD2-CD2 3.91Å; L200-F275 HydrophobicContact CD2-CE1 4.19Å; L200-F275 HydrophobicContact CD2-CE2 4.27Å; L200-F275 HydrophobicContact CD2-CG 3.66Å; L200-F275 HydrophobicContact CD2-CZ 4.4Å; L200-F275 HydrophobicContact CG-CD2 4.47Å
201	H	94.7	Very high	93.9	Very high	17 Å²	17	39 Å²	39	8%	0.079	19%	0.188	C	C	.	.	H	α-helix	trans	-55.6	-52.2	178.4	174.9	-80.8	0	0	0	111	F197 L198 K203 L204 Y205 P216 A218 Y256	F197-H201 WeakPolarHBondContact O-CB 3.13Å; F197-H201 PolarHBondContact O-N 3.38Å; L198-H201 PolarHBondContact O-N 3.25Å; H201-K203 VanDerWaalsContact C-N 3.28Å; H201-K203 PolarHBondContact O-N 3.44Å; H201-L204 PolarHBondContact O-N 2.94Å; H201-L204 VanDerWaalsContact O-N 3.14Å; H201-Y205 AromaticContact CE1-CD2 3.63Å; H201-Y205 AromaticContact CE1-CG 3.9Å; H201-Y205 AromaticContact NE2-CD2 3.95Å; H201-Y205 WeakPolarHBondContact O-CB 3.41Å; H201-Y205 PolarHBondContact O-N 3.06Å; H201-P216 PolarHBondContact CD2-O 3.17Å; H201-P216 VanDerWaalsContact CD2-O 3.27Å; H201-P216 PolarHBondContact NE2-O 3.44Å; H201-A218 HydrophobicContact CB-CB 4.45Å; H201-A218 PolarHBondContact CD2-N 2.74Å; H201-A218 PolarHBondContact NE2-N 3.02Å; H201-Y256 VanDerWaalsContact CA-OH 3.24Å; H201-Y256 WeakPolarHBondContact CA-OH 3.41Å; H201-Y256 HydrophobicContact CB-CE2 4.37Å; H201-Y256 WeakPolarHBondContact CB-OH 3.41Å; H201-Y256 AromaticContact CD2-CE2 3.78Å; H201-Y256 PolarHBondContact N-OH 3.09Å
202	D	93.5	Very high	93.9	Very high	42 Å²	42	36.1 Å²	36.1	23%	0.225	18%	0.177	C	C	.	.	H	α-helix	trans	-55.3	-44.1	-179.4	-69.2	-10.1	0	0	0	111.5	L198 L200 D206	L198-D202 VanDerWaalsContact O-CG 3.29Å; L198-D202 PolarHBondContact O-N 3.18Å; L200-D202 PolarHBondContact O-N 2.81Å; D202-D206 WeakPolarHBondContact O-CB 3.47Å; D202-D206 VanDerWaalsContact O-CG 3.26Å; D202-D206 PolarHBondContact O-N 3.04Å
203	K	94.2	Very high	94.1	Very high	105 Å²	105	38.3 Å²	38.3	46%	0.457	19%	0.185	S	C	.	.	H	α-helix	trans	-63.2	-46.9	177.1	-73	173.9	172.6	-168.1	0	112.8	G199 L200 H201 K207 D271	G199-K203 VanDerWaalsContact O-CG 3.3Å; G199-K203 WeakPolarHBondContact O-CG 3.2Å; G199-K203 PolarHBondContact O-N 3.12Å; L200-K203 PolarHBondContact O-N 2.78Å; H201-K203 VanDerWaalsContact C-N 3.28Å; H201-K203 PolarHBondContact O-N 3.44Å; K203-K207 WeakPolarHBondContact O-CB 3.33Å; K203-K207 PolarHBondContact O-N 2.9Å; K203-K207 VanDerWaalsContact O-N 3.15Å; K203-D271 HydrophobicContact CD-CB 4.27Å; K203-D271 IonicContact NZ-OD1 3.74Å; K203-D271 PolarHBondContact NZ-OD1 3.33Å
204	L	96	Very high	94.3	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-67	-42.7	-179.8	-67.3	179.2	0	0	0	110.6	L200 H201 K207 Y208 V215 T260 L266 D269 F272	L200-L204 HydrophobicContact CD1-CD1 3.88Å; L200-L204 HydrophobicContact CD1-CG 4Å; L200-L204 HydrophobicContact CG-CD1 3.97Å; L200-L204 HydrophobicContact CG-CG 4.4Å; L200-L204 WeakPolarHBondContact O-CG 3.41Å; L200-L204 PolarHBondContact O-N 3.39Å; H201-L204 PolarHBondContact O-N 2.94Å; H201-L204 VanDerWaalsContact O-N 3.14Å; L204-K207 PolarHBondContact O-N 3.11Å; L204-Y208 HydrophobicContact CB-CD2 4.4Å; L204-Y208 HydrophobicContact CD2-CD2 4.12Å; L204-Y208 HydrophobicContact CD2-CE2 3.82Å; L204-Y208 VanDerWaalsContact O-CB 3.31Å; L204-Y208 WeakPolarHBondContact O-CB 3.34Å; L204-Y208 VanDerWaalsContact O-CD2 3.3Å; L204-Y208 WeakPolarHBondContact O-CD2 3.37Å; L204-Y208 PolarHBondContact O-N 3.48Å; L204-V215 HydrophobicContact CB-CG1 4.21Å; L204-T260 HydrophobicContact CD1-CG2 3.77Å; L204-L266 HydrophobicContact CD2-CD2 4.47Å; L204-D269 HydrophobicContact CD2-CB 3.94Å; L204-D269 WeakPolarHBondContact CD2-OD1 3.36Å; L204-F272 HydrophobicContact CD1-CD2 4.46Å
205	Y	94.5	Very high	94.5	Very high	52 Å²	52	35.2 Å²	35.2	20%	0.204	17%	0.174	C	C	.	.	H	α-helix	trans	-61.5	-53.3	179.6	-170.9	-85.8	0	0	0	111	H201 K207 Y208 L209 V215 E421	H201-Y205 AromaticContact CE1-CD2 3.63Å; H201-Y205 AromaticContact CE1-CG 3.9Å; H201-Y205 AromaticContact NE2-CD2 3.95Å; H201-Y205 WeakPolarHBondContact O-CB 3.41Å; H201-Y205 PolarHBondContact O-N 3.06Å; Y205-K207 PolarHBondContact O-N 3.21Å; Y205-Y208 PolarHBondContact O-N 3.17Å; Y205-L209 HydrophobicContact CD1-CD2 4.4Å; Y205-L209 HydrophobicContact CE1-CB 4.5Å; Y205-L209 HydrophobicContact CE1-CD2 3.62Å; Y205-L209 HydrophobicContact CE1-CG 4.48Å; Y205-L209 HydrophobicContact CE2-CD1 3.93Å; Y205-L209 HydrophobicContact CE2-CD2 4.28Å; Y205-L209 WeakPolarHBondContact O-CB 3.48Å; Y205-L209 PolarHBondContact O-N 2.96Å; Y205-L209 WeakPolarHBondContact OH-CD2 3.28Å; Y205-V215 HydrophobicContact CD2-CB 4.44Å; Y205-E421 VanDerWaalsContact OH-CD 3.28Å; Y205-E421 PolarHBondContact OH-OE2 2.94Å
206	D	93.5	Very high	94.7	Very high	113 Å²	113	34.6 Å²	34.6	60%	0.604	17%	0.169	S	C	*	.	H	α-helix	trans	-60.8	-33.8	178.1	-71.9	-13.7	0	0	0	112.6	D202 P210	D202-D206 WeakPolarHBondContact O-CB 3.47Å; D202-D206 VanDerWaalsContact O-CG 3.26Å; D202-D206 PolarHBondContact O-N 3.04Å; D206-P210 WeakPolarHBondContact O-CD 3.28Å
207	K	95.9	Very high	94.7	Very high	90 Å²	90	34.5 Å²	34.5	39%	0.391	17%	0.169	S	C	.	.	H	α-helix	trans	-78.5	-41.6	-178.2	-176.5	175.5	178.6	-175.8	0	112.9	K203 L204 Y205 H211 D269	K203-K207 WeakPolarHBondContact O-CB 3.33Å; K203-K207 PolarHBondContact O-N 2.9Å; K203-K207 VanDerWaalsContact O-N 3.15Å; L204-K207 PolarHBondContact O-N 3.11Å; Y205-K207 PolarHBondContact O-N 3.21Å; K207-H211 PolarHBondContact O-CE1 3.27Å; K207-H211 PolarHBondContact O-ND1 2.91Å; K207-D269 IonicContact NZ-OD2 3.25Å; K207-D269 PolarHBondContact NZ-OD2 3.39Å
208	Y	97	Very high	94.1	Very high	30 Å²	30	36.4 Å²	36.4	12%	0.118	19%	0.185	C	C	.	.	H	α-helix	trans	-108	-26.9	-165.4	-70.2	-69.8	0	0	0	114.1	L204 Y205 H211 R213 V265 L266 D269	L204-Y208 HydrophobicContact CB-CD2 4.4Å; L204-Y208 HydrophobicContact CD2-CD2 4.12Å; L204-Y208 HydrophobicContact CD2-CE2 3.82Å; L204-Y208 VanDerWaalsContact O-CB 3.31Å; L204-Y208 WeakPolarHBondContact O-CB 3.34Å; L204-Y208 VanDerWaalsContact O-CD2 3.3Å; L204-Y208 WeakPolarHBondContact O-CD2 3.37Å; L204-Y208 PolarHBondContact O-N 3.48Å; Y205-Y208 PolarHBondContact O-N 3.17Å; Y208-H211 PolarHBondContact O-N 3.35Å; Y208-H211 VanDerWaalsContact O-N 3.11Å; Y208-R213 HydrophobicContact CD1-CG 4.28Å; Y208-R213 WeakPolarHBondContact O-CB 3.42Å; Y208-R213 PolarHBondContact O-N 3.44Å; Y208-V265 HydrophobicContact CD1-CG1 4.11Å; Y208-V265 HydrophobicContact CE1-CG1 3.48Å; Y208-V265 VanDerWaalsContact CE1-CG1 3.48Å; Y208-L266 HydrophobicContact CD1-CD2 4.45Å; Y208-L266 HydrophobicContact CD2-CD2 3.42Å; Y208-L266 VanDerWaalsContact CD2-CD2 3.42Å; Y208-L266 HydrophobicContact CE2-CD2 3.75Å; Y208-L266 HydrophobicContact CG-CD2 3.82Å; Y208-D269 HydrophobicContact CE2-CB 4.11Å; Y208-D269 WeakPolarHBondContact CE2-OD2 3.37Å; Y208-D269 PolarHBondContact OH-OD2 2.92Å
209	L	95.3	Very high	93.1	Very high	10 Å²	10	34.9 Å²	34.9	5%	0.052	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-57.3	-48.6	177.5	-169.7	87.8	0	0	0	112	Y205 H211 G212 V418 E421 V422 E425	Y205-L209 HydrophobicContact CD1-CD2 4.4Å; Y205-L209 HydrophobicContact CE1-CB 4.5Å; Y205-L209 HydrophobicContact CE1-CD2 3.62Å; Y205-L209 HydrophobicContact CE1-CG 4.48Å; Y205-L209 HydrophobicContact CE2-CD1 3.93Å; Y205-L209 HydrophobicContact CE2-CD2 4.28Å; Y205-L209 WeakPolarHBondContact O-CB 3.48Å; Y205-L209 PolarHBondContact O-N 2.96Å; Y205-L209 WeakPolarHBondContact OH-CD2 3.28Å; L209-H211 PolarHBondContact O-N 3.11Å; L209-G212 PolarHBondContact O-N 3.32Å; L209-V418 HydrophobicContact CD1-CG1 4.3Å; L209-E421 HydrophobicContact CD1-CB 4.36Å; L209-V422 HydrophobicContact CD1-CG2 3.67Å; L209-E425 HydrophobicContact CD2-CG 4.27Å; L209-E425 HydrophobicContact CG-CG 4.08Å
210	P	94.8	Very high	92.1	Very high	44 Å²	44	36.8 Å²	36.8	29%	0.286	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-63.9	-13.2	-179.8	-21.5	35.1	0	0	0	114.2	D206 H479 V483	D206-P210 WeakPolarHBondContact O-CD 3.28Å; P210-H479 PolarHBondContact O-CE1 3.46Å; P210-V483 WeakPolarHBondContact O-CG2 3.47Å
211	H	95.6	Very high	90.5	Very high	84 Å²	84	43.5 Å²	43.5	39%	0.389	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-98.8	13.7	177.2	-59	92.6	0	0	0	112.3	K207 Y208 L209 S486	K207-H211 PolarHBondContact O-CE1 3.27Å; K207-H211 PolarHBondContact O-ND1 2.91Å; Y208-H211 PolarHBondContact O-N 3.35Å; Y208-H211 VanDerWaalsContact O-N 3.11Å; L209-H211 PolarHBondContact O-N 3.11Å; H211-S486 WeakPolarHBondContact O-CB 3.38Å; H211-S486 PolarHBondContact O-OG 2.89Å
212	G	95.6	Very high	88.7	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.8	29.8	176.7	0	0	0	0	0	114.3	L209 S486	L209-G212 PolarHBondContact O-N 3.32Å; G212-S486 PolarHBondContact O-OG 3.17Å
213	R	96.9	Very high	86.3	Confident	45 Å²	45	47.7 Å²	47.7	17%	0.17	25%	0.247	C	C	.	.			trans	-102.5	138.4	179.6	-57.2	-66.6	178.4	-170.1	-13.9	111.9	Y208 V215 V422 S486 E490	Y208-R213 HydrophobicContact CD1-CG 4.28Å; Y208-R213 WeakPolarHBondContact O-CB 3.42Å; Y208-R213 PolarHBondContact O-N 3.44Å; R213-V215 PolarHBondContact O-N 3.49Å; R213-V422 WeakPolarHBondContact O-CG2 3.43Å; R213-S486 WeakPolarHBondContact CD-OG 3.41Å; R213-S486 PolarHBondContact NE-OG 2.87Å; R213-S486 VanDerWaalsContact NE-OG 3.1Å; R213-S486 PolarHBondContact NH2-OG 2.74Å; R213-E490 VanDerWaalsContact CD-OE1 3.29Å; R213-E490 WeakPolarHBondContact CD-OE1 3.49Å; R213-E490 IonicContact CZ-OE1 3.88Å; R213-E490 IonicContact NE-OE1 3.26Å; R213-E490 IonicContact NH1-OE1 2.7Å; R213-E490 PolarHBondContact NH1-OE1 2.92Å
214	I	96.6	Very high	83.9	Confident	11 Å²	11	49.7 Å²	49.7	6%	0.056	26%	0.256	C	S	.	.			trans	-85.9	109.2	178.9	-59.6	165.2	0	0	0	109	H263 L415 V418 V419 V422 E490 F494	I214-H263 PolarHBondContact O-CD2 3.15Å; I214-L415 HydrophobicContact CG2-CD1 3.68Å; I214-V418 HydrophobicContact CG2-CG1 4.24Å; I214-V419 HydrophobicContact CD1-CG2 3.87Å; I214-V419 HydrophobicContact CG1-CG2 4.32Å; I214-V419 HydrophobicContact CG2-CG2 4.41Å; I214-V422 HydrophobicContact CG1-CG1 4.48Å; I214-V422 HydrophobicContact CG1-CG2 4.15Å; I214-E490 HydrophobicContact CD1-CB 3.86Å; I214-E490 HydrophobicContact CG1-CB 4.08Å; I214-F494 HydrophobicContact CD1-CB 3.74Å; I214-F494 HydrophobicContact CD1-CG 4.35Å
215	V	95.7	Very high	81.5	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-93.1	129.2	174	-179.3	0	0	0	0	108.9	L204 Y205 R213 L266 V418	L204-V215 HydrophobicContact CB-CG1 4.21Å; Y205-V215 HydrophobicContact CD2-CB 4.44Å; R213-V215 PolarHBondContact O-N 3.49Å; V215-L266 HydrophobicContact CG2-CD1 4.49Å; V215-L266 HydrophobicContact CG2-CD2 4.45Å; V215-V418 WeakPolarHBondContact O-CG1 3.13Å
216	P	94.2	Very high	79	Confident	8 Å²	8	54.5 Å²	54.5	5%	0.052	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-56.3	142.2	179	-26	35.3	0	0	0	112.2	H201 Y256 R259	H201-P216 PolarHBondContact CD2-O 3.17Å; H201-P216 VanDerWaalsContact CD2-O 3.27Å; H201-P216 PolarHBondContact NE2-O 3.44Å; P216-Y256 HydrophobicContact CB-CD2 3.94Å; P216-Y256 HydrophobicContact CB-CE2 4.24Å; P216-Y256 WeakPolarHBondContact O-CE2 3.27Å; P216-R259 HydrophobicContact CB-CB 4.07Å; P216-R259 HydrophobicContact CG-CB 3.71Å
217	P	91.5	Very high	76.6	Confident	15 Å²	15	54.7 Å²	54.7	10%	0.097	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-63.1	144.6	-173.8	26.4	-35.9	0	0	0	111.9	Y256 A414 L415	P217-Y256 WeakPolarHBondContact O-CD2 3.4Å; P217-A414 HydrophobicContact CB-CB 3.74Å; P217-A414 HydrophobicContact CG-CB 3.84Å; P217-L415 HydrophobicContact CG-CB 4.42Å
218	A	83.1	Confident	74.1	Confident	40 Å²	40	58.4 Å²	58.4	33%	0.331	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-61.2	136.9	175.8	0	0	0	0	0	111.3	L198 H201 A220	L198-A218 HydrophobicContact CD2-CB 4.15Å; H201-A218 HydrophobicContact CB-CB 4.45Å; H201-A218 PolarHBondContact CD2-N 2.74Å; H201-A218 PolarHBondContact NE2-N 3.02Å; A218-A220 PolarHBondContact O-N 2.94Å
219	P	71.4	Confident	71.5	Confident	6 Å²	6	61.5 Å²	61.5	4%	0.039	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-54.3	126.8	170	-29.1	37.8	0	0	0	111.1	F194 K221 L253 Y256	F194-P219 HydrophobicContact CE2-CB 3.86Å; F194-P219 WeakPolarHBondContact CZ-O 3.44Å; P219-K221 PolarHBondContact O-N 3.4Å; P219-L253 HydrophobicContact CB-CD2 3.98Å; P219-L253 HydrophobicContact CB-CG 4.48Å; P219-L253 HydrophobicContact CG-CD2 3.67Å; P219-L253 HydrophobicContact CG-CG 4.37Å; P219-Y256 HydrophobicContact CG-CD1 4.42Å; P219-Y256 HydrophobicContact CG-CG 4.09Å
220	A	69.7	Low	68.7	Low	53 Å²	53	69.8 Å²	69.8	44%	0.438	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-60.2	132.1	-173.7	0	0	0	0	0	111.7	A218 N222	A218-A220 PolarHBondContact O-N 2.94Å; A220-N222 PolarHBondContact O-N 3.3Å
221	K	61.5	Low	66	Low	149 Å²	149	75.7 Å²	75.7	65%	0.648	40%	0.399	S	S	*	.			trans	-72.5	84.8	168.6	-171.4	-177.7	-179.3	-175.3	0	107.9	F194 P219 V223	F194-K221 HydrophobicContact CE1-CB 4.37Å; F194-K221 HydrophobicContact CE1-CG 4.41Å; F194-K221 HydrophobicContact CZ-CB 4.5Å; P219-K221 PolarHBondContact O-N 3.4Å; K221-V223 WeakPolarHBondContact O-CG2 3.26Å; K221-V223 PolarHBondContact O-N 3.36Å
222	N	56.4	Low	63.2	Low	53 Å²	53	78.5 Å²	78.5	28%	0.283	42%	0.422	S	S	.	.			trans	-63.5	108.7	174.5	-61.7	-20.3	0	0	0	108.9	A220 F224 F245	A220-N222 PolarHBondContact O-N 3.3Å; N222-F224 PolarHBondContact O-N 2.86Å; N222-F245 HydrophobicContact CB-CD2 4.4Å; N222-F245 HydrophobicContact CB-CE2 3.26Å; N222-F245 HydrophobicContact CB-CZ 3.63Å
223	V	42.5	Very low	60.5	Low	94 Å²	94	89 Å²	89	57%	0.57	47%	0.468	S	S	*	.	G	3₁₀ helix	trans	-73.6	-9.7	-175.9	-177.2	0	0	0	0	112.1	K221 V225 S226	K221-V223 WeakPolarHBondContact O-CG2 3.26Å; K221-V223 PolarHBondContact O-N 3.36Å; V223-V225 PolarHBondContact O-N 2.92Å; V223-V225 VanDerWaalsContact O-N 3.12Å; V223-S226 PolarHBondContact O-N 2.97Å; V223-S226 VanDerWaalsContact O-N 3.13Å; V223-S226 PolarHBondContact O-OG 2.72Å
224	F	44.7	Very low	57.8	Low	147 Å²	147	88.6 Å²	88.6	65%	0.645	48%	0.477	S	S	*	.	G	3₁₀ helix	trans	-62.9	-24.2	-172.1	-156.3	-101.4	0	0	0	114.6	N222	N222-F224 PolarHBondContact O-N 2.86Å
225	V	44.2	Very low	55.3	Low	64 Å²	64	92 Å²	92	39%	0.388	50%	0.498	S	S	.	.	G	3₁₀ helix	trans	-83.6	-15.8	-179.7	174.7	0	0	0	0	113.2	V223 T227 T229 F245	V223-V225 PolarHBondContact O-N 2.92Å; V223-V225 VanDerWaalsContact O-N 3.12Å; V225-T227 VanDerWaalsContact C-N 3.34Å; V225-T227 PolarHBondContact O-N 2.67Å; V225-T229 PolarHBondContact O-OG1 3.36Å; V225-F245 HydrophobicContact CB-CE1 4.23Å; V225-F245 HydrophobicContact CB-CZ 4.1Å; V225-F245 HydrophobicContact CG2-CD1 3.64Å; V225-F245 HydrophobicContact CG2-CD2 3.92Å; V225-F245 HydrophobicContact CG2-CE1 3.39Å; V225-F245 HydrophobicContact CG2-CE2 3.63Å; V225-F245 HydrophobicContact CG2-CG 3.87Å; V225-F245 HydrophobicContact CG2-CZ 3.35Å
226	S	43.7	Very low	53.2	Low	89 Å²	89	94.6 Å²	94.6	62%	0.622	51%	0.514	S	S	*	.	G	3₁₀ helix	trans	-78.6	-12.6	-175.6	2.5	0	0	0	0	114.7	V223	V223-S226 PolarHBondContact O-N 2.97Å; V223-S226 VanDerWaalsContact O-N 3.13Å; V223-S226 PolarHBondContact O-OG 2.72Å
227	T	42.3	Very low	51.2	Low	117 Å²	117	102.3 Å²	102.3	72%	0.718	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.6	-0.7	-167	21.9	0	0	0	0	116.4	V225	V225-T227 VanDerWaalsContact C-N 3.34Å; V225-T227 PolarHBondContact O-N 2.67Å
228	K	42.6	Very low	49.5	Very low	168 Å²	168	108.4 Å²	108.4	73%	0.73	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.9	-10.4	178.9	-82.1	-168.5	175.9	-177.5	0	118.2	K230	K228-K230 PolarHBondContact O-N 3.28Å
229	T	42.3	Very low	48.7	Very low	95 Å²	95	109.7 Å²	109.7	58%	0.583	58%	0.578	S	S	*	*			trans	-84.9	59.5	172.4	31.2	0	0	0	0	111.6	V225	V225-T229 PolarHBondContact O-OG1 3.36Å
230	K	37.5	Very low	48.7	Very low	184 Å²	184	114.2 Å²	114.2	80%	0.8	61%	0.608	S	S	*	*			trans	-86.2	109.1	169.2	-145	177.8	-173.3	-179.3	0	107.4	K228	K228-K230 PolarHBondContact O-N 3.28Å
231	M	38.1	Very low	49	Very low	167 Å²	167	116 Å²	116	82%	0.823	61%	0.613	S	S	*	*			trans	63.9	81.2	151.8	-61.7	170.2	149.1	0	0	118.4
232	V	36.8	Very low	49.6	Very low	144 Å²	144	109.9 Å²	109.9	87%	0.873	59%	0.59	S	S	*	*			trans	-140	135.7	135.2	-178.6	0	0	0	0	108.3	G234	V232-G234 PolarHBondContact O-N 3.39Å
233	K	38.2	Very low	50.7	Low	221 Å²	221	109 Å²	109	96%	0.961	59%	0.59	S	S	*	*			trans	-73.5	73.7	178.4	-167.5	-176.1	-174.9	-176.3	0	109
234	G	40.3	Very low	52.5	Low	35 Å²	35	107.2 Å²	107.2	36%	0.361	58%	0.576	S	S	.	*	S	Bend	trans	-132.8	144.8	171.2	0	0	0	0	0	107.9	V232 E238	V232-G234 PolarHBondContact O-N 3.39Å; G234-E238 WeakPolarHBondContact CA-OE2 3.42Å
235	T	44.5	Very low	54.3	Low	82 Å²	82	101.4 Å²	101.4	50%	0.503	55%	0.55	S	S	.	*			trans	-53.3	149.5	175.9	46	0	0	0	0	109.1	E237 E238	T235-E237 PolarHBondContact O-N 2.72Å; T235-E238 PolarHBondContact O-N 3.14Å
236	V	52.3	Low	56.3	Low	55 Å²	55	99 Å²	99	33%	0.333	54%	0.535	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-11.5	176.6	173	0	0	0	0	112.2	K159 L246	K159-V236 HydrophobicContact CD-CG2 3.92Å; V236-L246 HydrophobicContact CG1-CD1 3.55Å
237	E	52.1	Low	58.4	Low	171 Å²	171	97.7 Å²	97.7	80%	0.799	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-16.3	176.3	-61.2	177.6	164	0	0	114.1	T235	T235-E237 PolarHBondContact O-N 2.72Å
238	E	55	Low	60.4	Low	143 Å²	143	95.2 Å²	95.2	67%	0.668	50%	0.496	S	S	*	.	S	Bend	trans	-94.8	-13.3	-174.4	-72.5	179.9	172.9	0	0	114.7	G234 T235 P240	G234-E238 WeakPolarHBondContact CA-OE2 3.42Å; T235-E238 PolarHBondContact O-N 3.14Å; E238-P240 WeakPolarHBondContact O-CD 3.3Å
239	D	66.3	Low	62.7	Low	67 Å²	67	89 Å²	89	36%	0.358	47%	0.469	S	S	.	.			trans	-96.8	105.3	174.7	-173.1	-8.5	0	0	0	109.8	V241 A242 A243	D239-V241 PolarHBondContact O-N 3.43Å; D239-V241 VanDerWaalsContact O-N 3.13Å; D239-V241 WeakPolarHBondContact OD1-CB 3.35Å; D239-V241 PolarHBondContact OD1-N 3.14Å; D239-V241 VanDerWaalsContact OD1-N 3.14Å; D239-A242 HydrophobicContact CB-CB 3.91Å; D239-A242 WeakPolarHBondContact O-CB 3.48Å; D239-A242 PolarHBondContact O-N 3.37Å; D239-A243 PolarHBondContact O-N 3.45Å
240	P	72.2	Confident	65	Low	101 Å²	101	86.1 Å²	86.1	66%	0.656	45%	0.447	S	S	*	.	H	α-helix	trans	-57.9	-30.7	-177	23.1	-33.5	0	0	0	112.4	E238 A243 E244	E238-P240 WeakPolarHBondContact O-CD 3.3Å; P240-A243 PolarHBondContact O-N 2.86Å; P240-E244 PolarHBondContact O-N 2.86Å
241	V	74.5	Confident	67.5	Low	90 Å²	90	78.3 Å²	78.3	55%	0.545	42%	0.416	S	S	.	.	H	α-helix	trans	-69.3	-38.1	177.9	-176.8	0	0	0	0	110.9	D239 F245	D239-V241 PolarHBondContact O-N 3.43Å; D239-V241 VanDerWaalsContact O-N 3.13Å; D239-V241 WeakPolarHBondContact OD1-CB 3.35Å; D239-V241 PolarHBondContact OD1-N 3.14Å; D239-V241 VanDerWaalsContact OD1-N 3.14Å; V241-F245 WeakPolarHBondContact O-CB 3.01Å; V241-F245 PolarHBondContact O-N 3.38Å; V241-F245 VanDerWaalsContact O-N 3.16Å
242	A	75.4	Confident	70	Confident	21 Å²	21	71.5 Å²	71.5	17%	0.174	39%	0.385	C	S	.	.	H	α-helix	trans	-69.6	-38.9	176.7	0	0	0	0	0	111.7	D239 F245 L246	D239-A242 HydrophobicContact CB-CB 3.91Å; D239-A242 WeakPolarHBondContact O-CB 3.48Å; D239-A242 PolarHBondContact O-N 3.37Å; A242-F245 PolarHBondContact O-N 3.49Å; A242-L246 WeakPolarHBondContact O-CG 3.38Å; A242-L246 PolarHBondContact O-N 3.38Å
243	A	79.5	Confident	72.7	Confident	34 Å²	34	64.6 Å²	64.6	28%	0.281	34%	0.344	S	S	.	.	H	α-helix	trans	-63.6	-48.9	176.5	0	0	0	0	0	111.8	D239 P240 F245 L246 E247	D239-A243 PolarHBondContact O-N 3.45Å; P240-A243 PolarHBondContact O-N 2.86Å; A243-F245 VanDerWaalsContact C-N 3.29Å; A243-F245 PolarHBondContact O-N 2.82Å; A243-L246 PolarHBondContact O-N 2.83Å; A243-E247 PolarHBondContact O-N 3.45Å
244	E	79.7	Confident	75.3	Confident	57 Å²	57	55 Å²	55	27%	0.266	30%	0.302	S	S	.	.	H	α-helix	trans	-56.8	-45	176.6	-171.8	-175.7	-171.7	0	0	110.7	P240 L246 E247 R248 K351	P240-E244 PolarHBondContact O-N 2.86Å; E244-L246 PolarHBondContact O-N 2.9Å; E244-E247 PolarHBondContact O-N 3.01Å; E244-R248 VanDerWaalsContact CD-NH2 3.32Å; E244-R248 WeakPolarHBondContact O-CG 3.41Å; E244-R248 PolarHBondContact O-N 3.29Å; E244-R248 IonicContact OE1-CZ 2.63Å; E244-R248 IonicContact OE1-NE 2.63Å; E244-R248 IonicContact OE1-NH2 3.8Å; E244-R248 PolarHBondContact OE1-NH2 3.04Å; E244-R248 IonicContact OE2-NH2 3.42Å; E244-K351 IonicContact OE1-NZ 2.82Å; E244-K351 PolarHBondContact OE1-NZ 3.46Å
245	F	83	Confident	77.8	Confident	25 Å²	25	55.3 Å²	55.3	11%	0.11	29%	0.292	C	S	.	.	H	α-helix	trans	-60.2	-44.8	177.1	175.9	-90.1	0	0	0	113.8	N222 V225 V241 A242 A243 E247 R248 R249	N222-F245 HydrophobicContact CB-CD2 4.4Å; N222-F245 HydrophobicContact CB-CE2 3.26Å; N222-F245 HydrophobicContact CB-CZ 3.63Å; V225-F245 HydrophobicContact CB-CE1 4.23Å; V225-F245 HydrophobicContact CB-CZ 4.1Å; V225-F245 HydrophobicContact CG2-CD1 3.64Å; V225-F245 HydrophobicContact CG2-CD2 3.92Å; V225-F245 HydrophobicContact CG2-CE1 3.39Å; V225-F245 HydrophobicContact CG2-CE2 3.63Å; V225-F245 HydrophobicContact CG2-CG 3.87Å; V225-F245 HydrophobicContact CG2-CZ 3.35Å; V241-F245 WeakPolarHBondContact O-CB 3.01Å; V241-F245 PolarHBondContact O-N 3.38Å; V241-F245 VanDerWaalsContact O-N 3.16Å; A242-F245 PolarHBondContact O-N 3.49Å; A243-F245 VanDerWaalsContact C-N 3.29Å; A243-F245 PolarHBondContact O-N 2.82Å; F245-E247 VanDerWaalsContact C-N 3.32Å; F245-R248 PolarHBondContact O-N 3.04Å; F245-R249 VanDerWaalsContact CE1-CZ 3.41Å; F245-R249 PolarHBondContact O-N 3.39Å
246	L	85.9	Confident	80.1	Confident	12 Å²	12	51.5 Å²	51.5	6%	0.063	27%	0.269	C	S	.	.	H	α-helix	trans	-67.4	-37.4	-179.6	-73.9	173	0	0	0	111.3	Y157 M168 V236 A242 A243 E244 R249 R250	Y157-L246 HydrophobicContact CD2-CB 4.4Å; Y157-L246 HydrophobicContact CD2-CD1 4.3Å; Y157-L246 HydrophobicContact CE1-CB 4.31Å; Y157-L246 HydrophobicContact CE2-CB 3.8Å; Y157-L246 HydrophobicContact CE2-CD1 3.85Å; Y157-L246 HydrophobicContact CE2-CG 4.43Å; M168-L246 HydrophobicContact CE-CD1 4.09Å; M168-L246 HydrophobicContact CE-CD2 4.41Å; M168-L246 HydrophobicContact CG-CD2 3.86Å; V236-L246 HydrophobicContact CG1-CD1 3.55Å; A242-L246 WeakPolarHBondContact O-CG 3.38Å; A242-L246 PolarHBondContact O-N 3.38Å; A243-L246 PolarHBondContact O-N 2.83Å; E244-L246 PolarHBondContact O-N 2.9Å; L246-R249 PolarHBondContact O-N 3.28Å; L246-R250 WeakPolarHBondContact O-CB 3.4Å; L246-R250 PolarHBondContact O-N 3.17Å
247	E	86.9	Confident	82.2	Confident	62 Å²	62	48.9 Å²	48.9	29%	0.29	25%	0.253	S	S	.	.	H	α-helix	trans	-66.3	-44.5	176.1	-173.9	51.2	-144.1	0	0	111.8	A243 E244 F245 R249 R250 A251 F403	A243-E247 PolarHBondContact O-N 3.45Å; E244-E247 PolarHBondContact O-N 3.01Å; F245-E247 VanDerWaalsContact C-N 3.32Å; E247-R249 VanDerWaalsContact C-N 3.28Å; E247-R249 PolarHBondContact O-N 3.13Å; E247-R250 VanDerWaalsContact CD-NE 3.31Å; E247-R250 WeakPolarHBondContact O-CB 3.48Å; E247-R250 PolarHBondContact O-N 2.89Å; E247-R250 VanDerWaalsContact O-N 3.14Å; E247-R250 IonicContact OE1-CZ 3.93Å; E247-R250 IonicContact OE1-NE 3.32Å; E247-R250 PolarHBondContact OE1-NE 3.31Å; E247-R250 IonicContact OE1-NH2 3.44Å; E247-R250 PolarHBondContact OE1-NH2 3.04Å; E247-R250 IonicContact OE2-NE 3.62Å; E247-R250 PolarHBondContact OE2-NE 2.83Å; E247-R250 VanDerWaalsContact OE2-NE 3.16Å; E247-A251 PolarHBondContact O-N 3.29Å; E247-F403 HydrophobicContact CG-CE1 4.42Å; E247-F403 HydrophobicContact CG-CZ 4.17Å
248	R	86.2	Confident	84.1	Confident	65 Å²	65	45 Å²	45	25%	0.245	23%	0.231	C	C	.	.	H	α-helix	trans	-54.8	-45.1	170.8	-68.6	178.3	-175.1	-164.9	1.9	112.1	E244 F245 S252 F402 F403	E244-R248 VanDerWaalsContact CD-NH2 3.32Å; E244-R248 WeakPolarHBondContact O-CG 3.41Å; E244-R248 PolarHBondContact O-N 3.29Å; E244-R248 IonicContact OE1-CZ 2.63Å; E244-R248 IonicContact OE1-NE 2.63Å; E244-R248 IonicContact OE1-NH2 3.8Å; E244-R248 PolarHBondContact OE1-NH2 3.04Å; E244-R248 IonicContact OE2-NH2 3.42Å; F245-R248 PolarHBondContact O-N 3.04Å; R248-S252 WeakPolarHBondContact O-CB 3.39Å; R248-S252 PolarHBondContact O-N 3.45Å; R248-F402 HydrophobicContact CG-CE1 3.69Å; R248-F402 HydrophobicContact CG-CZ 4.29Å; R248-F402 VanDerWaalsContact NE-CZ 3.32Å; R248-F402 VanDerWaalsContact NH1-CZ 3.3Å; R248-F403 HydrophobicContact CB-CE1 4.35Å; R248-F403 HydrophobicContact CG-CE1 3.65Å; R248-F403 HydrophobicContact CG-CZ 3.82Å
249	R	89	Confident	85.9	Confident	39 Å²	39	39.1 Å²	39.1	15%	0.147	20%	0.202	C	C	.	.	H	α-helix	trans	-65.5	-42.9	177.2	-179.1	174.5	-77.2	167	-3.5	111.9	Y170 F194 F245 L246 E247 S252 L253	Y170-R249 WeakPolarHBondContact OH-CD 3.49Å; Y170-R249 WeakPolarHBondContact OH-CG 3.33Å; F194-R249 HydrophobicContact CD2-CG 4.09Å; F194-R249 HydrophobicContact CE2-CG 4.32Å; F245-R249 VanDerWaalsContact CE1-CZ 3.41Å; F245-R249 PolarHBondContact O-N 3.39Å; L246-R249 PolarHBondContact O-N 3.28Å; E247-R249 VanDerWaalsContact C-N 3.28Å; E247-R249 PolarHBondContact O-N 3.13Å; R249-S252 PolarHBondContact O-N 3.32Å; R249-L253 HydrophobicContact CG-CD1 3.99Å; R249-L253 HydrophobicContact CG-CG 4.41Å; R249-L253 VanDerWaalsContact O-CG 3.26Å; R249-L253 WeakPolarHBondContact O-CG 3.44Å; R249-L253 PolarHBondContact O-N 2.77Å
250	R	91.9	Very high	87.2	Confident	34 Å²	34	35.9 Å²	35.9	13%	0.128	19%	0.185	C	C	.	.	H	α-helix	trans	-58.1	-50	176.7	-173.3	-149.7	64	68.4	10	110.6	I154 Y157 Y170 L246 E247 S252 L253 E254	I154-R250 HydrophobicContact CB-CG 4.05Å; I154-R250 HydrophobicContact CG2-CG 3.52Å; I154-R250 WeakPolarHBondContact O-CD 3.49Å; I154-R250 PolarHBondContact O-NH1 2.96Å; Y157-R250 HydrophobicContact CD1-CB 4.07Å; Y157-R250 HydrophobicContact CD1-CG 4.09Å; Y157-R250 HydrophobicContact CE1-CB 4.29Å; Y170-R250 HydrophobicContact CD1-CB 4.42Å; Y170-R250 HydrophobicContact CD1-CG 4.35Å; Y170-R250 HydrophobicContact CE1-CB 4.22Å; L246-R250 WeakPolarHBondContact O-CB 3.4Å; L246-R250 PolarHBondContact O-N 3.17Å; E247-R250 VanDerWaalsContact CD-NE 3.31Å; E247-R250 WeakPolarHBondContact O-CB 3.48Å; E247-R250 PolarHBondContact O-N 2.89Å; E247-R250 VanDerWaalsContact O-N 3.14Å; E247-R250 IonicContact OE1-CZ 3.93Å; E247-R250 IonicContact OE1-NE 3.32Å; E247-R250 PolarHBondContact OE1-NE 3.31Å; E247-R250 IonicContact OE1-NH2 3.44Å; E247-R250 PolarHBondContact OE1-NH2 3.04Å; E247-R250 IonicContact OE2-NE 3.62Å; E247-R250 PolarHBondContact OE2-NE 2.83Å; E247-R250 VanDerWaalsContact OE2-NE 3.16Å; R250-S252 PolarHBondContact O-N 2.91Å; R250-L253 PolarHBondContact O-N 3.16Å; R250-E254 IonicContact CZ-OE2 2.67Å; R250-E254 IonicContact NH1-OE1 3.96Å; R250-E254 IonicContact NH1-OE2 3.81Å; R250-E254 PolarHBondContact NH1-OE2 3.14Å; R250-E254 IonicContact NH2-OE2 2.84Å; R250-E254 WeakPolarHBondContact O-CB 3.33Å; R250-E254 PolarHBondContact O-N 3.06Å
251	A	89.6	Confident	88.2	Confident	19 Å²	19	31.3 Å²	31.3	16%	0.157	16%	0.156	C	C	.	.	H	α-helix	trans	-60.5	-41.9	178.6	0	0	0	0	0	112.7	E247 E254 R255	E247-A251 PolarHBondContact O-N 3.29Å; A251-E254 PolarHBondContact O-N 2.93Å; A251-R255 PolarHBondContact O-N 2.92Å
252	S	90.7	Very high	89	Confident	24 Å²	24	30.1 Å²	30.1	17%	0.168	15%	0.147	C	C	.	.	H	α-helix	trans	-64.7	-44.4	176.2	175.3	0	0	0	0	112.6	R248 R249 R250 E254 R255 Y256	R248-S252 WeakPolarHBondContact O-CB 3.39Å; R248-S252 PolarHBondContact O-N 3.45Å; R249-S252 PolarHBondContact O-N 3.32Å; R250-S252 PolarHBondContact O-N 2.91Å; S252-E254 VanDerWaalsContact C-N 3.3Å; S252-E254 PolarHBondContact O-N 3.45Å; S252-R255 PolarHBondContact O-N 3.31Å; S252-Y256 WeakPolarHBondContact O-CB 3.45Å; S252-Y256 PolarHBondContact O-N 3.49Å
253	L	93.9	Very high	89.8	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-61.9	-40.2	176.1	-70.7	166.2	0	0	0	111.8	I154 Y170 F194 F197 P219 R249 R250 Y256 I257	I154-L253 HydrophobicContact CD1-CB 3.48Å; I154-L253 VanDerWaalsContact CD1-CB 3.48Å; Y170-L253 HydrophobicContact CD1-CD1 3.91Å; Y170-L253 HydrophobicContact CD2-CD1 3.64Å; Y170-L253 HydrophobicContact CE1-CD1 3.81Å; Y170-L253 HydrophobicContact CE2-CD1 3.54Å; Y170-L253 HydrophobicContact CG-CD1 3.84Å; F194-L253 HydrophobicContact CD2-CD1 4.26Å; F194-L253 HydrophobicContact CD2-CD2 3.85Å; F194-L253 HydrophobicContact CD2-CG 4.39Å; F194-L253 HydrophobicContact CE2-CD2 4.23Å; F197-L253 HydrophobicContact CB-CD2 3.74Å; F197-L253 HydrophobicContact CD1-CD2 3.75Å; F197-L253 HydrophobicContact CD2-CD1 4.47Å; F197-L253 HydrophobicContact CD2-CD2 3.65Å; F197-L253 HydrophobicContact CE1-CB 4.25Å; F197-L253 HydrophobicContact CE1-CD2 4.19Å; F197-L253 HydrophobicContact CE2-CD1 4.29Å; F197-L253 HydrophobicContact CE2-CD2 4.11Å; F197-L253 HydrophobicContact CG-CD2 3.45Å; F197-L253 VanDerWaalsContact CG-CD2 3.45Å; F197-L253 HydrophobicContact CZ-CB 4.35Å; F197-L253 HydrophobicContact CZ-CD2 4.36Å; P219-L253 HydrophobicContact CB-CD2 3.98Å; P219-L253 HydrophobicContact CB-CG 4.48Å; P219-L253 HydrophobicContact CG-CD2 3.67Å; P219-L253 HydrophobicContact CG-CG 4.37Å; R249-L253 HydrophobicContact CG-CD1 3.99Å; R249-L253 HydrophobicContact CG-CG 4.41Å; R249-L253 VanDerWaalsContact O-CG 3.26Å; R249-L253 WeakPolarHBondContact O-CG 3.44Å; R249-L253 PolarHBondContact O-N 2.77Å; R250-L253 PolarHBondContact O-N 3.16Å; L253-Y256 PolarHBondContact O-N 3.12Å; L253-I257 PolarHBondContact O-N 3.48Å
254	E	93.5	Very high	90.4	Very high	20 Å²	20	30.8 Å²	30.8	9%	0.093	15%	0.146	C	C	.	.	H	α-helix	trans	-65.6	-42.5	179.2	-172.2	177.6	-138.4	0	0	111.4	D153 I154 R250 A251 S252 I257 R258	D153-E254 WeakPolarHBondContact CA-OE1 3.44Å; I154-E254 HydrophobicContact CB-CB 4.15Å; I154-E254 HydrophobicContact CB-CG 4.36Å; I154-E254 HydrophobicContact CD1-CB 3.96Å; I154-E254 HydrophobicContact CG1-CB 3.9Å; I154-E254 HydrophobicContact CG1-CG 4.19Å; I154-E254 PolarHBondContact N-OE1 2.94Å; R250-E254 IonicContact CZ-OE2 2.67Å; R250-E254 IonicContact NH1-OE1 3.96Å; R250-E254 IonicContact NH1-OE2 3.81Å; R250-E254 PolarHBondContact NH1-OE2 3.14Å; R250-E254 IonicContact NH2-OE2 2.84Å; R250-E254 WeakPolarHBondContact O-CB 3.33Å; R250-E254 PolarHBondContact O-N 3.06Å; A251-E254 PolarHBondContact O-N 2.93Å; S252-E254 VanDerWaalsContact C-N 3.3Å; S252-E254 PolarHBondContact O-N 3.45Å; E254-I257 WeakPolarHBondContact O-CG2 3.44Å; E254-I257 PolarHBondContact O-N 3.14Å; E254-R258 VanDerWaalsContact CG-NH1 3.28Å; E254-R258 WeakPolarHBondContact O-CB 3.48Å; E254-R258 VanDerWaalsContact O-CG 3.28Å; E254-R258 WeakPolarHBondContact O-CG 3.19Å; E254-R258 PolarHBondContact O-N 3.34Å; E254-R258 IonicContact OE1-CZ 3.23Å; E254-R258 VanDerWaalsContact OE1-CZ 3.26Å; E254-R258 IonicContact OE1-NH1 2.74Å; E254-R258 PolarHBondContact OE1-NH1 2.93Å; E254-R258 IonicContact OE1-NH2 2.66Å; E254-R258 PolarHBondContact OE1-NH2 3.48Å; E254-R258 IonicContact OE2-CZ 2.82Å; E254-R258 IonicContact OE2-NH1 2.79Å; E254-R258 PolarHBondContact OE2-NH1 3.38Å; E254-R258 IonicContact OE2-NH2 3.98Å
255	R	91.3	Very high	91	Very high	40 Å²	40	30.3 Å²	30.3	15%	0.151	15%	0.147	C	C	.	.	H	α-helix	trans	-63.6	-45.4	174.6	-166.4	-176.3	-59	159.5	1.6	112.1	A251 S252 I257 R258 R259 E407 D411	A251-R255 PolarHBondContact O-N 2.92Å; S252-R255 PolarHBondContact O-N 3.31Å; R255-I257 PolarHBondContact O-N 3.04Å; R255-R258 PolarHBondContact O-N 3.39Å; R255-R259 WeakPolarHBondContact O-CG 3.37Å; R255-R259 PolarHBondContact O-N 3.47Å; R255-E407 PolarHBondContact NH1-O 3.38Å; R255-D411 WeakPolarHBondContact CD-OD2 3.43Å; R255-D411 IonicContact CZ-OD2 3.64Å; R255-D411 IonicContact NE-OD2 3.82Å; R255-D411 IonicContact NH1-OD2 2.72Å; R255-D411 PolarHBondContact NH1-OD2 2.98Å; R255-D411 VanDerWaalsContact NH1-OD2 3.14Å
256	Y	94.4	Very high	91.6	Very high	3 Å²	3	29.1 Å²	29.1	1%	0.012	14%	0.142	C	C	.	.	H	α-helix	trans	-55.9	-50	176.7	166.2	-101.9	0	0	0	111.8	F197 L200 H201 P216 P217 P219 S252 L253 T260	F197-Y256 HydrophobicContact CD1-CD1 4.05Å; F197-Y256 HydrophobicContact CD1-CE1 4.25Å; L200-Y256 HydrophobicContact CD2-CE1 4.4Å; H201-Y256 VanDerWaalsContact CA-OH 3.24Å; H201-Y256 WeakPolarHBondContact CA-OH 3.41Å; H201-Y256 HydrophobicContact CB-CE2 4.37Å; H201-Y256 WeakPolarHBondContact CB-OH 3.41Å; H201-Y256 AromaticContact CD2-CE2 3.78Å; H201-Y256 PolarHBondContact N-OH 3.09Å; P216-Y256 HydrophobicContact CB-CD2 3.94Å; P216-Y256 HydrophobicContact CB-CE2 4.24Å; P216-Y256 WeakPolarHBondContact O-CE2 3.27Å; P217-Y256 WeakPolarHBondContact O-CD2 3.4Å; P219-Y256 HydrophobicContact CG-CD1 4.42Å; P219-Y256 HydrophobicContact CG-CG 4.09Å; S252-Y256 WeakPolarHBondContact O-CB 3.45Å; S252-Y256 PolarHBondContact O-N 3.49Å; L253-Y256 PolarHBondContact O-N 3.12Å; Y256-T260 WeakPolarHBondContact O-CB 3.4Å; Y256-T260 PolarHBondContact O-N 3.3Å; Y256-T260 PolarHBondContact O-OG1 2.95Å
257	I	94.5	Very high	91.9	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-70.1	-37.7	-176.7	-159.1	79.1	0	0	0	112.1	I152 F197 L200 L253 E254 R255 T260 A261 F272 F275 I276	I152-I257 HydrophobicContact CB-CG2 4.21Å; I152-I257 HydrophobicContact CD1-CG1 4.04Å; I152-I257 HydrophobicContact CG2-CG1 4.18Å; I152-I257 HydrophobicContact CG2-CG2 3.58Å; F197-I257 HydrophobicContact CE1-CB 4.41Å; F197-I257 HydrophobicContact CE1-CD1 4.32Å; L200-I257 HydrophobicContact CD2-CD1 4.13Å; L253-I257 PolarHBondContact O-N 3.48Å; E254-I257 WeakPolarHBondContact O-CG2 3.44Å; E254-I257 PolarHBondContact O-N 3.14Å; R255-I257 PolarHBondContact O-N 3.04Å; I257-T260 PolarHBondContact O-N 3.31Å; I257-A261 PolarHBondContact O-N 3.34Å; I257-F272 HydrophobicContact CD1-CD2 4.35Å; I257-F272 HydrophobicContact CD1-CE2 3.5Å; I257-F272 VanDerWaalsContact CD1-CE2 3.5Å; I257-F272 HydrophobicContact CD1-CZ 4.2Å; I257-F272 HydrophobicContact CG1-CE2 4.07Å; I257-F272 HydrophobicContact CG1-CZ 4.32Å; I257-F275 HydrophobicContact CD1-CD1 3.84Å; I257-F275 HydrophobicContact CD1-CE1 3.7Å; I257-I276 HydrophobicContact CD1-CG2 4.21Å; I257-I276 HydrophobicContact CG1-CG2 4.31Å
258	R	93.4	Very high	92.1	Very high	89 Å²	89	33.9 Å²	33.9	34%	0.336	16%	0.157	S	C	.	.	H	α-helix	trans	-61.2	-50.9	174.7	-76.8	177.4	178.7	142.9	1.6	111.4	I152 D153 E254 R255 T260 A261 D262	I152-R258 HydrophobicContact CB-CG 4.45Å; I152-R258 VanDerWaalsContact O-CG 3.28Å; I152-R258 WeakPolarHBondContact O-CG 3.35Å; I152-R258 PolarHBondContact O-NE 3Å; I152-R258 PolarHBondContact O-NH2 3.48Å; D153-R258 IonicContact OD1-CZ 2.78Å; D153-R258 IonicContact OD1-NE 2.6Å; D153-R258 IonicContact OD1-NH2 2.66Å; D153-R258 PolarHBondContact OD1-NH2 2.92Å; E254-R258 VanDerWaalsContact CG-NH1 3.28Å; E254-R258 WeakPolarHBondContact O-CB 3.48Å; E254-R258 VanDerWaalsContact O-CG 3.28Å; E254-R258 WeakPolarHBondContact O-CG 3.19Å; E254-R258 PolarHBondContact O-N 3.34Å; E254-R258 IonicContact OE1-CZ 3.23Å; E254-R258 VanDerWaalsContact OE1-CZ 3.26Å; E254-R258 IonicContact OE1-NH1 2.74Å; E254-R258 PolarHBondContact OE1-NH1 2.93Å; E254-R258 IonicContact OE1-NH2 2.66Å; E254-R258 PolarHBondContact OE1-NH2 3.48Å; E254-R258 IonicContact OE2-CZ 2.82Å; E254-R258 IonicContact OE2-NH1 2.79Å; E254-R258 PolarHBondContact OE2-NH1 3.38Å; E254-R258 IonicContact OE2-NH2 3.98Å; R255-R258 PolarHBondContact O-N 3.39Å; R258-T260 PolarHBondContact O-N 3.43Å; R258-A261 WeakPolarHBondContact O-CA 3.49Å; R258-A261 WeakPolarHBondContact O-CB 3.37Å; R258-A261 PolarHBondContact O-N 2.92Å; R258-D262 PolarHBondContact O-N 3.22Å
259	R	92.5	Very high	92.5	Very high	19 Å²	19	30.8 Å²	30.8	7%	0.072	15%	0.145	C	C	.	.	H	α-helix	trans	-62	-32.7	177.8	-74.5	-173.7	177	163.9	4.9	113.5	P216 R255 H263 D411 E501	P216-R259 HydrophobicContact CB-CB 4.07Å; P216-R259 HydrophobicContact CG-CB 3.71Å; R255-R259 WeakPolarHBondContact O-CG 3.37Å; R255-R259 PolarHBondContact O-N 3.47Å; R259-H263 PolarHBondContact O-N 3.12Å; R259-D411 IonicContact CZ-OD2 2.74Å; R259-D411 VanDerWaalsContact NH1-CG 3.28Å; R259-D411 IonicContact NH1-OD1 4Å; R259-D411 PolarHBondContact NH1-OD1 2.99Å; R259-D411 IonicContact NH1-OD2 2.68Å; R259-D411 PolarHBondContact NH1-OD2 3.41Å; R259-D411 IonicContact NH2-OD2 3.83Å; R259-D411 PolarHBondContact NH2-OD2 3.01Å; R259-E501 IonicContact CZ-OE2 2.87Å; R259-E501 IonicContact NE-OE1 3.11Å; R259-E501 IonicContact NE-OE2 3.93Å; R259-E501 PolarHBondContact NE-OE2 2.88Å; R259-E501 IonicContact NH2-OE2 3.74Å; R259-E501 PolarHBondContact NH2-OE2 2.93Å
260	T	94.4	Very high	92.7	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-68.4	-41.1	174.5	-53.5	0	0	0	0	110.7	L204 Y256 I257 R258 D262 H263 L266 F272	L204-T260 HydrophobicContact CD1-CG2 3.77Å; Y256-T260 WeakPolarHBondContact O-CB 3.4Å; Y256-T260 PolarHBondContact O-N 3.3Å; Y256-T260 PolarHBondContact O-OG1 2.95Å; I257-T260 PolarHBondContact O-N 3.31Å; R258-T260 PolarHBondContact O-N 3.43Å; T260-D262 VanDerWaalsContact C-N 3.34Å; T260-H263 PolarHBondContact O-N 2.82Å; T260-L266 HydrophobicContact CG2-CB 3.9Å; T260-L266 HydrophobicContact CG2-CD1 4.06Å; T260-F272 HydrophobicContact CG2-CD2 3.41Å; T260-F272 VanDerWaalsContact CG2-CD2 3.41Å; T260-F272 HydrophobicContact CG2-CE2 3.31Å; T260-F272 HydrophobicContact CG2-CG 4.2Å; T260-F272 HydrophobicContact CG2-CZ 4.03Å
261	A	92.8	Very high	92.8	Very high	4 Å²	4	34.2 Å²	34.2	3%	0.033	17%	0.173	C	C	.	.	H	α-helix	trans	-66.6	-32.8	175.2	0	0	0	0	0	113.2	I152 I257 R258 H263 L267 F272	I152-A261 HydrophobicContact CD1-CB 3.63Å; I152-A261 HydrophobicContact CG1-CB 4.37Å; I257-A261 PolarHBondContact O-N 3.34Å; R258-A261 WeakPolarHBondContact O-CA 3.49Å; R258-A261 WeakPolarHBondContact O-CB 3.37Å; R258-A261 PolarHBondContact O-N 2.92Å; A261-H263 PolarHBondContact O-N 3.23Å; A261-L267 HydrophobicContact CB-CD1 4.49Å; A261-F272 HydrophobicContact CB-CE1 4.16Å; A261-F272 HydrophobicContact CB-CZ 3.88Å
262	D	91	Very high	93	Very high	66 Å²	66	33.3 Å²	33.3	35%	0.353	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-13.5	177	-70.7	-30	0	0	0	112.9	R258 T260 R493	R258-D262 PolarHBondContact O-N 3.22Å; T260-D262 VanDerWaalsContact C-N 3.34Å; D262-R493 PolarHBondContact O-NH2 3.47Å
263	H	92.7	Very high	93.1	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.005	17%	0.167	C	C	.	.	S	Bend	trans	-87.6	119	179	-170	-38.2	0	0	0	110.6	I214 R259 T260 A261 V265 L266 L267 E490 R493	I214-H263 PolarHBondContact O-CD2 3.15Å; R259-H263 PolarHBondContact O-N 3.12Å; T260-H263 PolarHBondContact O-N 2.82Å; A261-H263 PolarHBondContact O-N 3.23Å; H263-V265 VanDerWaalsContact C-N 3.3Å; H263-V265 PolarHBondContact ND1-N 3.16Å; H263-V265 PolarHBondContact O-N 3.02Å; H263-L266 HydrophobicContact CB-CB 3.98Å; H263-L266 HydrophobicContact CB-CD1 3.8Å; H263-L266 HydrophobicContact CB-CG 3.85Å; H263-L266 PolarHBondContact O-N 2.97Å; H263-L266 VanDerWaalsContact O-N 3.17Å; H263-L267 VanDerWaalsContact O-CB 3.31Å; H263-L267 WeakPolarHBondContact O-CB 3.44Å; H263-L267 PolarHBondContact O-N 3.13Å; H263-E490 IonicContact CD2-OE2 3.83Å; H263-E490 IonicContact CE1-OE1 2.86Å; H263-E490 PolarHBondContact CE1-OE1 2.84Å; H263-E490 VanDerWaalsContact CE1-OE1 3.24Å; H263-E490 IonicContact CE1-OE2 2.64Å; H263-E490 IonicContact NE2-OE1 3.48Å; H263-E490 PolarHBondContact NE2-OE1 2.92Å; H263-E490 IonicContact NE2-OE2 3.85Å; H263-E490 PolarHBondContact NE2-OE2 2.92Å; H263-E490 VanDerWaalsContact NE2-OE2 3.11Å; H263-R493 PolarHBondContact CD2-NH1 2.86Å; H263-R493 VanDerWaalsContact CD2-NH1 3.29Å
264	P	91.1	Very high	93	Very high	68 Å²	68	37.4 Å²	37.4	44%	0.442	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-32.7	-170.3	22.4	-34.4	0	0	0	114.2	R268	P264-R268 WeakPolarHBondContact O-CD 3.47Å; P264-R268 WeakPolarHBondContact O-CG 3.4Å
265	V	93.4	Very high	93.1	Very high	46 Å²	46	36.6 Å²	36.6	28%	0.279	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-48.3	174.3	-176.5	0	0	0	0	112	Y208 H263 L267 R268 D269	Y208-V265 HydrophobicContact CD1-CG1 4.11Å; Y208-V265 HydrophobicContact CE1-CG1 3.48Å; Y208-V265 VanDerWaalsContact CE1-CG1 3.48Å; H263-V265 VanDerWaalsContact C-N 3.3Å; H263-V265 PolarHBondContact ND1-N 3.16Å; H263-V265 PolarHBondContact O-N 3.02Å; V265-L267 VanDerWaalsContact C-N 3.34Å; V265-L267 PolarHBondContact O-N 3.06Å; V265-R268 PolarHBondContact O-N 3.43Å; V265-R268 VanDerWaalsContact O-N 3.16Å; V265-D269 PolarHBondContact O-N 3.4Å
266	L	94.4	Very high	93.1	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-67.7	-34.2	-177.3	-53.5	178.7	0	0	0	112	L204 Y208 V215 T260 H263 R268 D269 F272	L204-L266 HydrophobicContact CD2-CD2 4.47Å; Y208-L266 HydrophobicContact CD1-CD2 4.45Å; Y208-L266 HydrophobicContact CD2-CD2 3.42Å; Y208-L266 VanDerWaalsContact CD2-CD2 3.42Å; Y208-L266 HydrophobicContact CE2-CD2 3.75Å; Y208-L266 HydrophobicContact CG-CD2 3.82Å; V215-L266 HydrophobicContact CG2-CD1 4.49Å; V215-L266 HydrophobicContact CG2-CD2 4.45Å; T260-L266 HydrophobicContact CG2-CB 3.9Å; T260-L266 HydrophobicContact CG2-CD1 4.06Å; H263-L266 HydrophobicContact CB-CB 3.98Å; H263-L266 HydrophobicContact CB-CD1 3.8Å; H263-L266 HydrophobicContact CB-CG 3.85Å; H263-L266 PolarHBondContact O-N 2.97Å; H263-L266 VanDerWaalsContact O-N 3.17Å; L266-R268 PolarHBondContact O-N 2.93Å; L266-D269 WeakPolarHBondContact O-CB 3.42Å; L266-D269 PolarHBondContact O-N 2.84Å; L266-F272 WeakPolarHBondContact O-CB 3.49Å
267	L	92.4	Very high	92.9	Very high	5 Å²	5	36.2 Å²	36.2	3%	0.026	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-59.1	-31.2	174	178.3	59.6	0	0	0	113.1	L148 I150 F183 A261 H263 V265 D269 F272 Q273	L148-L267 HydrophobicContact CB-CD2 4.15Å; I150-L267 HydrophobicContact CD1-CD1 3.73Å; I150-L267 HydrophobicContact CD1-CD2 4.4Å; F183-L267 HydrophobicContact CE2-CD1 4.39Å; F183-L267 HydrophobicContact CZ-CD1 4.15Å; A261-L267 HydrophobicContact CB-CD1 4.49Å; H263-L267 VanDerWaalsContact O-CB 3.31Å; H263-L267 WeakPolarHBondContact O-CB 3.44Å; H263-L267 PolarHBondContact O-N 3.13Å; V265-L267 VanDerWaalsContact C-N 3.34Å; V265-L267 PolarHBondContact O-N 3.06Å; L267-D269 VanDerWaalsContact C-N 3.34Å; L267-F272 HydrophobicContact CD1-CD1 4.37Å; L267-F272 HydrophobicContact CD1-CE1 3.88Å; L267-Q273 VanDerWaalsContact O-CG 3.27Å; L267-Q273 WeakPolarHBondContact O-CG 3.44Å; L267-Q273 PolarHBondContact O-NE2 3.21Å; L267-Q273 VanDerWaalsContact O-NE2 3.1Å
268	R	91.5	Very high	92.7	Very high	170 Å²	170	40.4 Å²	40.4	64%	0.642	20%	0.201	S	C	*	.	G	3₁₀ helix	trans	-89.2	-3.4	179.2	-65.1	177.1	-174.2	177.8	3.2	112.8	P264 V265 L266	P264-R268 WeakPolarHBondContact O-CD 3.47Å; P264-R268 WeakPolarHBondContact O-CG 3.4Å; V265-R268 PolarHBondContact O-N 3.43Å; V265-R268 VanDerWaalsContact O-N 3.16Å; L266-R268 PolarHBondContact O-N 2.93Å
269	D	94.2	Very high	92	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.211	C	C	.	.			trans	-68.7	131.4	179.7	-178	-93.6	0	0	0	110.9	L204 K207 Y208 V265 L266 L267 D271 F272 Q273	L204-D269 HydrophobicContact CD2-CB 3.94Å; L204-D269 WeakPolarHBondContact CD2-OD1 3.36Å; K207-D269 IonicContact NZ-OD2 3.25Å; K207-D269 PolarHBondContact NZ-OD2 3.39Å; Y208-D269 HydrophobicContact CE2-CB 4.11Å; Y208-D269 WeakPolarHBondContact CE2-OD2 3.37Å; Y208-D269 PolarHBondContact OH-OD2 2.92Å; V265-D269 PolarHBondContact O-N 3.4Å; L266-D269 WeakPolarHBondContact O-CB 3.42Å; L266-D269 PolarHBondContact O-N 2.84Å; L267-D269 VanDerWaalsContact C-N 3.34Å; D269-D271 VanDerWaalsContact C-N 3.34Å; D269-D271 PolarHBondContact O-N 3.35Å; D269-D271 WeakPolarHBondContact OD1-CA 3.37Å; D269-D271 VanDerWaalsContact OD1-CB 3.25Å; D269-D271 WeakPolarHBondContact OD1-CB 3.41Å; D269-D271 PolarHBondContact OD1-N 3.44Å; D269-F272 HydrophobicContact CB-CB 4.08Å; D269-F272 PolarHBondContact O-N 3.45Å; D269-F272 PolarHBondContact OD1-N 2.91Å; D269-F272 VanDerWaalsContact OD1-N 3.12Å; D269-Q273 WeakPolarHBondContact O-CG 3.37Å; D269-Q273 PolarHBondContact O-N 2.73Å
270	P	93.4	Very high	91.4	Very high	87 Å²	87	42.1 Å²	42.1	57%	0.565	22%	0.223	S	C	*	.	H	α-helix	trans	-60.9	-36.2	-180	-25.7	34.9	0	0	0	114.5	N274	P270-N274 WeakPolarHBondContact O-CB 3.39Å; P270-N274 PolarHBondContact O-N 3.38Å
271	D	93.4	Very high	90.4	Very high	57 Å²	57	48.8 Å²	48.8	31%	0.305	25%	0.254	S	S	.	.	H	α-helix	trans	-68.1	-40.4	177.7	-73.6	-72.5	0	0	0	110.4	L200 K203 D269 F275	L200-D271 HydrophobicContact CD1-CB 4.28Å; K203-D271 HydrophobicContact CD-CB 4.27Å; K203-D271 IonicContact NZ-OD1 3.74Å; K203-D271 PolarHBondContact NZ-OD1 3.33Å; D269-D271 VanDerWaalsContact C-N 3.34Å; D269-D271 PolarHBondContact O-N 3.35Å; D269-D271 WeakPolarHBondContact OD1-CA 3.37Å; D269-D271 VanDerWaalsContact OD1-CB 3.25Å; D269-D271 WeakPolarHBondContact OD1-CB 3.41Å; D269-D271 PolarHBondContact OD1-N 3.44Å; D271-F275 VanDerWaalsContact O-CB 3.31Å; D271-F275 WeakPolarHBondContact O-CB 3.31Å; D271-F275 PolarHBondContact O-N 3.09Å
272	F	94.5	Very high	89.3	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-64.8	-49.4	174.7	-176.1	-103.2	0	0	0	112.5	I152 L200 L204 I257 T260 A261 L266 L267 D269 N274 F275 I276	I152-F272 HydrophobicContact CD1-CZ 4.16Å; L200-F272 HydrophobicContact CD1-CB 4.41Å; L200-F272 HydrophobicContact CD2-CD2 4Å; L204-F272 HydrophobicContact CD1-CD2 4.46Å; I257-F272 HydrophobicContact CD1-CD2 4.35Å; I257-F272 HydrophobicContact CD1-CE2 3.5Å; I257-F272 VanDerWaalsContact CD1-CE2 3.5Å; I257-F272 HydrophobicContact CD1-CZ 4.2Å; I257-F272 HydrophobicContact CG1-CE2 4.07Å; I257-F272 HydrophobicContact CG1-CZ 4.32Å; T260-F272 HydrophobicContact CG2-CD2 3.41Å; T260-F272 VanDerWaalsContact CG2-CD2 3.41Å; T260-F272 HydrophobicContact CG2-CE2 3.31Å; T260-F272 HydrophobicContact CG2-CG 4.2Å; T260-F272 HydrophobicContact CG2-CZ 4.03Å; A261-F272 HydrophobicContact CB-CE1 4.16Å; A261-F272 HydrophobicContact CB-CZ 3.88Å; L266-F272 WeakPolarHBondContact O-CB 3.49Å; L267-F272 HydrophobicContact CD1-CD1 4.37Å; L267-F272 HydrophobicContact CD1-CE1 3.88Å; D269-F272 HydrophobicContact CB-CB 4.08Å; D269-F272 PolarHBondContact O-N 3.45Å; D269-F272 PolarHBondContact OD1-N 2.91Å; D269-F272 VanDerWaalsContact OD1-N 3.12Å; F272-N274 VanDerWaalsContact C-N 3.33Å; F272-N274 PolarHBondContact O-N 3.48Å; F272-F275 WeakPolarHBondContact O-CB 3.26Å; F272-F275 PolarHBondContact O-N 3.45Å; F272-F275 VanDerWaalsContact O-N 3.09Å; F272-I276 HydrophobicContact CD1-CD1 4.18Å; F272-I276 HydrophobicContact CE1-CD1 3.74Å; F272-I276 HydrophobicContact CE1-CG2 4.42Å; F272-I276 HydrophobicContact CE2-CG2 4.33Å; F272-I276 HydrophobicContact CZ-CD1 4.35Å; F272-I276 HydrophobicContact CZ-CG2 4.11Å; F272-I276 PolarHBondContact O-N 3.04Å; F272-I276 VanDerWaalsContact O-N 3.11Å
273	Q	92.5	Very high	88.1	Confident	41 Å²	41	52.4 Å²	52.4	19%	0.192	28%	0.278	C	S	.	.	H	α-helix	trans	-60.1	-44.4	178.3	-72.1	-173	-5.7	0	0	111.5	F183 L267 D269 F275 I276 T277	F183-Q273 HydrophobicContact CZ-CG 4.26Å; L267-Q273 VanDerWaalsContact O-CG 3.27Å; L267-Q273 WeakPolarHBondContact O-CG 3.44Å; L267-Q273 PolarHBondContact O-NE2 3.21Å; L267-Q273 VanDerWaalsContact O-NE2 3.1Å; D269-Q273 WeakPolarHBondContact O-CG 3.37Å; D269-Q273 PolarHBondContact O-N 2.73Å; Q273-F275 VanDerWaalsContact C-N 3.3Å; Q273-F275 PolarHBondContact O-N 3.37Å; Q273-I276 WeakPolarHBondContact O-CG1 3.21Å; Q273-I276 PolarHBondContact O-N 2.81Å; Q273-T277 WeakPolarHBondContact O-CB 3.35Å; Q273-T277 WeakPolarHBondContact O-CG2 3.4Å; Q273-T277 PolarHBondContact O-N 3.1Å; Q273-T277 PolarHBondContact O-OG1 3.03Å
274	N	92.7	Very high	86.3	Confident	69 Å²	69	60.2 Å²	60.2	37%	0.369	31%	0.312	S	S	.	.	H	α-helix	trans	-62.2	-40	175.2	-172.6	50.8	0	0	0	111.2	R192 P270 F272 I276 T277 F278	R192-N274 PolarHBondContact NH2-O 2.98Å; P270-N274 WeakPolarHBondContact O-CB 3.39Å; P270-N274 PolarHBondContact O-N 3.38Å; F272-N274 VanDerWaalsContact C-N 3.33Å; F272-N274 PolarHBondContact O-N 3.48Å; N274-I276 VanDerWaalsContact C-N 3.33Å; N274-I276 PolarHBondContact O-N 2.63Å; N274-T277 PolarHBondContact O-N 2.61Å; N274-F278 WeakPolarHBondContact O-CB 3.48Å; N274-F278 PolarHBondContact O-N 3.09Å; N274-F278 WeakPolarHBondContact OD1-CB 3.4Å
275	F	93.8	Very high	84.4	Confident	4 Å²	4	58.2 Å²	58.2	2%	0.018	30%	0.302	C	S	.	.	H	α-helix	trans	-59.1	-40.4	177.6	-175.7	-87.7	0	0	0	112.9	R192 D196 F197 L200 I257 D271 F272 Q273 L282	R192-F275 HydrophobicContact CB-CE1 4.45Å; R192-F275 HydrophobicContact CB-CE2 4.31Å; R192-F275 HydrophobicContact CB-CZ 3.79Å; R192-F275 HydrophobicContact CG-CE1 3.84Å; R192-F275 HydrophobicContact CG-CE2 3.95Å; R192-F275 HydrophobicContact CG-CZ 3.52Å; R192-F275 VanDerWaalsContact CZ-O 3.22Å; R192-F275 PolarHBondContact NE-O 3.31Å; R192-F275 PolarHBondContact NH2-O 2.91Å; D196-F275 HydrophobicContact CB-CE2 3.78Å; F197-F275 HydrophobicContact CD1-CE1 4.01Å; F197-F275 AromaticContact CD1-CZ 3.65Å; F197-F275 HydrophobicContact CD1-CZ 3.65Å; F197-F275 AromaticContact CD2-CZ 3.9Å; F197-F275 HydrophobicContact CD2-CZ 3.9Å; F197-F275 AromaticContact CE1-CE1 3.78Å; F197-F275 HydrophobicContact CE1-CE1 3.78Å; F197-F275 AromaticContact CE1-CZ 3.73Å; F197-F275 HydrophobicContact CE1-CZ 3.73Å; F197-F275 AromaticContact CE2-CZ 3.97Å; F197-F275 HydrophobicContact CE2-CZ 3.97Å; F197-F275 AromaticContact CG-CZ 3.75Å; F197-F275 HydrophobicContact CG-CZ 3.75Å; F197-F275 HydrophobicContact CZ-CE1 4.11Å; F197-F275 AromaticContact CZ-CZ 3.88Å; F197-F275 HydrophobicContact CZ-CZ 3.88Å; L200-F275 HydrophobicContact CB-CD2 4.07Å; L200-F275 HydrophobicContact CB-CE2 4.3Å; L200-F275 HydrophobicContact CD1-CB 4.31Å; L200-F275 HydrophobicContact CD2-CB 4.06Å; L200-F275 HydrophobicContact CD2-CD1 3.8Å; L200-F275 HydrophobicContact CD2-CD2 3.91Å; L200-F275 HydrophobicContact CD2-CE1 4.19Å; L200-F275 HydrophobicContact CD2-CE2 4.27Å; L200-F275 HydrophobicContact CD2-CG 3.66Å; L200-F275 HydrophobicContact CD2-CZ 4.4Å; L200-F275 HydrophobicContact CG-CD2 4.47Å; I257-F275 HydrophobicContact CD1-CD1 3.84Å; I257-F275 HydrophobicContact CD1-CE1 3.7Å; D271-F275 VanDerWaalsContact O-CB 3.31Å; D271-F275 WeakPolarHBondContact O-CB 3.31Å; D271-F275 PolarHBondContact O-N 3.09Å; F272-F275 WeakPolarHBondContact O-CB 3.26Å; F272-F275 PolarHBondContact O-N 3.45Å; F272-F275 VanDerWaalsContact O-N 3.09Å; Q273-F275 VanDerWaalsContact C-N 3.3Å; Q273-F275 PolarHBondContact O-N 3.37Å; F275-L282 HydrophobicContact CD2-CD1 3.57Å; F275-L282 HydrophobicContact CE2-CD1 4.08Å; F275-L282 HydrophobicContact CG-CD1 4.45Å
276	I	92.7	Very high	81.8	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-89.6	-22.6	-177.6	65	-179.4	0	0	0	114.2	I152 T174 F183 Y188 I257 F272 Q273 N274	I152-I276 HydrophobicContact CD1-CD1 4.47Å; I152-I276 HydrophobicContact CD1-CG2 4.16Å; T174-I276 HydrophobicContact CG2-CD1 4.23Å; F183-I276 HydrophobicContact CE1-CD1 3.65Å; F183-I276 HydrophobicContact CE1-CG1 4.18Å; F183-I276 HydrophobicContact CZ-CD1 3.82Å; Y188-I276 WeakPolarHBondContact CB-O 3.4Å; I257-I276 HydrophobicContact CD1-CG2 4.21Å; I257-I276 HydrophobicContact CG1-CG2 4.31Å; F272-I276 HydrophobicContact CD1-CD1 4.18Å; F272-I276 HydrophobicContact CE1-CD1 3.74Å; F272-I276 HydrophobicContact CE1-CG2 4.42Å; F272-I276 HydrophobicContact CE2-CG2 4.33Å; F272-I276 HydrophobicContact CZ-CD1 4.35Å; F272-I276 HydrophobicContact CZ-CG2 4.11Å; F272-I276 PolarHBondContact O-N 3.04Å; F272-I276 VanDerWaalsContact O-N 3.11Å; Q273-I276 WeakPolarHBondContact O-CG1 3.21Å; Q273-I276 PolarHBondContact O-N 2.81Å; N274-I276 VanDerWaalsContact C-N 3.33Å; N274-I276 PolarHBondContact O-N 2.63Å
277	T	90.4	Very high	79.2	Confident	34 Å²	34	65 Å²	65	21%	0.209	34%	0.342	C	S	.	.	H	α-helix	trans	-102.1	-27.4	-175.8	60.7	0	0	0	0	114.7	F183 Y188 Q273 N274 E279	F183-T277 HydrophobicContact CD1-CG2 3.71Å; F183-T277 HydrophobicContact CE1-CG2 3.7Å; Y188-T277 HydrophobicContact CD1-CG2 3.98Å; Y188-T277 WeakPolarHBondContact CD1-O 3.34Å; Y188-T277 HydrophobicContact CD2-CG2 4.08Å; Y188-T277 HydrophobicContact CE1-CG2 3.87Å; Y188-T277 HydrophobicContact CE2-CG2 3.99Å; Y188-T277 HydrophobicContact CG-CG2 4.07Å; Q273-T277 WeakPolarHBondContact O-CB 3.35Å; Q273-T277 WeakPolarHBondContact O-CG2 3.4Å; Q273-T277 PolarHBondContact O-N 3.1Å; Q273-T277 PolarHBondContact O-OG1 3.03Å; N274-T277 PolarHBondContact O-N 2.61Å; T277-E279 PolarHBondContact O-N 2.96Å
278	F	88.6	Confident	77	Confident	88 Å²	88	68.9 Å²	68.9	39%	0.386	37%	0.367	S	S	.	.			trans	-77.3	114.4	-174.6	-176.4	-110	0	0	0	111.8	R192 N274 G280 L282	R192-F278 PolarHBondContact NH1-O 3.28Å; R192-F278 PolarHBondContact NH2-O 2.9Å; N274-F278 WeakPolarHBondContact O-CB 3.48Å; N274-F278 PolarHBondContact O-N 3.09Å; N274-F278 WeakPolarHBondContact OD1-CB 3.4Å; F278-G280 VanDerWaalsContact C-N 3.28Å; F278-G280 VanDerWaalsContact CD1-O 3.31Å; F278-G280 WeakPolarHBondContact CD1-O 3.48Å; F278-G280 WeakPolarHBondContact CE1-O 3.25Å; F278-G280 PolarHBondContact O-N 3.32Å; F278-L282 HydrophobicContact CD1-CD2 3.99Å
279	E	80.1	Confident	74.3	Confident	114 Å²	114	65.5 Å²	65.5	53%	0.533	38%	0.375	S	S	.	.			trans	-76.1	-14.4	-176.7	-64.5	174.9	-168.8	0	0	113.4	K185 T277	K185-E279 IonicContact NZ-OE1 2.91Å; K185-E279 PolarHBondContact NZ-OE1 3Å; K185-E279 IonicContact NZ-OE2 2.76Å; T277-E279 PolarHBondContact O-N 2.96Å
280	G	79.8	Confident	71.6	Confident	31 Å²	31	69.4 Å²	69.4	32%	0.32	40%	0.398	S	S	.	.	S	Bend	trans	-80.1	170.6	178.2	0	0	0	0	0	114.2	R192 F278 L282	R192-G280 PolarHBondContact NH1-O 3.38Å; F278-G280 VanDerWaalsContact C-N 3.28Å; F278-G280 VanDerWaalsContact CD1-O 3.31Å; F278-G280 WeakPolarHBondContact CD1-O 3.48Å; F278-G280 WeakPolarHBondContact CE1-O 3.25Å; F278-G280 PolarHBondContact O-N 3.32Å; G280-L282 PolarHBondContact O-N 3.45Å
281	E	72.2	Confident	69.1	Low	140 Å²	140	74.4 Å²	74.4	65%	0.654	42%	0.418	S	S	*	.	P	Polyproline II helix	trans	-66.9	123.6	168.7	-65.8	-167.6	165	0	0	109.4
282	L	70.5	Confident	66.4	Low	33 Å²	33	75.2 Å²	75.2	17%	0.173	43%	0.428	C	S	.	.	P	Polyproline II helix	trans	-62.5	143.2	171.4	-70.5	169	0	0	0	108.5	D196 F275 F278 G280 K284	D196-L282 HydrophobicContact CB-CD1 4.32Å; F275-L282 HydrophobicContact CD2-CD1 3.57Å; F275-L282 HydrophobicContact CE2-CD1 4.08Å; F275-L282 HydrophobicContact CG-CD1 4.45Å; F278-L282 HydrophobicContact CD1-CD2 3.99Å; G280-L282 PolarHBondContact O-N 3.45Å; L282-K284 PolarHBondContact O-N 3.44Å
283	P	65	Low	64.2	Low	113 Å²	113	77.4 Å²	77.4	73%	0.734	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-48.5	124.3	169	-23.2	31.7	0	0	0	107.8	A285	P283-A285 PolarHBondContact O-N 3.03Å
284	K	56.8	Low	62.3	Low	165 Å²	165	78.6 Å²	78.6	72%	0.717	46%	0.461	S	S	*	.			trans	-44.2	119.2	-179.7	-75	-178.8	180	175	0	107	L282 S286	L282-K284 PolarHBondContact O-N 3.44Å; K284-S286 VanDerWaalsContact C-N 3.33Å; K284-S286 PolarHBondContact O-N 3.05Å
285	A	50.1	Low	60.3	Low	26 Å²	26	78.7 Å²	78.7	22%	0.215	47%	0.465	C	S	.	.			trans	-49	106.1	175.6	0	0	0	0	0	106.9	P283 Q287 T288	P283-A285 PolarHBondContact O-N 3.03Å; A285-Q287 PolarHBondContact O-N 2.87Å; A285-T288 PolarHBondContact O-N 3.34Å
286	S	38	Very low	58.6	Low	110 Å²	110	84.5 Å²	84.5	77%	0.769	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	40.2	-172.5	-176.9	0	0	0	0	110.3	K284	K284-S286 VanDerWaalsContact C-N 3.33Å; K284-S286 PolarHBondContact O-N 3.05Å
287	Q	41.7	Very low	57.1	Low	77 Å²	77	90.8 Å²	90.8	36%	0.36	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125	-1.6	176.3	-68.3	-150.1	41.8	0	0	112.5	A285	A285-Q287 PolarHBondContact O-N 2.87Å
288	T	44.7	Very low	55.8	Low	88 Å²	88	92.9 Å²	92.9	54%	0.54	53%	0.526	S	S	.	.	S	Bend	trans	-116.5	3	-176.9	-14.6	0	0	0	0	115.3	A285	A285-T288 PolarHBondContact O-N 3.34Å
289	A	35.5	Very low	54.7	Low	99 Å²	99	93.1 Å²	93.1	82%	0.818	53%	0.531	S	S	*	.	S	Bend	trans	-117.7	13.3	-179.3	0	0	0	0	0	114.5
290	V	38.1	Very low	53.6	Low	81 Å²	81	96.3 Å²	96.3	49%	0.491	54%	0.538	S	S	.	.			trans	-127.1	111	171.7	-125.7	0	0	0	0	108.6	S292	V290-S292 PolarHBondContact O-N 3.32Å
291	I	39.6	Very low	52.8	Low	192 Å²	192	97.9 Å²	97.9	99%	0.985	54%	0.539	S	S	*	.	S	Bend	trans	-67.5	69.7	152.6	-59.8	171.9	0	0	0	105.3
292	S	38.2	Very low	52.4	Low	74 Å²	74	99.4 Å²	99.4	52%	0.517	54%	0.539	S	S	.	.	S	Bend	trans	-159.1	122.3	-174.1	-175.9	0	0	0	0	110.4	V290 T294	V290-S292 PolarHBondContact O-N 3.32Å; S292-T294 VanDerWaalsContact C-N 3.35Å; S292-T294 PolarHBondContact O-N 2.98Å
293	G	46.3	Very low	51.9	Low	47 Å²	47	101.2 Å²	101.2	49%	0.485	55%	0.551	S	S	.	*	S	Bend	trans	69.6	-66.3	164.1	0	0	0	0	0	117.4	I296 K297	G293-I296 PolarHBondContact O-N 2.63Å; G293-K297 WeakPolarHBondContact O-CB 3.46Å; G293-K297 PolarHBondContact O-N 2.95Å
294	T	52.7	Low	51.8	Low	65 Å²	65	97.9 Å²	97.9	40%	0.399	53%	0.53	S	S	.	.	H	α-helix	trans	-73.9	-38.4	-160	-38.1	0	0	0	0	113.6	S292 K297 R298	S292-T294 VanDerWaalsContact C-N 3.35Å; S292-T294 PolarHBondContact O-N 2.98Å; T294-K297 PolarHBondContact O-N 3.45Å; T294-R298 WeakPolarHBondContact O-CG 3.4Å; T294-R298 PolarHBondContact O-N 3.34Å
295	T	52.2	Low	51.9	Low	72 Å²	72	92.6 Å²	92.6	44%	0.442	51%	0.508	S	S	.	.	H	α-helix	trans	-68.5	-37.9	175.7	-54.1	0	0	0	0	111.6	R298 I299	T295-R298 PolarHBondContact O-N 2.95Å; T295-R298 PolarHBondContact OG1-NH1 2.95Å; T295-I299 HydrophobicContact CG2-CD1 4.42Å; T295-I299 WeakPolarHBondContact O-CG1 3.23Å; T295-I299 PolarHBondContact O-N 3.35Å
296	I	58.2	Low	52.5	Low	126 Å²	126	92.8 Å²	92.8	65%	0.646	51%	0.513	S	S	*	.	H	α-helix	trans	-67.7	-41.1	174.5	-62.4	172.5	0	0	0	109.6	G293 R298 I299 W300	G293-I296 PolarHBondContact O-N 2.63Å; I296-R298 PolarHBondContact O-N 3.3Å; I296-I299 PolarHBondContact O-N 3.45Å; I296-W300 WeakPolarHBondContact O-CB 3.29Å; I296-W300 PolarHBondContact O-N 3.12Å
297	K	59.6	Low	53.5	Low	132 Å²	132	94.3 Å²	94.3	57%	0.574	51%	0.506	S	S	*	.	H	α-helix	trans	-58.7	-44.8	173.2	-165.6	-171.4	171.7	-173	0	111.1	G293 T294 I299 W300 D301	G293-K297 WeakPolarHBondContact O-CB 3.46Å; G293-K297 PolarHBondContact O-N 2.95Å; T294-K297 PolarHBondContact O-N 3.45Å; K297-I299 VanDerWaalsContact C-N 3.34Å; K297-I299 PolarHBondContact O-N 2.8Å; K297-W300 CarbonylContact O-C 3.57Å; K297-W300 PolarHBondContact O-N 3.03Å; K297-D301 VanDerWaalsContact O-CB 3.27Å; K297-D301 WeakPolarHBondContact O-CB 3.39Å; K297-D301 PolarHBondContact O-N 3.18Å
298	R	63.6	Low	54.2	Low	77 Å²	77	93.7 Å²	93.7	29%	0.291	51%	0.505	S	S	.	.	H	α-helix	trans	-63.8	-34.7	175.4	-71.1	-172	-129.1	109.6	-3.1	113.6	T294 T295 I296 R302	T294-R298 WeakPolarHBondContact O-CG 3.4Å; T294-R298 PolarHBondContact O-N 3.34Å; T295-R298 PolarHBondContact O-N 2.95Å; T295-R298 PolarHBondContact OG1-NH1 2.95Å; I296-R298 PolarHBondContact O-N 3.3Å; R298-R302 WeakPolarHBondContact O-CB 3.35Å; R298-R302 WeakPolarHBondContact O-CG 3.46Å; R298-R302 PolarHBondContact O-N 2.97Å
299	I	66.5	Low	54.9	Low	94 Å²	94	94.1 Å²	94.1	48%	0.482	50%	0.496	S	S	.	.	H	α-helix	trans	-70.5	-44.7	174.4	-67.2	166.2	0	0	0	109.7	T295 I296 K297 R302 V303	T295-I299 HydrophobicContact CG2-CD1 4.42Å; T295-I299 WeakPolarHBondContact O-CG1 3.23Å; T295-I299 PolarHBondContact O-N 3.35Å; I296-I299 PolarHBondContact O-N 3.45Å; K297-I299 VanDerWaalsContact C-N 3.34Å; K297-I299 PolarHBondContact O-N 2.8Å; I299-R302 PolarHBondContact O-N 3.13Å; I299-V303 HydrophobicContact CG2-CG2 4.44Å; I299-V303 WeakPolarHBondContact O-CB 3.49Å; I299-V303 VanDerWaalsContact O-CG2 3.31Å; I299-V303 WeakPolarHBondContact O-CG2 3.16Å; I299-V303 PolarHBondContact O-N 3.37Å
300	W	56	Low	56	Low	180 Å²	180	95.6 Å²	95.6	68%	0.682	49%	0.489	S	S	*	.	H	α-helix	trans	-61.9	-42.8	175.8	-179.3	-93	0	0	0	111.9	I296 K297 V303 S304	I296-W300 WeakPolarHBondContact O-CB 3.29Å; I296-W300 PolarHBondContact O-N 3.12Å; K297-W300 CarbonylContact O-C 3.57Å; K297-W300 PolarHBondContact O-N 3.03Å; W300-V303 PolarHBondContact O-N 3.37Å; W300-S304 WeakPolarHBondContact O-CB 3.23Å; W300-S304 PolarHBondContact O-N 3.4Å
301	D	63.8	Low	56.9	Low	65 Å²	65	95.5 Å²	95.5	35%	0.348	50%	0.497	S	S	.	.	H	α-helix	trans	-63.9	-42.5	176.5	-68.3	-18.5	0	0	0	109.7	K297 S304 E305	K297-D301 VanDerWaalsContact O-CB 3.27Å; K297-D301 WeakPolarHBondContact O-CB 3.39Å; K297-D301 PolarHBondContact O-N 3.18Å; D301-S304 PolarHBondContact O-N 3.21Å; D301-E305 WeakPolarHBondContact O-CB 3.28Å; D301-E305 WeakPolarHBondContact O-CG 3.3Å; D301-E305 PolarHBondContact O-N 3.28Å
302	R	63.4	Low	57.7	Low	172 Å²	172	87.9 Å²	87.9	65%	0.649	46%	0.458	S	S	*	.	H	α-helix	trans	-65.4	-38.8	173.9	-83.4	-169	-90	177.3	-13.4	114	R298 I299 E305 G306	R298-R302 WeakPolarHBondContact O-CB 3.35Å; R298-R302 WeakPolarHBondContact O-CG 3.46Å; R298-R302 PolarHBondContact O-N 2.97Å; I299-R302 PolarHBondContact O-N 3.13Å; R302-E305 PolarHBondContact O-N 3.48Å; R302-G306 PolarHBondContact O-N 3.47Å
303	V	60.4	Low	58.5	Low	71 Å²	71	88 Å²	88	43%	0.43	46%	0.459	S	S	.	.	H	α-helix	trans	-68.9	-46.4	176.1	169.6	0	0	0	0	110.2	I299 W300 E305 G306 F307	I299-V303 HydrophobicContact CG2-CG2 4.44Å; I299-V303 WeakPolarHBondContact O-CB 3.49Å; I299-V303 VanDerWaalsContact O-CG2 3.31Å; I299-V303 WeakPolarHBondContact O-CG2 3.16Å; I299-V303 PolarHBondContact O-N 3.37Å; W300-V303 PolarHBondContact O-N 3.37Å; V303-E305 VanDerWaalsContact C-N 3.28Å; V303-E305 PolarHBondContact O-N 3.42Å; V303-G306 WeakPolarHBondContact O-CA 3.44Å; V303-G306 PolarHBondContact O-N 3.11Å; V303-F307 HydrophobicContact CG1-CD2 3.74Å; V303-F307 HydrophobicContact CG1-CE2 3.45Å; V303-F307 VanDerWaalsContact CG1-CE2 3.45Å; V303-F307 WeakPolarHBondContact O-CD2 3.03Å; V303-F307 PolarHBondContact O-N 3.3Å
304	S	61.4	Low	59	Low	42 Å²	42	94.2 Å²	94.2	29%	0.294	47%	0.472	S	S	.	.	H	α-helix	trans	-57.1	-42.8	172.6	178.1	0	0	0	0	110.7	W300 D301 F307 N308	W300-S304 WeakPolarHBondContact O-CB 3.23Å; W300-S304 PolarHBondContact O-N 3.4Å; D301-S304 PolarHBondContact O-N 3.21Å; S304-F307 PolarHBondContact O-N 3.05Å; S304-N308 WeakPolarHBondContact O-CB 3.48Å; S304-N308 PolarHBondContact O-N 3.19Å; S304-N308 PolarHBondContact O-ND2 2.85Å; S304-N308 PolarHBondContact OG-ND2 2.81Å
305	E	60.9	Low	59.8	Low	55 Å²	55	93.1 Å²	93.1	26%	0.257	46%	0.463	S	S	.	.	H	α-helix	trans	-64	-37.3	172.7	-79.9	-179.4	159.9	0	0	112.5	D301 R302 V303 N308 R309 K428	D301-E305 WeakPolarHBondContact O-CB 3.28Å; D301-E305 WeakPolarHBondContact O-CG 3.3Å; D301-E305 PolarHBondContact O-N 3.28Å; R302-E305 PolarHBondContact O-N 3.48Å; V303-E305 VanDerWaalsContact C-N 3.28Å; V303-E305 PolarHBondContact O-N 3.42Å; E305-N308 CarbonylContact O-C 3.56Å; E305-N308 PolarHBondContact O-N 3.41Å; E305-R309 WeakPolarHBondContact O-CB 3.47Å; E305-R309 WeakPolarHBondContact O-CG 3.4Å; E305-R309 PolarHBondContact O-N 3.36Å; E305-K428 IonicContact OE1-NZ 3.76Å; E305-K428 PolarHBondContact OE1-NZ 2.9Å
306	G	62.5	Low	60.4	Low	30 Å²	30	96.8 Å²	96.8	31%	0.309	48%	0.48	S	S	.	.	H	α-helix	trans	-62.8	-45.6	172.8	0	0	0	0	0	112.5	R302 V303 R309 I310	R302-G306 PolarHBondContact O-N 3.47Å; V303-G306 WeakPolarHBondContact O-CA 3.44Å; V303-G306 PolarHBondContact O-N 3.11Å; G306-R309 PolarHBondContact O-N 2.89Å; G306-I310 WeakPolarHBondContact O-CG1 3.42Å; G306-I310 PolarHBondContact O-N 3.45Å
307	F	58.5	Low	60.8	Low	142 Å²	142	93.5 Å²	93.5	62%	0.623	46%	0.462	S	S	*	.	H	α-helix	trans	-67	-39.7	174.2	-73.9	-68.4	0	0	0	112.2	V303 S304 I310 A311	V303-F307 HydrophobicContact CG1-CD2 3.74Å; V303-F307 HydrophobicContact CG1-CE2 3.45Å; V303-F307 VanDerWaalsContact CG1-CE2 3.45Å; V303-F307 WeakPolarHBondContact O-CD2 3.03Å; V303-F307 PolarHBondContact O-N 3.3Å; S304-F307 PolarHBondContact O-N 3.05Å; F307-I310 PolarHBondContact O-N 3.35Å; F307-A311 WeakPolarHBondContact O-CB 3.34Å; F307-A311 PolarHBondContact O-N 3.25Å
308	N	56.1	Low	61.4	Low	64 Å²	64	93.7 Å²	93.7	34%	0.342	47%	0.469	S	S	.	.	H	α-helix	trans	-63	-43.2	173.4	-80.4	-24.9	0	0	0	110.3	S304 E305 I310 A311 I312	S304-N308 WeakPolarHBondContact O-CB 3.48Å; S304-N308 PolarHBondContact O-N 3.19Å; S304-N308 PolarHBondContact O-ND2 2.85Å; S304-N308 PolarHBondContact OG-ND2 2.81Å; E305-N308 CarbonylContact O-C 3.56Å; E305-N308 PolarHBondContact O-N 3.41Å; N308-I310 PolarHBondContact O-N 2.95Å; N308-A311 PolarHBondContact O-N 2.94Å; N308-A311 VanDerWaalsContact O-N 3.09Å; N308-I312 HydrophobicContact CB-CD1 3.51Å; N308-I312 HydrophobicContact CB-CG1 4.05Å; N308-I312 WeakPolarHBondContact O-CA 3.43Å; N308-I312 WeakPolarHBondContact O-CB 3.42Å; N308-I312 WeakPolarHBondContact O-CG1 3.49Å; N308-I312 PolarHBondContact O-N 3.39Å
309	R	59.2	Low	62.5	Low	96 Å²	96	92.2 Å²	92.2	36%	0.362	47%	0.467	S	S	.	.	H	α-helix	trans	-55	-41.2	175.5	-79.6	171.2	-168.8	-147.3	7.8	111.4	E305 G306 S313 F424	E305-R309 WeakPolarHBondContact O-CB 3.47Å; E305-R309 WeakPolarHBondContact O-CG 3.4Å; E305-R309 PolarHBondContact O-N 3.36Å; G306-R309 PolarHBondContact O-N 2.89Å; R309-S313 WeakPolarHBondContact O-CB 3.45Å; R309-S313 PolarHBondContact O-N 2.73Å; R309-F424 HydrophobicContact CB-CE2 4.11Å; R309-F424 HydrophobicContact CB-CZ 4.02Å; R309-F424 HydrophobicContact CG-CD1 4.06Å; R309-F424 HydrophobicContact CG-CD2 3.93Å; R309-F424 HydrophobicContact CG-CE1 3.53Å; R309-F424 HydrophobicContact CG-CE2 3.44Å; R309-F424 VanDerWaalsContact CG-CE2 3.44Å; R309-F424 HydrophobicContact CG-CG 4.24Å; R309-F424 HydrophobicContact CG-CZ 3.22Å
310	I	58.9	Low	63.6	Low	131 Å²	131	91 Å²	91	67%	0.672	47%	0.472	S	S	*	.	H	α-helix	trans	-71.4	-43.2	177.6	-61.8	168.2	0	0	0	111.1	G306 F307 N308 S313	G306-I310 WeakPolarHBondContact O-CG1 3.42Å; G306-I310 PolarHBondContact O-N 3.45Å; F307-I310 PolarHBondContact O-N 3.35Å; N308-I310 PolarHBondContact O-N 2.95Å; I310-S313 PolarHBondContact O-OG 3.49Å
311	A	56.2	Low	65.4	Low	78 Å²	78	85 Å²	85	65%	0.645	45%	0.449	S	S	*	.	H	α-helix	trans	-80.7	-29.9	-175.5	0	0	0	0	0	115.1	F307 N308	F307-A311 WeakPolarHBondContact O-CB 3.34Å; F307-A311 PolarHBondContact O-N 3.25Å; N308-A311 PolarHBondContact O-N 2.94Å; N308-A311 VanDerWaalsContact O-N 3.09Å
312	I	58.2	Low	66.9	Low	32 Å²	32	82.3 Å²	82.3	16%	0.164	43%	0.434	C	S	.	.	H	α-helix	trans	-93.6	-8.7	-173.7	-60.6	-173.4	0	0	0	111	N308 K314 V427 N431	N308-I312 HydrophobicContact CB-CD1 3.51Å; N308-I312 HydrophobicContact CB-CG1 4.05Å; N308-I312 WeakPolarHBondContact O-CA 3.43Å; N308-I312 WeakPolarHBondContact O-CB 3.42Å; N308-I312 WeakPolarHBondContact O-CG1 3.49Å; N308-I312 PolarHBondContact O-N 3.39Å; I312-K314 PolarHBondContact O-N 2.94Å; I312-V427 HydrophobicContact CG2-CG1 3.97Å; I312-N431 HydrophobicContact CG2-CB 3.89Å; I312-N431 WeakPolarHBondContact CG2-ND2 3Å; I312-N431 PolarHBondContact O-ND2 3.16Å
313	S	54.3	Low	68.2	Low	78 Å²	78	78.1 Å²	78.1	55%	0.545	42%	0.424	S	S	.	.			trans	-58.9	-12.3	-177	57.5	0	0	0	0	115.8	R309 I310 M315	R309-S313 WeakPolarHBondContact O-CB 3.45Å; R309-S313 PolarHBondContact O-N 2.73Å; I310-S313 PolarHBondContact O-OG 3.49Å; S313-M315 VanDerWaalsContact C-N 3.3Å; S313-M315 PolarHBondContact O-N 2.9Å
314	K	55.7	Low	69.8	Low	176 Å²	176	79.6 Å²	79.6	77%	0.765	43%	0.427	S	S	*	.			trans	-84.5	71.1	179	-63.6	-171.1	179.4	-176.6	0	111.2	I312 W430	I312-K314 PolarHBondContact O-N 2.94Å; K314-W430 WeakPolarHBondContact O-CH2 3.29Å; K314-W430 WeakPolarHBondContact O-CZ3 3.42Å
315	M	70.2	Confident	71.4	Confident	42 Å²	42	80.2 Å²	80.2	21%	0.207	42%	0.423	C	S	.	.			trans	-83.1	111.1	163.3	-174.9	165.5	-178.9	0	0	108.5	S313 E317 R426 V427 W430 F480	S313-M315 VanDerWaalsContact C-N 3.3Å; S313-M315 PolarHBondContact O-N 2.9Å; M315-E317 HydrophobicContact CE-CB 3.61Å; M315-E317 HydrophobicContact CE-CG 4.05Å; M315-E317 WeakPolarHBondContact CE-OE2 3.41Å; M315-E317 HydrophobicContact CG-CB 4.04Å; M315-R426 VanDerWaalsContact CE-CZ 3.48Å; M315-V427 HydrophobicContact SD-CG2 4.33Å; M315-W430 HydrophobicContact CB-CD2 4.44Å; M315-W430 HydrophobicContact CB-CE3 4.19Å; M315-W430 HydrophobicContact CB-CZ3 4.36Å; M315-W430 HydrophobicContact CE-CB 3.99Å; M315-W430 HydrophobicContact CE-CD2 4.39Å; M315-W430 HydrophobicContact CE-CG 3.74Å; M315-W430 HydrophobicContact CG-CD2 3.78Å; M315-W430 HydrophobicContact CG-CE3 4.04Å; M315-W430 HydrophobicContact CG-CG 4.07Å; M315-W430 HydrophobicContact CG-CZ2 4.42Å; M315-W430 HydrophobicContact CG-CZ3 4.49Å; M315-W430 HydrophobicContact SD-CB 4.2Å; M315-W430 HydrophobicContact SD-CD2 4.45Å; M315-W430 HydrophobicContact SD-CG 4.15Å; M315-F480 HydrophobicContact CE-CE2 3.88Å; M315-F480 HydrophobicContact CE-CZ 3.86Å
316	D	64.5	Low	72.9	Confident	150 Å²	150	81.3 Å²	81.3	80%	0.802	43%	0.428	S	S	*	.			trans	-81.2	-6.2	177.8	-167.1	33	0	0	0	112.2	N318 W430	D316-N318 PolarHBondContact O-N 3.41Å; D316-W430 HydrophobicContact CB-CH2 4.22Å; D316-W430 HydrophobicContact CB-CZ2 4.2Å
317	E	67.3	Low	74.3	Confident	56 Å²	56	87 Å²	87	26%	0.262	44%	0.441	S	S	.	.			trans	-79.3	109.6	175.9	-175.1	-173.7	150.2	0	0	110.6	M315 D319 R426 W430 F480	M315-E317 HydrophobicContact CE-CB 3.61Å; M315-E317 HydrophobicContact CE-CG 4.05Å; M315-E317 WeakPolarHBondContact CE-OE2 3.41Å; M315-E317 HydrophobicContact CG-CB 4.04Å; E317-D319 VanDerWaalsContact C-N 3.31Å; E317-D319 PolarHBondContact O-N 3.19Å; E317-D319 VanDerWaalsContact O-N 3.13Å; E317-R426 IonicContact OE1-NH2 2.67Å; E317-R426 PolarHBondContact OE1-NH2 3.38Å; E317-W430 PolarHBondContact OE2-NE1 2.82Å; E317-W430 VanDerWaalsContact OE2-NE1 3.14Å; E317-F480 WeakPolarHBondContact OE1-CZ 3.23Å; E317-F480 WeakPolarHBondContact OE2-CE1 3.25Å; E317-F480 WeakPolarHBondContact OE2-CZ 3.44Å
318	N	71.5	Confident	76	Confident	136 Å²	136	84 Å²	84	73%	0.727	43%	0.428	S	S	*	.			trans	-87.5	66.3	179	-165.5	7	0	0	0	111.3	D316 A320 N323	D316-N318 PolarHBondContact O-N 3.41Å; N318-A320 PolarHBondContact O-N 3.35Å; N318-N323 PolarHBondContact OD1-ND2 2.87Å
319	D	86.3	Confident	77.9	Confident	46 Å²	46	81 Å²	81	25%	0.246	41%	0.413	C	S	.	.			trans	-75.5	104.3	168.6	-170.5	-35.8	0	0	0	109.1	E317 W321 F322 N323 R426	E317-D319 VanDerWaalsContact C-N 3.31Å; E317-D319 PolarHBondContact O-N 3.19Å; E317-D319 VanDerWaalsContact O-N 3.13Å; D319-W321 PolarHBondContact O-N 3.01Å; D319-W321 WeakPolarHBondContact OD1-CB 3.35Å; D319-W321 PolarHBondContact OD1-N 3.02Å; D319-F322 HydrophobicContact CB-CB 4.42Å; D319-F322 HydrophobicContact CB-CD2 3.93Å; D319-F322 VanDerWaalsContact CG-CD2 3.45Å; D319-F322 PolarHBondContact O-N 3.26Å; D319-F322 VanDerWaalsContact O-N 3.13Å; D319-F322 PolarHBondContact OD1-N 3.5Å; D319-F322 VanDerWaalsContact OD2-CD2 3.28Å; D319-F322 WeakPolarHBondContact OD2-CD2 3.43Å; D319-N323 PolarHBondContact O-N 2.86Å; D319-R426 IonicContact OD2-NH2 3.41Å; D319-R426 PolarHBondContact OD2-NH2 3.22Å
320	A	90.6	Very high	79.6	Confident	69 Å²	69	79 Å²	79	57%	0.57	41%	0.408	S	S	*	.	H	α-helix	trans	-54.9	-35	-178.6	0	0	0	0	0	112.5	N318 E324	N318-A320 PolarHBondContact O-N 3.35Å; A320-E324 VanDerWaalsContact O-CB 3.28Å; A320-E324 WeakPolarHBondContact O-CB 3.31Å; A320-E324 PolarHBondContact O-N 3.34Å
321	W	94.7	Very high	81.3	Confident	55 Å²	55	76.2 Å²	76.2	21%	0.208	39%	0.392	C	S	.	.	H	α-helix	trans	-65.9	-48.4	179.2	-173.4	101	0	0	0	110.5	D319 N323 R325 F423 Q488 Y491	D319-W321 PolarHBondContact O-N 3.01Å; D319-W321 WeakPolarHBondContact OD1-CB 3.35Å; D319-W321 PolarHBondContact OD1-N 3.02Å; W321-N323 PolarHBondContact O-N 3.39Å; W321-R325 VanDerWaalsContact CD1-NH2 3.25Å; W321-R325 HydrophobicContact CD2-CG 4.18Å; W321-R325 HydrophobicContact CE3-CB 4.45Å; W321-R325 HydrophobicContact CE3-CG 4.31Å; W321-R325 HydrophobicContact CH2-CB 4.32Å; W321-R325 HydrophobicContact CH2-CG 3.87Å; W321-R325 HydrophobicContact CZ2-CG 3.77Å; W321-R325 HydrophobicContact CZ3-CB 4.22Å; W321-R325 HydrophobicContact CZ3-CG 4.15Å; W321-R325 VanDerWaalsContact NE1-NE 3.17Å; W321-R325 WeakPolarHBondContact O-CB 3.36Å; W321-R325 VanDerWaalsContact O-CD 3.24Å; W321-R325 WeakPolarHBondContact O-CD 3.31Å; W321-R325 PolarHBondContact O-N 3.49Å; W321-F423 HydrophobicContact CZ3-CZ 4.29Å; W321-Q488 HydrophobicContact CD2-CG 4.15Å; W321-Q488 HydrophobicContact CE3-CG 3.88Å; W321-Q488 HydrophobicContact CH2-CB 4.21Å; W321-Q488 HydrophobicContact CH2-CG 3.72Å; W321-Q488 HydrophobicContact CZ2-CB 4.32Å; W321-Q488 HydrophobicContact CZ2-CG 3.93Å; W321-Q488 HydrophobicContact CZ3-CG 3.68Å; W321-Y491 HydrophobicContact CH2-CD1 4.02Å; W321-Y491 HydrophobicContact CH2-CG 4.13Å; W321-Y491 HydrophobicContact CZ2-CD1 4.01Å
322	F	93.7	Very high	83.1	Confident	7 Å²	7	73.7 Å²	73.7	3%	0.031	37%	0.367	C	S	.	.	H	α-helix	trans	-67.5	-38.3	-179.7	-76.7	-83.8	0	0	0	112.4	D319 H326 F423 R426 I487 Q488	D319-F322 HydrophobicContact CB-CB 4.42Å; D319-F322 HydrophobicContact CB-CD2 3.93Å; D319-F322 VanDerWaalsContact CG-CD2 3.45Å; D319-F322 PolarHBondContact O-N 3.26Å; D319-F322 VanDerWaalsContact O-N 3.13Å; D319-F322 PolarHBondContact OD1-N 3.5Å; D319-F322 VanDerWaalsContact OD2-CD2 3.28Å; D319-F322 WeakPolarHBondContact OD2-CD2 3.43Å; F322-H326 WeakPolarHBondContact O-CB 3.46Å; F322-H326 PolarHBondContact O-N 2.76Å; F322-F423 HydrophobicContact CD1-CD1 4.1Å; F322-F423 AromaticContact CD1-CE1 3.87Å; F322-F423 HydrophobicContact CD1-CE1 3.87Å; F322-R426 VanDerWaalsContact CD1-CD 3.47Å; F322-R426 VanDerWaalsContact CE2-CZ 3.47Å; F322-R426 VanDerWaalsContact CZ-CD 3.41Å; F322-I487 HydrophobicContact CE1-CB 4.07Å; F322-I487 HydrophobicContact CE1-CD1 4.33Å; F322-I487 HydrophobicContact CE1-CG2 3.79Å; F322-Q488 HydrophobicContact CZ-CG 4.09Å
323	N	90.9	Very high	84.9	Confident	84 Å²	84	73.2 Å²	73.2	45%	0.449	36%	0.364	S	S	.	.	H	α-helix	trans	-64.6	-46.3	178.9	-72.4	-24.4	0	0	0	111.9	N318 D319 W321 Y327	N318-N323 PolarHBondContact OD1-ND2 2.87Å; D319-N323 PolarHBondContact O-N 2.86Å; W321-N323 PolarHBondContact O-N 3.39Å; N323-Y327 WeakPolarHBondContact O-CB 3.39Å; N323-Y327 PolarHBondContact O-N 3.14Å
324	E	94	Very high	86.8	Confident	103 Å²	103	73 Å²	73	48%	0.481	36%	0.356	S	S	.	.	H	α-helix	trans	-60.9	-50.5	175.9	-176.8	179.4	-164.5	0	0	111.2	A320 H326 Y327 E328	A320-E324 VanDerWaalsContact O-CB 3.28Å; A320-E324 WeakPolarHBondContact O-CB 3.31Å; A320-E324 PolarHBondContact O-N 3.34Å; E324-H326 PolarHBondContact O-N 3.02Å; E324-Y327 WeakPolarHBondContact O-CB 3.49Å; E324-Y327 PolarHBondContact O-N 3.31Å; E324-E328 WeakPolarHBondContact O-CG 3.34Å; E324-E328 PolarHBondContact O-N 3.33Å
325	R	94.6	Very high	88.7	Confident	55 Å²	55	68.9 Å²	68.9	21%	0.208	34%	0.34	C	S	.	.	H	α-helix	trans	-68.6	-36.5	-177.3	-83.7	50.5	159.6	-160.8	17.3	112.1	W321 Y327 E328 V329 F423 Y491	W321-R325 VanDerWaalsContact CD1-NH2 3.25Å; W321-R325 HydrophobicContact CD2-CG 4.18Å; W321-R325 HydrophobicContact CE3-CB 4.45Å; W321-R325 HydrophobicContact CE3-CG 4.31Å; W321-R325 HydrophobicContact CH2-CB 4.32Å; W321-R325 HydrophobicContact CH2-CG 3.87Å; W321-R325 HydrophobicContact CZ2-CG 3.77Å; W321-R325 HydrophobicContact CZ3-CB 4.22Å; W321-R325 HydrophobicContact CZ3-CG 4.15Å; W321-R325 VanDerWaalsContact NE1-NE 3.17Å; W321-R325 WeakPolarHBondContact O-CB 3.36Å; W321-R325 VanDerWaalsContact O-CD 3.24Å; W321-R325 WeakPolarHBondContact O-CD 3.31Å; W321-R325 PolarHBondContact O-N 3.49Å; R325-Y327 VanDerWaalsContact C-N 3.33Å; R325-E328 PolarHBondContact O-N 3.16Å; R325-V329 WeakPolarHBondContact O-CB 3.24Å; R325-V329 VanDerWaalsContact O-CG2 3.23Å; R325-V329 WeakPolarHBondContact O-CG2 3.29Å; R325-V329 PolarHBondContact O-N 2.86Å; R325-F423 HydrophobicContact CB-CE1 4Å; R325-F423 HydrophobicContact CB-CZ 3.84Å; R325-Y491 HydrophobicContact CB-CE1 4.37Å; R325-Y491 HydrophobicContact CG-CD1 4.01Å; R325-Y491 HydrophobicContact CG-CE1 3.55Å
326	H	92.4	Very high	89.8	Confident	78 Å²	78	68.1 Å²	68.1	36%	0.361	34%	0.336	S	S	.	.	H	α-helix	trans	-61.8	-44.6	174	-175.7	-73.3	0	0	0	110.5	F322 E324 V329 E330 F423	F322-H326 WeakPolarHBondContact O-CB 3.46Å; F322-H326 PolarHBondContact O-N 2.76Å; E324-H326 PolarHBondContact O-N 3.02Å; H326-V329 PolarHBondContact O-N 2.75Å; H326-E330 IonicContact CE1-OE1 2.79Å; H326-E330 PolarHBondContact CE1-OE1 2.9Å; H326-E330 IonicContact NE2-OE1 3.7Å; H326-E330 WeakPolarHBondContact O-CG 3.36Å; H326-E330 PolarHBondContact O-N 2.8Å; H326-F423 HydrophobicContact CB-CD1 3.99Å; H326-F423 HydrophobicContact CB-CE1 4.14Å
327	Y	93	Very high	91.2	Very high	148 Å²	148	66 Å²	66	58%	0.58	32%	0.317	S	S	*	.	H	α-helix	trans	-60.8	-45.9	174.9	178.3	-96.7	0	0	0	112	N323 E324 R325 V329 E330 Q331	N323-Y327 WeakPolarHBondContact O-CB 3.39Å; N323-Y327 PolarHBondContact O-N 3.14Å; E324-Y327 WeakPolarHBondContact O-CB 3.49Å; E324-Y327 PolarHBondContact O-N 3.31Å; R325-Y327 VanDerWaalsContact C-N 3.33Å; Y327-V329 VanDerWaalsContact C-N 3.33Å; Y327-V329 PolarHBondContact O-N 2.84Å; Y327-E330 PolarHBondContact O-N 2.93Å; Y327-Q331 HydrophobicContact CD1-CG 4.16Å; Y327-Q331 HydrophobicContact CE1-CG 3.69Å; Y327-Q331 HydrophobicContact CE2-CG 4.16Å; Y327-Q331 WeakPolarHBondContact O-CG 3.43Å; Y327-Q331 PolarHBondContact O-N 3.45Å
328	E	94.3	Very high	92.5	Very high	79 Å²	79	68.7 Å²	68.7	37%	0.369	33%	0.327	S	S	.	.	H	α-helix	trans	-57.9	-42.8	175.5	-72.9	175.8	178.6	0	0	112.6	E324 R325 Q331 L332 Y491	E324-E328 WeakPolarHBondContact O-CG 3.34Å; E324-E328 PolarHBondContact O-N 3.33Å; R325-E328 PolarHBondContact O-N 3.16Å; E328-Q331 PolarHBondContact O-N 3.01Å; E328-L332 WeakPolarHBondContact O-CB 3.49Å; E328-L332 PolarHBondContact O-N 3.4Å; E328-Y491 PolarHBondContact OE2-OH 3.48Å; E328-Y491 VanDerWaalsContact OE2-OH 3.05Å
329	V	95.3	Very high	93.5	Very high	2 Å²	2	65.7 Å²	65.7	1%	0.012	31%	0.311	C	S	.	.	H	α-helix	trans	-65.1	-40.8	178.3	170.9	0	0	0	0	111.5	R325 H326 Y327 L332 E333 I416 V419 K420 Y491	R325-V329 WeakPolarHBondContact O-CB 3.24Å; R325-V329 VanDerWaalsContact O-CG2 3.23Å; R325-V329 WeakPolarHBondContact O-CG2 3.29Å; R325-V329 PolarHBondContact O-N 2.86Å; H326-V329 PolarHBondContact O-N 2.75Å; Y327-V329 VanDerWaalsContact C-N 3.33Å; Y327-V329 PolarHBondContact O-N 2.84Å; V329-L332 PolarHBondContact O-N 2.9Å; V329-E333 PolarHBondContact O-N 3.37Å; V329-I416 HydrophobicContact CG1-CG2 4.05Å; V329-V419 HydrophobicContact CG1-CG1 4.12Å; V329-V419 HydrophobicContact CG2-CG1 3.97Å; V329-K420 HydrophobicContact CG1-CD 4.25Å; V329-K420 HydrophobicContact CG1-CG 3.53Å; V329-Y491 HydrophobicContact CG2-CD2 4.37Å; V329-Y491 HydrophobicContact CG2-CE2 3.53Å
330	E	94.6	Very high	93.8	Very high	55 Å²	55	64.8 Å²	64.8	26%	0.257	31%	0.306	S	S	.	.	H	α-helix	trans	-63	-46.7	174.9	-70.2	-71.7	168.2	0	0	111.6	H326 Y327 L332 E333 I334 K420	H326-E330 IonicContact CE1-OE1 2.79Å; H326-E330 PolarHBondContact CE1-OE1 2.9Å; H326-E330 IonicContact NE2-OE1 3.7Å; H326-E330 WeakPolarHBondContact O-CG 3.36Å; H326-E330 PolarHBondContact O-N 2.8Å; Y327-E330 PolarHBondContact O-N 2.93Å; E330-L332 VanDerWaalsContact C-N 3.34Å; E330-L332 PolarHBondContact O-N 2.73Å; E330-E333 WeakPolarHBondContact O-CB 3.31Å; E330-E333 PolarHBondContact O-N 3.07Å; E330-I334 WeakPolarHBondContact O-CG1 3.43Å; E330-I334 PolarHBondContact O-N 3.32Å; E330-I334 VanDerWaalsContact O-N 3.16Å; E330-K420 WeakPolarHBondContact OE1-CE 3.39Å; E330-K420 IonicContact OE1-NZ 3.54Å; E330-K420 PolarHBondContact OE1-NZ 2.95Å; E330-K420 IonicContact OE2-NZ 3.35Å; E330-K420 PolarHBondContact OE2-NZ 3.46Å
331	Q	95.3	Very high	93.9	Very high	71 Å²	71	64 Å²	64	33%	0.332	30%	0.3	S	S	.	.	H	α-helix	trans	-63.7	-41.7	176.6	-66.6	-52.2	-43.4	0	0	111.8	Y327 E328 E333 I334 E335	Y327-Q331 HydrophobicContact CD1-CG 4.16Å; Y327-Q331 HydrophobicContact CE1-CG 3.69Å; Y327-Q331 HydrophobicContact CE2-CG 4.16Å; Y327-Q331 WeakPolarHBondContact O-CG 3.43Å; Y327-Q331 PolarHBondContact O-N 3.45Å; E328-Q331 PolarHBondContact O-N 3.01Å; Q331-E333 VanDerWaalsContact C-N 3.3Å; Q331-E333 PolarHBondContact O-N 2.91Å; Q331-I334 PolarHBondContact O-N 3.47Å; Q331-E335 PolarHBondContact O-N 3.24Å
332	L	94.2	Very high	93.8	Very high	25 Å²	25	69 Å²	69	13%	0.131	32%	0.323	C	S	.	.	H	α-helix	trans	-59.5	-42	175.4	177.4	65.9	0	0	0	111.7	E328 V329 E330 E335 M336 I416 F494	E328-L332 WeakPolarHBondContact O-CB 3.49Å; E328-L332 PolarHBondContact O-N 3.4Å; V329-L332 PolarHBondContact O-N 2.9Å; E330-L332 VanDerWaalsContact C-N 3.34Å; E330-L332 PolarHBondContact O-N 2.73Å; L332-E335 PolarHBondContact O-N 3.13Å; L332-M336 HydrophobicContact CD1-CE 4.27Å; L332-M336 HydrophobicContact CD1-CG 3.78Å; L332-M336 HydrophobicContact CG-CG 4.11Å; L332-M336 VanDerWaalsContact O-CB 3.26Å; L332-M336 WeakPolarHBondContact O-CB 3.26Å; L332-M336 WeakPolarHBondContact O-CG 3.36Å; L332-M336 PolarHBondContact O-N 2.84Å; L332-I416 HydrophobicContact CD2-CD1 3.73Å; L332-I416 HydrophobicContact CD2-CG1 3.95Å; L332-I416 HydrophobicContact CG-CD1 3.75Å; L332-I416 HydrophobicContact CG-CG1 4.46Å; L332-F494 HydrophobicContact CD2-CE1 4.48Å
333	E	95	Very high	93.6	Very high	23 Å²	23	68.8 Å²	68.8	11%	0.107	32%	0.323	C	S	.	.	H	α-helix	trans	-59.4	-47.9	176.5	-168.5	-168.6	156.6	0	0	111.2	V329 E330 Q331 E335 M336 R337 I416 K420	V329-E333 PolarHBondContact O-N 3.37Å; E330-E333 WeakPolarHBondContact O-CB 3.31Å; E330-E333 PolarHBondContact O-N 3.07Å; Q331-E333 VanDerWaalsContact C-N 3.3Å; Q331-E333 PolarHBondContact O-N 2.91Å; E333-E335 PolarHBondContact O-N 2.72Å; E333-M336 PolarHBondContact O-N 3.43Å; E333-R337 WeakPolarHBondContact O-CB 3.47Å; E333-R337 WeakPolarHBondContact O-CG 3.18Å; E333-R337 PolarHBondContact O-N 2.85Å; E333-R337 IonicContact OE1-CZ 2.76Å; E333-R337 IonicContact OE1-NE 3.82Å; E333-R337 PolarHBondContact OE1-NE 2.96Å; E333-R337 IonicContact OE1-NH2 3.16Å; E333-R337 PolarHBondContact OE1-NH2 3.21Å; E333-I416 HydrophobicContact CB-CG2 3.76Å; E333-I416 HydrophobicContact CG-CG2 4.08Å; E333-K420 WeakPolarHBondContact OE2-CD 3.36Å; E333-K420 WeakPolarHBondContact OE2-CE 3.24Å; E333-K420 IonicContact OE2-NZ 2.74Å; E333-K420 PolarHBondContact OE2-NZ 3.46Å
334	I	95.5	Very high	93.6	Very high	72 Å²	72	70 Å²	70	37%	0.369	33%	0.326	S	S	.	.	H	α-helix	trans	-57.5	-50.4	179.3	-67.2	167.2	0	0	0	110.2	E330 Q331 R337 K338	E330-I334 WeakPolarHBondContact O-CG1 3.43Å; E330-I334 PolarHBondContact O-N 3.32Å; E330-I334 VanDerWaalsContact O-N 3.16Å; Q331-I334 PolarHBondContact O-N 3.47Å; I334-R337 PolarHBondContact O-N 3.45Å; I334-K338 HydrophobicContact CG2-CD 4.46Å; I334-K338 WeakPolarHBondContact O-CG 3.44Å; I334-K338 PolarHBondContact O-N 3.44Å; I334-K338 VanDerWaalsContact O-N 3.07Å
335	E	94.5	Very high	93.3	Very high	91 Å²	91	68.3 Å²	68.3	43%	0.425	33%	0.325	S	S	.	.	H	α-helix	trans	-67.6	-39.6	-179.2	-66.8	-52.3	136.8	0	0	112.6	Q331 L332 E333 R337 K338 L339	Q331-E335 PolarHBondContact O-N 3.24Å; L332-E335 PolarHBondContact O-N 3.13Å; E333-E335 PolarHBondContact O-N 2.72Å; E335-R337 PolarHBondContact O-N 2.67Å; E335-K338 PolarHBondContact O-N 3.45Å; E335-K338 IonicContact OE1-NZ 3.39Å; E335-K338 PolarHBondContact OE1-NZ 3.01Å; E335-K338 IonicContact OE2-NZ 3.17Å; E335-L339 WeakPolarHBondContact O-CB 3.15Å; E335-L339 PolarHBondContact O-N 3.44Å
336	M	92.9	Very high	93	Very high	25 Å²	25	69 Å²	69	12%	0.123	33%	0.332	C	S	.	.	H	α-helix	trans	-66	-36.4	176.1	-72.9	-64.1	105.3	0	0	112.5	L332 E333 L339 L340 L409 V413 I416 F502	L332-M336 HydrophobicContact CD1-CE 4.27Å; L332-M336 HydrophobicContact CD1-CG 3.78Å; L332-M336 HydrophobicContact CG-CG 4.11Å; L332-M336 VanDerWaalsContact O-CB 3.26Å; L332-M336 WeakPolarHBondContact O-CB 3.26Å; L332-M336 WeakPolarHBondContact O-CG 3.36Å; L332-M336 PolarHBondContact O-N 2.84Å; E333-M336 PolarHBondContact O-N 3.43Å; M336-L339 HydrophobicContact CE-CD2 3.87Å; M336-L339 PolarHBondContact O-N 2.93Å; M336-L339 HydrophobicContact SD-CD2 4.4Å; M336-L340 VanDerWaalsContact O-CB 3.29Å; M336-L340 WeakPolarHBondContact O-CB 3.05Å; M336-L340 PolarHBondContact O-N 3.3Å; M336-L409 HydrophobicContact SD-CD2 4.27Å; M336-V413 HydrophobicContact CB-CG2 3.86Å; M336-I416 HydrophobicContact CB-CD1 4.07Å; M336-I416 HydrophobicContact CG-CD1 3.71Å; M336-F502 HydrophobicContact CE-CE1 4.48Å; M336-F502 HydrophobicContact SD-CE1 3.92Å; M336-F502 HydrophobicContact SD-CZ 3.59Å; M336-F502 VanDerWaalsContact SD-CZ 3.59Å
337	R	94.8	Very high	92.8	Very high	106 Å²	106	65.8 Å²	65.8	40%	0.4	32%	0.319	S	S	.	.	H	α-helix	trans	-67	-40.7	173.8	-74.3	-174.7	-172.6	-76.7	0.6	112.1	E333 I334 E335 L340 A341 V413 E417	E333-R337 WeakPolarHBondContact O-CB 3.47Å; E333-R337 WeakPolarHBondContact O-CG 3.18Å; E333-R337 PolarHBondContact O-N 2.85Å; E333-R337 IonicContact OE1-CZ 2.76Å; E333-R337 IonicContact OE1-NE 3.82Å; E333-R337 PolarHBondContact OE1-NE 2.96Å; E333-R337 IonicContact OE1-NH2 3.16Å; E333-R337 PolarHBondContact OE1-NH2 3.21Å; I334-R337 PolarHBondContact O-N 3.45Å; E335-R337 PolarHBondContact O-N 2.67Å; R337-L340 PolarHBondContact O-N 3.44Å; R337-A341 PolarHBondContact O-N 3.44Å; R337-V413 HydrophobicContact CG-CG1 3.99Å; R337-V413 HydrophobicContact CG-CG2 4.3Å; R337-E417 IonicContact CZ-OE1 2.75Å; R337-E417 IonicContact NH1-OE1 3.22Å; R337-E417 IonicContact NH2-OE1 2.73Å; R337-E417 PolarHBondContact NH2-OE1 3.23Å
338	K	94.3	Very high	92.6	Very high	112 Å²	112	61.4 Å²	61.4	49%	0.487	31%	0.309	S	S	.	.	H	α-helix	trans	-60.1	-47.6	172.9	-70.5	172.4	-173.3	169	0	110.7	I334 E335 L340 A341 K342	I334-K338 HydrophobicContact CG2-CD 4.46Å; I334-K338 WeakPolarHBondContact O-CG 3.44Å; I334-K338 PolarHBondContact O-N 3.44Å; I334-K338 VanDerWaalsContact O-N 3.07Å; E335-K338 PolarHBondContact O-N 3.45Å; E335-K338 IonicContact OE1-NZ 3.39Å; E335-K338 PolarHBondContact OE1-NZ 3.01Å; E335-K338 IonicContact OE2-NZ 3.17Å; K338-L340 PolarHBondContact O-N 2.81Å; K338-A341 PolarHBondContact O-N 3.39Å; K338-K342 WeakPolarHBondContact O-CG 3.34Å; K338-K342 PolarHBondContact O-N 2.89Å; K338-K342 VanDerWaalsContact O-N 3.11Å
339	L	92.3	Very high	92.2	Very high	74 Å²	74	61.5 Å²	61.5	39%	0.387	32%	0.315	S	S	.	.	H	α-helix	trans	-62.3	-41.7	178.5	-177.6	58.5	0	0	0	112	E335 M336 A341 K342 A343 L409	E335-L339 WeakPolarHBondContact O-CB 3.15Å; E335-L339 PolarHBondContact O-N 3.44Å; M336-L339 HydrophobicContact CE-CD2 3.87Å; M336-L339 PolarHBondContact O-N 2.93Å; M336-L339 HydrophobicContact SD-CD2 4.4Å; L339-A341 PolarHBondContact O-N 3.35Å; L339-K342 PolarHBondContact O-N 3.18Å; L339-A343 PolarHBondContact O-N 3.32Å; L339-L409 HydrophobicContact CD2-CD1 4.24Å; L339-L409 HydrophobicContact CD2-CD2 3.58Å; L339-L409 HydrophobicContact CG-CD1 3.81Å; L339-L409 HydrophobicContact CG-CD2 4.01Å
340	L	93.2	Very high	91.8	Very high	26 Å²	26	64.7 Å²	64.7	14%	0.136	33%	0.327	C	S	.	.	H	α-helix	trans	-58.4	-45.8	174.8	177.8	61.5	0	0	0	112	M336 R337 K338 K342 A343 E344 Y406 L409 K410 V413	M336-L340 VanDerWaalsContact O-CB 3.29Å; M336-L340 WeakPolarHBondContact O-CB 3.05Å; M336-L340 PolarHBondContact O-N 3.3Å; R337-L340 PolarHBondContact O-N 3.44Å; K338-L340 PolarHBondContact O-N 2.81Å; L340-K342 VanDerWaalsContact C-N 3.3Å; L340-K342 PolarHBondContact O-N 3.29Å; L340-A343 PolarHBondContact O-N 3.17Å; L340-E344 PolarHBondContact O-N 2.77Å; L340-Y406 HydrophobicContact CD1-CD2 3.57Å; L340-Y406 HydrophobicContact CD1-CE2 3.54Å; L340-Y406 HydrophobicContact CD1-CG 4.46Å; L340-Y406 HydrophobicContact CG-CE2 4.35Å; L340-L409 HydrophobicContact CB-CB 4.44Å; L340-L409 HydrophobicContact CD1-CB 3.91Å; L340-K410 HydrophobicContact CD1-CB 3.83Å; L340-K410 HydrophobicContact CD2-CB 4.31Å; L340-V413 HydrophobicContact CD2-CG2 4.16Å
341	A	93.4	Very high	91.5	Very high	54 Å²	54	64.7 Å²	64.7	45%	0.446	33%	0.326	S	S	.	.	H	α-helix	trans	-62.5	-36.6	177.2	0	0	0	0	0	112.3	R337 K338 L339 S345	R337-A341 PolarHBondContact O-N 3.44Å; K338-A341 PolarHBondContact O-N 3.39Å; L339-A341 PolarHBondContact O-N 3.35Å; A341-S345 PolarHBondContact O-N 2.96Å; A341-S345 VanDerWaalsContact O-N 3.09Å
342	K	91.5	Very high	91.2	Very high	158 Å²	158	66.9 Å²	66.9	69%	0.687	34%	0.336	S	S	*	.	H	α-helix	trans	-68.7	-39.8	173.7	-63.7	-57.8	-178	-178	0	112.2	K338 L339 L340 S345 L346	K338-K342 WeakPolarHBondContact O-CG 3.34Å; K338-K342 PolarHBondContact O-N 2.89Å; K338-K342 VanDerWaalsContact O-N 3.11Å; L339-K342 PolarHBondContact O-N 3.18Å; L340-K342 VanDerWaalsContact C-N 3.3Å; L340-K342 PolarHBondContact O-N 3.29Å; K342-S345 PolarHBondContact O-N 2.96Å; K342-L346 WeakPolarHBondContact O-CB 3.18Å; K342-L346 PolarHBondContact O-N 3.3Å
343	A	90.1	Very high	90.8	Very high	3 Å²	3	72.2 Å²	72.2	3%	0.025	36%	0.356	C	S	.	.	H	α-helix	trans	-64.7	-39.4	175.4	0	0	0	0	0	112.1	L339 L340 L346 V347 L405 L409	L339-A343 PolarHBondContact O-N 3.32Å; L340-A343 PolarHBondContact O-N 3.17Å; A343-L346 PolarHBondContact O-N 3.4Å; A343-V347 WeakPolarHBondContact O-CG2 3.47Å; A343-V347 PolarHBondContact O-N 3.23Å; A343-L405 HydrophobicContact CB-CD2 3.99Å; A343-L405 HydrophobicContact CB-CG 4.04Å; A343-L409 HydrophobicContact CB-CD1 3.6Å
344	E	91	Very high	90.5	Very high	110 Å²	110	71.4 Å²	71.4	51%	0.514	35%	0.352	S	S	.	.	H	α-helix	trans	-61.5	-47.4	174	-172.5	171.2	-163.4	0	0	111.7	L340 L346 V347 S348 Y406	L340-E344 PolarHBondContact O-N 2.77Å; E344-L346 VanDerWaalsContact C-N 3.35Å; E344-L346 PolarHBondContact O-N 3.19Å; E344-V347 PolarHBondContact O-N 3.14Å; E344-S348 PolarHBondContact O-N 3.03Å; E344-Y406 HydrophobicContact CB-CD2 3.95Å; E344-Y406 HydrophobicContact CB-CE2 3.78Å; E344-Y406 HydrophobicContact CG-CE2 4.08Å
345	S	88.2	Confident	90.3	Very high	68 Å²	68	72.4 Å²	72.4	48%	0.476	36%	0.362	S	S	.	.	H	α-helix	trans	-60.6	-42.2	175.6	177.1	0	0	0	0	112.2	A341 K342 V347 S348 V349	A341-S345 PolarHBondContact O-N 2.96Å; A341-S345 VanDerWaalsContact O-N 3.09Å; K342-S345 PolarHBondContact O-N 2.96Å; S345-V347 PolarHBondContact O-N 3.29Å; S345-S348 PolarHBondContact O-N 3.25Å; S345-V349 WeakPolarHBondContact O-CG2 3.26Å; S345-V349 PolarHBondContact O-N 2.99Å
346	L	86.6	Confident	90.1	Very high	68 Å²	68	71.1 Å²	71.1	36%	0.356	37%	0.367	S	S	.	.	H	α-helix	trans	-58.5	-48.1	176.3	176.2	65.4	0	0	0	111.5	K342 A343 E344 V349 R350 L405	K342-L346 WeakPolarHBondContact O-CB 3.18Å; K342-L346 PolarHBondContact O-N 3.3Å; A343-L346 PolarHBondContact O-N 3.4Å; E344-L346 VanDerWaalsContact C-N 3.35Å; E344-L346 PolarHBondContact O-N 3.19Å; L346-V349 PolarHBondContact O-N 3.31Å; L346-R350 HydrophobicContact CD1-CG 4.42Å; L346-R350 WeakPolarHBondContact O-CG 3.31Å; L346-R350 PolarHBondContact O-N 3.39Å; L346-L405 HydrophobicContact CD2-CD2 4.26Å
347	V	89.1	Confident	89.9	Confident	12 Å²	12	70.3 Å²	70.3	7%	0.073	36%	0.363	C	S	.	.	H	α-helix	trans	-62.9	-43.6	178.4	173.7	0	0	0	0	110.9	A343 E344 S345 R350 K351 D401 F402	A343-V347 WeakPolarHBondContact O-CG2 3.47Å; A343-V347 PolarHBondContact O-N 3.23Å; E344-V347 PolarHBondContact O-N 3.14Å; S345-V347 PolarHBondContact O-N 3.29Å; V347-R350 PolarHBondContact O-N 3.05Å; V347-K351 HydrophobicContact CG1-CD 4.45Å; V347-K351 WeakPolarHBondContact O-CG 3.19Å; V347-K351 PolarHBondContact O-N 2.74Å; V347-D401 HydrophobicContact CG2-CB 4.1Å; V347-F402 HydrophobicContact CG1-CB 3.96Å; V347-F402 HydrophobicContact CG1-CD2 4.09Å; V347-F402 HydrophobicContact CG1-CG 4.49Å; V347-F402 HydrophobicContact CG2-CB 4.13Å
348	S	88.5	Confident	89.7	Confident	55 Å²	55	69.4 Å²	69.4	39%	0.385	36%	0.363	S	S	.	.	H	α-helix	trans	-58.6	-52.6	177.5	-163.9	0	0	0	0	111.4	E344 S345 R350 K351 E352	E344-S348 PolarHBondContact O-N 3.03Å; S345-S348 PolarHBondContact O-N 3.25Å; S348-R350 VanDerWaalsContact C-N 3.3Å; S348-R350 PolarHBondContact O-N 3.44Å; S348-K351 PolarHBondContact O-N 3.06Å; S348-K351 VanDerWaalsContact O-N 3.12Å; S348-E352 WeakPolarHBondContact O-CG 3.38Å; S348-E352 PolarHBondContact O-N 3.37Å; S348-E352 PolarHBondContact OG-OE1 3.37Å
349	V	85.9	Confident	89.6	Confident	81 Å²	81	65.6 Å²	65.6	49%	0.491	36%	0.356	S	S	.	.	H	α-helix	trans	-61.4	-38.8	-178.8	171.3	0	0	0	0	111.3	S345 L346 E352 Y353	S345-V349 WeakPolarHBondContact O-CG2 3.26Å; S345-V349 PolarHBondContact O-N 2.99Å; L346-V349 PolarHBondContact O-N 3.31Å; V349-E352 PolarHBondContact O-N 2.81Å; V349-Y353 VanDerWaalsContact O-CB 3.26Å; V349-Y353 WeakPolarHBondContact O-CB 2.98Å; V349-Y353 PolarHBondContact O-N 2.96Å
350	R	86.2	Confident	89.4	Confident	70 Å²	70	66.9 Å²	66.9	26%	0.264	36%	0.359	S	S	.	.	H	α-helix	trans	-64.5	-41.5	175.2	-75.8	-173.6	-171.3	-105.7	23.7	112.8	L346 V347 S348 Y353 S354 A398 D401	L346-R350 HydrophobicContact CD1-CG 4.42Å; L346-R350 WeakPolarHBondContact O-CG 3.31Å; L346-R350 PolarHBondContact O-N 3.39Å; V347-R350 PolarHBondContact O-N 3.05Å; S348-R350 VanDerWaalsContact C-N 3.3Å; S348-R350 PolarHBondContact O-N 3.44Å; R350-Y353 PolarHBondContact O-N 3.15Å; R350-S354 PolarHBondContact O-N 2.99Å; R350-A398 HydrophobicContact CB-CB 3.79Å; R350-D401 WeakPolarHBondContact CD-OD2 3.47Å; R350-D401 IonicContact CZ-OD2 3.23Å; R350-D401 IonicContact NE-OD2 2.81Å; R350-D401 PolarHBondContact NE-OD2 2.99Å; R350-D401 IonicContact NH2-OD1 3.01Å; R350-D401 IonicContact NH2-OD2 3.81Å; R350-D401 PolarHBondContact NH2-OD2 3.41Å
351	K	89.2	Confident	89.3	Confident	54 Å²	54	65.8 Å²	65.8	24%	0.235	35%	0.353	C	S	.	.	H	α-helix	trans	-64.8	-44.7	175.9	-72.3	-168	178.6	-145.2	0	111	E244 V347 S348 Y353 S354 V355 A398 D399	E244-K351 IonicContact OE1-NZ 2.82Å; E244-K351 PolarHBondContact OE1-NZ 3.46Å; V347-K351 HydrophobicContact CG1-CD 4.45Å; V347-K351 WeakPolarHBondContact O-CG 3.19Å; V347-K351 PolarHBondContact O-N 2.74Å; S348-K351 PolarHBondContact O-N 3.06Å; S348-K351 VanDerWaalsContact O-N 3.12Å; K351-Y353 VanDerWaalsContact C-N 3.31Å; K351-Y353 PolarHBondContact O-N 3.18Å; K351-S354 PolarHBondContact O-N 2.86Å; K351-V355 WeakPolarHBondContact O-CG2 3.47Å; K351-V355 PolarHBondContact O-N 2.96Å; K351-A398 HydrophobicContact CG-CB 3.54Å; K351-D399 WeakPolarHBondContact CE-OD1 3.48Å; K351-D399 IonicContact NZ-OD1 2.67Å; K351-D399 PolarHBondContact NZ-OD1 3.38Å
352	E	88.9	Confident	89.2	Confident	117 Å²	117	68.9 Å²	68.9	55%	0.547	36%	0.356	S	S	.	.	H	α-helix	trans	-59.8	-41.4	174.8	-71.3	166.6	-141.5	0	0	112	S348 V349 V355 A356	S348-E352 WeakPolarHBondContact O-CG 3.38Å; S348-E352 PolarHBondContact O-N 3.37Å; S348-E352 PolarHBondContact OG-OE1 3.37Å; V349-E352 PolarHBondContact O-N 2.81Å; E352-V355 PolarHBondContact O-N 3.27Å; E352-A356 WeakPolarHBondContact O-CB 3.24Å; E352-A356 PolarHBondContact O-N 2.78Å
353	Y	86.1	Confident	89.3	Confident	138 Å²	138	65.3 Å²	65.3	54%	0.541	35%	0.35	S	S	.	.	H	α-helix	trans	-65.1	-40	177.7	-176.5	-127	0	0	0	112.7	V349 R350 K351 A356 T357 Q394	V349-Y353 VanDerWaalsContact O-CB 3.26Å; V349-Y353 WeakPolarHBondContact O-CB 2.98Å; V349-Y353 PolarHBondContact O-N 2.96Å; R350-Y353 PolarHBondContact O-N 3.15Å; K351-Y353 VanDerWaalsContact C-N 3.31Å; K351-Y353 PolarHBondContact O-N 3.18Å; Y353-A356 PolarHBondContact O-N 2.79Å; Y353-T357 WeakPolarHBondContact O-CB 3.05Å; Y353-T357 PolarHBondContact O-N 3.44Å; Y353-T357 PolarHBondContact O-OG1 3.34Å; Y353-Q394 VanDerWaalsContact CD1-CD 3.45Å; Y353-Q394 HydrophobicContact CD1-CG 4.13Å; Y353-Q394 HydrophobicContact CE1-CG 4.13Å; Y353-Q394 PolarHBondContact O-OE1 2.79Å
354	S	88.7	Confident	89.3	Confident	5 Å²	5	65.7 Å²	65.7	4%	0.035	35%	0.352	C	S	.	.	H	α-helix	trans	-61.8	-49.5	172.9	178.6	0	0	0	0	111.4	R350 K351 A356 T357 E358 S391 N395	R350-S354 PolarHBondContact O-N 2.99Å; K351-S354 PolarHBondContact O-N 2.86Å; S354-A356 VanDerWaalsContact C-N 3.32Å; S354-A356 PolarHBondContact O-N 3.5Å; S354-T357 WeakPolarHBondContact O-CB 3.37Å; S354-T357 PolarHBondContact O-N 3.34Å; S354-T357 VanDerWaalsContact O-N 3.11Å; S354-E358 PolarHBondContact O-N 3.02Å; S354-S391 PolarHBondContact O-OG 2.83Å; S354-S391 PolarHBondContact OG-O 3.39Å; S354-N395 WeakPolarHBondContact OG-CB 3.27Å
355	V	91.6	Very high	89.4	Confident	94 Å²	94	62.7 Å²	62.7	57%	0.57	34%	0.343	S	S	*	.	H	α-helix	trans	-61.1	-39.9	178.4	173.5	0	0	0	0	111.9	K351 E352 T357 E358 G359	K351-V355 WeakPolarHBondContact O-CG2 3.47Å; K351-V355 PolarHBondContact O-N 2.96Å; E352-V355 PolarHBondContact O-N 3.27Å; V355-T357 VanDerWaalsContact C-N 3.35Å; V355-E358 PolarHBondContact O-N 2.82Å; V355-G359 PolarHBondContact O-N 3.44Å
356	A	90	Very high	89.6	Confident	63 Å²	63	66 Å²	66	52%	0.521	35%	0.352	S	S	.	.	H	α-helix	trans	-64.3	-39.9	175.7	0	0	0	0	0	112	E352 Y353 S354 G359 F360	E352-A356 WeakPolarHBondContact O-CB 3.24Å; E352-A356 PolarHBondContact O-N 2.78Å; Y353-A356 PolarHBondContact O-N 2.79Å; S354-A356 VanDerWaalsContact C-N 3.32Å; S354-A356 PolarHBondContact O-N 3.5Å; A356-G359 PolarHBondContact O-N 3.48Å; A356-F360 PolarHBondContact O-N 3.42Å
357	T	87.7	Confident	89.8	Confident	8 Å²	8	67.1 Å²	67.1	5%	0.049	36%	0.358	C	S	.	.	H	α-helix	trans	-63.8	-44.7	175.4	-58.2	0	0	0	0	110.9	Y353 S354 V355 G359 F360 C361 M387 V390 Q394	Y353-T357 WeakPolarHBondContact O-CB 3.05Å; Y353-T357 PolarHBondContact O-N 3.44Å; Y353-T357 PolarHBondContact O-OG1 3.34Å; S354-T357 WeakPolarHBondContact O-CB 3.37Å; S354-T357 PolarHBondContact O-N 3.34Å; S354-T357 VanDerWaalsContact O-N 3.11Å; V355-T357 VanDerWaalsContact C-N 3.35Å; T357-G359 VanDerWaalsContact C-N 3.33Å; T357-G359 PolarHBondContact O-N 3.47Å; T357-F360 WeakPolarHBondContact O-CB 3.49Å; T357-F360 PolarHBondContact O-N 2.74Å; T357-C361 PolarHBondContact O-N 3.24Å; T357-C361 PolarHBondContact O-SG 2.93Å; T357-M387 HydrophobicContact CG2-CE 3.76Å; T357-V390 HydrophobicContact CG2-CG1 4.49Å; T357-Q394 PolarHBondContact OG1-OE1 2.96Å; T357-Q394 VanDerWaalsContact OG1-OE1 3.04Å
358	E	91.5	Very high	90	Very high	87 Å²	87	67.2 Å²	67.2	41%	0.407	36%	0.359	S	S	.	.	H	α-helix	trans	-60.4	-42.2	174.1	-165.3	-164.2	144.9	0	0	112	S354 V355 F360 C361 K362 S391	S354-E358 PolarHBondContact O-N 3.02Å; V355-E358 PolarHBondContact O-N 2.82Å; E358-F360 VanDerWaalsContact C-N 3.33Å; E358-F360 PolarHBondContact O-N 3.16Å; E358-C361 WeakPolarHBondContact O-CB 3.46Å; E358-C361 PolarHBondContact O-N 3.41Å; E358-K362 WeakPolarHBondContact O-CG 3.36Å; E358-K362 PolarHBondContact O-N 2.66Å; E358-K362 VanDerWaalsContact O-N 3.09Å; E358-K362 WeakPolarHBondContact OE1-CE 3.28Å; E358-K362 IonicContact OE1-NZ 2.72Å; E358-K362 PolarHBondContact OE1-NZ 3.48Å; E358-S391 PolarHBondContact N-OG 3.46Å
359	G	91.9	Very high	90.1	Very high	32 Å²	32	68.8 Å²	68.8	33%	0.33	38%	0.375	S	S	.	.	H	α-helix	trans	-59.7	-42.9	173.9	0	0	0	0	0	112.3	V355 A356 T357 K362 C363	V355-G359 PolarHBondContact O-N 3.44Å; A356-G359 PolarHBondContact O-N 3.48Å; T357-G359 VanDerWaalsContact C-N 3.33Å; T357-G359 PolarHBondContact O-N 3.47Å; G359-K362 PolarHBondContact O-N 3.03Å; G359-C363 PolarHBondContact O-N 2.97Å
360	F	88.1	Confident	90.4	Very high	102 Å²	102	69.8 Å²	69.8	45%	0.447	39%	0.385	S	S	.	.	H	α-helix	trans	-62.9	-42.3	174.4	176.7	-109.2	0	0	0	112.2	A356 T357 E358 K362 C363 L364 M387	A356-F360 PolarHBondContact O-N 3.42Å; T357-F360 WeakPolarHBondContact O-CB 3.49Å; T357-F360 PolarHBondContact O-N 2.74Å; E358-F360 VanDerWaalsContact C-N 3.33Å; E358-F360 PolarHBondContact O-N 3.16Å; F360-K362 VanDerWaalsContact C-N 3.32Å; F360-K362 PolarHBondContact O-N 3.26Å; F360-C363 PolarHBondContact O-N 3.48Å; F360-L364 HydrophobicContact CE1-CD2 4.46Å; F360-L364 WeakPolarHBondContact O-CB 3.34Å; F360-L364 PolarHBondContact O-N 3.23Å; F360-M387 HydrophobicContact CD1-CE 3.67Å; F360-M387 HydrophobicContact CD1-CG 4.31Å; F360-M387 HydrophobicContact CE1-CE 3.88Å; F360-M387 HydrophobicContact CE1-CG 4.1Å
361	C	90.9	Very high	90.7	Very high	2 Å²	2	69.3 Å²	69.3	1%	0.014	39%	0.386	C	S	.	.	H	α-helix	trans	-56	-46.4	174.2	-61.8	0	0	0	0	111.5	T357 E358 C363 L364 S365 M387 E388	T357-C361 PolarHBondContact O-N 3.24Å; T357-C361 PolarHBondContact O-SG 2.93Å; E358-C361 WeakPolarHBondContact O-CB 3.46Å; E358-C361 PolarHBondContact O-N 3.41Å; C361-C363 PolarHBondContact O-N 2.92Å; C361-L364 CarbonylContact O-C 3.56Å; C361-L364 WeakPolarHBondContact O-CA 3.33Å; C361-L364 WeakPolarHBondContact O-CB 3.33Å; C361-L364 PolarHBondContact O-N 2.82Å; C361-L364 VanDerWaalsContact O-N 3.08Å; C361-S365 PolarHBondContact O-N 2.95Å; C361-S365 PolarHBondContact O-OG 3.44Å; C361-M387 WeakPolarHBondContact SG-CB 3.37Å; C361-E388 HydrophobicContact CB-CG 3.91Å; C361-E388 PolarHBondContact SG-N 2.84Å
362	K	92.6	Very high	90.8	Very high	119 Å²	119	75.6 Å²	75.6	52%	0.517	42%	0.416	S	S	.	.	H	α-helix	trans	-59.6	-44.8	178.8	-69.6	169.4	-175	165.2	0	111.9	E358 G359 F360 L364 S365 M366	E358-K362 WeakPolarHBondContact O-CG 3.36Å; E358-K362 PolarHBondContact O-N 2.66Å; E358-K362 VanDerWaalsContact O-N 3.09Å; E358-K362 WeakPolarHBondContact OE1-CE 3.28Å; E358-K362 IonicContact OE1-NZ 2.72Å; E358-K362 PolarHBondContact OE1-NZ 3.48Å; G359-K362 PolarHBondContact O-N 3.03Å; F360-K362 VanDerWaalsContact C-N 3.32Å; F360-K362 PolarHBondContact O-N 3.26Å; K362-L364 VanDerWaalsContact C-N 3.31Å; K362-L364 PolarHBondContact O-N 3.3Å; K362-S365 PolarHBondContact O-N 2.88Å; K362-M366 WeakPolarHBondContact O-CG 3.45Å; K362-M366 PolarHBondContact O-N 3.35Å; K362-M366 VanDerWaalsContact O-N 3.13Å
363	C	92.4	Very high	90.9	Very high	83 Å²	83	73 Å²	73	56%	0.561	41%	0.406	S	S	*	.	H	α-helix	trans	-61.7	-40.9	174.3	-67.2	0	0	0	0	111.9	G359 F360 C361 M366 L367	G359-C363 PolarHBondContact O-N 2.97Å; F360-C363 PolarHBondContact O-N 3.48Å; C361-C363 PolarHBondContact O-N 2.92Å; C363-M366 PolarHBondContact O-N 3.37Å; C363-L367 PolarHBondContact O-N 3.45Å
364	L	90.6	Very high	91.1	Very high	11 Å²	11	70.5 Å²	70.5	6%	0.058	41%	0.405	C	S	.	.	H	α-helix	trans	-66.1	-41	178	-174.2	62.4	0	0	0	112	F360 C361 K362 M366 L367 T368 L380 L383 C384	F360-L364 HydrophobicContact CE1-CD2 4.46Å; F360-L364 WeakPolarHBondContact O-CB 3.34Å; F360-L364 PolarHBondContact O-N 3.23Å; C361-L364 CarbonylContact O-C 3.56Å; C361-L364 WeakPolarHBondContact O-CA 3.33Å; C361-L364 WeakPolarHBondContact O-CB 3.33Å; C361-L364 PolarHBondContact O-N 2.82Å; C361-L364 VanDerWaalsContact O-N 3.08Å; K362-L364 VanDerWaalsContact C-N 3.31Å; K362-L364 PolarHBondContact O-N 3.3Å; L364-M366 VanDerWaalsContact C-N 3.3Å; L364-M366 PolarHBondContact O-N 2.96Å; L364-L367 HydrophobicContact CD1-CD2 4.42Å; L364-L367 WeakPolarHBondContact O-CB 3.5Å; L364-L367 PolarHBondContact O-N 3.27Å; L364-T368 PolarHBondContact O-N 3.1Å; L364-T368 PolarHBondContact O-OG1 3.04Å; L364-L380 HydrophobicContact CD1-CB 4.45Å; L364-L380 HydrophobicContact CD1-CD2 3.73Å; L364-L383 HydrophobicContact CD1-CD2 4.26Å; L364-L383 HydrophobicContact CD2-CB 3.91Å; L364-L383 HydrophobicContact CD2-CD2 3.69Å; L364-L383 HydrophobicContact CD2-CG 3.53Å; L364-C384 HydrophobicContact CD2-CB 4.05Å; L364-C384 HydrophobicContact CG-CB 4.31Å
365	S	92	Very high	91.1	Very high	47 Å²	47	72.6 Å²	72.6	33%	0.329	42%	0.42	S	S	.	.	H	α-helix	trans	-61.3	-39.8	174.4	-41.1	0	0	0	0	111.8	C361 K362 T368 A369 C384	C361-S365 PolarHBondContact O-N 2.95Å; C361-S365 PolarHBondContact O-OG 3.44Å; K362-S365 PolarHBondContact O-N 2.88Å; S365-T368 WeakPolarHBondContact O-CB 3.45Å; S365-T368 PolarHBondContact O-N 3.27Å; S365-A369 PolarHBondContact O-N 3.4Å; S365-C384 PolarHBondContact OG-SG 3.02Å
366	M	93.4	Very high	91	Very high	137 Å²	137	70.4 Å²	70.4	68%	0.675	40%	0.404	S	S	*	.	H	α-helix	trans	-63.8	-41.9	175.3	-69	176.1	67.9	0	0	111.4	K362 C363 L364 A369 C370	K362-M366 WeakPolarHBondContact O-CG 3.45Å; K362-M366 PolarHBondContact O-N 3.35Å; K362-M366 VanDerWaalsContact O-N 3.13Å; C363-M366 PolarHBondContact O-N 3.37Å; L364-M366 VanDerWaalsContact C-N 3.3Å; L364-M366 PolarHBondContact O-N 2.96Å; M366-A369 PolarHBondContact O-N 2.93Å; M366-C370 PolarHBondContact O-N 3.44Å; M366-C370 PolarHBondContact O-SG 3.19Å
367	L	91	Very high	91	Very high	92 Å²	92	68.8 Å²	68.8	48%	0.482	39%	0.389	S	S	.	.	H	α-helix	trans	-62.1	-46.4	175.1	-179.3	63.1	0	0	0	111.4	C363 L364 A369 C370 E371 L380	C363-L367 PolarHBondContact O-N 3.45Å; L364-L367 HydrophobicContact CD1-CD2 4.42Å; L364-L367 WeakPolarHBondContact O-CB 3.5Å; L364-L367 PolarHBondContact O-N 3.27Å; L367-A369 PolarHBondContact O-N 3.37Å; L367-C370 PolarHBondContact O-N 3.36Å; L367-E371 PolarHBondContact O-N 2.92Å; L367-E371 VanDerWaalsContact O-N 3.1Å; L367-L380 HydrophobicContact CD2-CD1 4.31Å; L367-L380 HydrophobicContact CD2-CD2 4.36Å; L367-L380 HydrophobicContact CG-CD1 4.13Å
368	T	91.8	Very high	91.1	Very high	15 Å²	15	75.9 Å²	75.9	9%	0.092	42%	0.415	C	S	.	.	H	α-helix	trans	-54.9	-37.9	175	-59.5	0	0	0	0	112.4	L364 S365 E371 S377 L380 S381	L364-T368 PolarHBondContact O-N 3.1Å; L364-T368 PolarHBondContact O-OG1 3.04Å; S365-T368 WeakPolarHBondContact O-CB 3.45Å; S365-T368 PolarHBondContact O-N 3.27Å; T368-E371 PolarHBondContact O-N 3.25Å; T368-S377 WeakPolarHBondContact CG2-O 2.96Å; T368-S377 PolarHBondContact O-OG 2.88Å; T368-L380 HydrophobicContact CG2-CB 4.35Å; T368-L380 WeakPolarHBondContact OG1-CB 3.39Å; T368-S381 WeakPolarHBondContact CG2-OG 3.32Å
369	A	91.8	Very high	90.9	Very high	87 Å²	87	71.9 Å²	71.9	72%	0.719	40%	0.397	S	S	*	.	H	α-helix	trans	-73.5	-24.6	179.3	0	0	0	0	0	113.6	S365 M366 L367	S365-A369 PolarHBondContact O-N 3.4Å; M366-A369 PolarHBondContact O-N 2.93Å; L367-A369 PolarHBondContact O-N 3.37Å
370	C	92	Very high	90.8	Very high	103 Å²	103	71.3 Å²	71.3	70%	0.696	39%	0.386	S	S	*	.	H	α-helix	trans	-88	-14.3	175	-65.7	0	0	0	0	113.2	M366 L367 E372	M366-C370 PolarHBondContact O-N 3.44Å; M366-C370 PolarHBondContact O-SG 3.19Å; L367-C370 PolarHBondContact O-N 3.36Å; C370-E372 PolarHBondContact O-N 3.38Å
371	E	92.1	Very high	90.9	Very high	59 Å²	59	68.6 Å²	68.6	28%	0.276	38%	0.38	S	S	.	.			trans	-76.9	118.3	-175.2	-177.9	54.9	-122.3	0	0	112	L367 T368 N373 L376 L380	L367-E371 PolarHBondContact O-N 2.92Å; L367-E371 VanDerWaalsContact O-N 3.1Å; T368-E371 PolarHBondContact O-N 3.25Å; E371-N373 HydrophobicContact CG-CB 4.42Å; E371-N373 WeakPolarHBondContact OE1-CB 3.46Å; E371-N373 PolarHBondContact OE1-N 3.48Å; E371-L376 VanDerWaalsContact CD-CD2 3.48Å; E371-L376 HydrophobicContact CG-CB 3.95Å; E371-L376 HydrophobicContact CG-CD2 4.08Å; E371-L376 HydrophobicContact CG-CG 3.87Å; E371-L376 VanDerWaalsContact OE2-CD2 3.28Å; E371-L376 WeakPolarHBondContact OE2-CD2 3.15Å; E371-L380 HydrophobicContact CB-CD1 4.26Å; E371-L380 HydrophobicContact CG-CD1 4.33Å
372	E	91.7	Very high	90.9	Very high	186 Å²	186	70.5 Å²	70.5	87%	0.869	39%	0.389	S	S	*	.			trans	-80.6	-27.1	179.5	-61.4	-176.6	175.8	0	0	112.2	C370 T374	C370-E372 PolarHBondContact O-N 3.38Å; E372-T374 PolarHBondContact O-N 2.75Å
373	N	90.2	Very high	90.6	Very high	64 Å²	64	66.5 Å²	66.5	34%	0.342	37%	0.374	S	S	.	.			trans	-75.8	112.4	179.3	-175.6	-74.7	0	0	0	110.8	E371 S375 L376 S377	E371-N373 HydrophobicContact CG-CB 4.42Å; E371-N373 WeakPolarHBondContact OE1-CB 3.46Å; E371-N373 PolarHBondContact OE1-N 3.48Å; N373-S375 VanDerWaalsContact C-N 3.32Å; N373-S375 PolarHBondContact O-N 2.95Å; N373-S375 PolarHBondContact OD1-N 2.79Å; N373-S375 VanDerWaalsContact OD1-N 3.12Å; N373-S375 PolarHBondContact OD1-OG 2.97Å; N373-L376 HydrophobicContact CB-CB 4.08Å; N373-L376 PolarHBondContact O-N 3.45Å; N373-L376 VanDerWaalsContact O-N 3.16Å; N373-L376 PolarHBondContact OD1-N 3.05Å; N373-S377 WeakPolarHBondContact O-CB 3.39Å; N373-S377 PolarHBondContact O-N 3.47Å
374	T	90.2	Very high	90.5	Very high	85 Å²	85	63 Å²	63	52%	0.521	35%	0.35	S	S	.	.	H	α-helix	trans	-57.3	-39.3	-176.3	-44.3	0	0	0	0	113.9	E372 R378	E372-T374 PolarHBondContact O-N 2.75Å; T374-R378 VanDerWaalsContact CG2-CZ 3.49Å; T374-R378 VanDerWaalsContact O-CG 3.31Å; T374-R378 WeakPolarHBondContact O-CG 3.11Å; T374-R378 PolarHBondContact O-N 2.88Å
375	S	89.9	Confident	90.5	Very high	49 Å²	49	67.2 Å²	67.2	34%	0.343	37%	0.369	S	S	.	.	H	α-helix	trans	-67.8	-43.2	178.5	31.4	0	0	0	0	112.2	N373 R378 A379	N373-S375 VanDerWaalsContact C-N 3.32Å; N373-S375 PolarHBondContact O-N 2.95Å; N373-S375 PolarHBondContact OD1-N 2.79Å; N373-S375 VanDerWaalsContact OD1-N 3.12Å; N373-S375 PolarHBondContact OD1-OG 2.97Å; S375-R378 PolarHBondContact O-N 3.32Å; S375-A379 PolarHBondContact O-N 3.01Å
376	L	88.4	Confident	90.2	Very high	47 Å²	47	65.3 Å²	65.3	25%	0.246	36%	0.356	C	S	.	.	H	α-helix	trans	-68.2	-44.3	177.9	-179.5	54	0	0	0	111	E371 N373 R378 A379 L380 L538	E371-L376 VanDerWaalsContact CD-CD2 3.48Å; E371-L376 HydrophobicContact CG-CB 3.95Å; E371-L376 HydrophobicContact CG-CD2 4.08Å; E371-L376 HydrophobicContact CG-CG 3.87Å; E371-L376 VanDerWaalsContact OE2-CD2 3.28Å; E371-L376 WeakPolarHBondContact OE2-CD2 3.15Å; N373-L376 HydrophobicContact CB-CB 4.08Å; N373-L376 PolarHBondContact O-N 3.45Å; N373-L376 VanDerWaalsContact O-N 3.16Å; N373-L376 PolarHBondContact OD1-N 3.05Å; L376-R378 VanDerWaalsContact C-N 3.29Å; L376-R378 PolarHBondContact O-N 3.44Å; L376-A379 WeakPolarHBondContact O-CB 3.49Å; L376-A379 PolarHBondContact O-N 3.42Å; L376-L380 HydrophobicContact CD1-CD1 4.26Å; L376-L380 HydrophobicContact CD1-CD2 4.41Å; L376-L380 HydrophobicContact CD1-CG 4.01Å; L376-L380 HydrophobicContact CG-CD1 4.04Å; L376-L380 HydrophobicContact CG-CG 4.29Å; L376-L380 WeakPolarHBondContact O-CG 3.28Å; L376-L380 PolarHBondContact O-N 2.85Å; L376-L538 HydrophobicContact CD1-CD1 4Å
377	S	90.3	Very high	89.9	Confident	29 Å²	29	60.9 Å²	60.9	20%	0.203	33%	0.334	C	S	.	.	H	α-helix	trans	-56.7	-41.3	175	-176.7	0	0	0	0	111.9	T368 N373 S381	T368-S377 WeakPolarHBondContact CG2-O 2.96Å; T368-S377 PolarHBondContact O-OG 2.88Å; N373-S377 WeakPolarHBondContact O-CB 3.39Å; N373-S377 PolarHBondContact O-N 3.47Å; S377-S381 WeakPolarHBondContact O-CB 3.37Å; S377-S381 PolarHBondContact O-N 3.45Å; S377-S381 PolarHBondContact O-OG 2.72Å
378	R	90.4	Very high	89.9	Confident	158 Å²	158	60.8 Å²	60.8	60%	0.596	33%	0.331	S	S	*	.	H	α-helix	trans	-62.9	-45.1	172	-74.3	179.9	-169.7	128.3	-0.6	112.9	T374 S375 L376 S381 L382	T374-R378 VanDerWaalsContact CG2-CZ 3.49Å; T374-R378 VanDerWaalsContact O-CG 3.31Å; T374-R378 WeakPolarHBondContact O-CG 3.11Å; T374-R378 PolarHBondContact O-N 2.88Å; S375-R378 PolarHBondContact O-N 3.32Å; L376-R378 VanDerWaalsContact C-N 3.29Å; L376-R378 PolarHBondContact O-N 3.44Å; R378-S381 WeakPolarHBondContact O-CB 3.27Å; R378-S381 PolarHBondContact O-N 3.43Å; R378-L382 WeakPolarHBondContact O-CG 3.43Å; R378-L382 PolarHBondContact O-N 2.6Å
379	A	88.3	Confident	89.9	Confident	2 Å²	2	63.3 Å²	63.3	2%	0.017	34%	0.344	C	S	.	.	H	α-helix	trans	-63.3	-41.7	179	0	0	0	0	0	112.1	S375 L376 L382 L383 L531	S375-A379 PolarHBondContact O-N 3.01Å; L376-A379 WeakPolarHBondContact O-CB 3.49Å; L376-A379 PolarHBondContact O-N 3.42Å; A379-L382 PolarHBondContact O-N 2.71Å; A379-L383 PolarHBondContact O-N 3.23Å; A379-L531 HydrophobicContact CB-CD2 3.94Å
380	L	89.9	Confident	89.6	Confident	21 Å²	21	59.8 Å²	59.8	11%	0.11	31%	0.314	C	S	.	.	H	α-helix	trans	-66.2	-37.5	174.4	-64.5	171.3	0	0	0	111.9	L364 L367 T368 E371 L376 L383 C384	L364-L380 HydrophobicContact CD1-CB 4.45Å; L364-L380 HydrophobicContact CD1-CD2 3.73Å; L367-L380 HydrophobicContact CD2-CD1 4.31Å; L367-L380 HydrophobicContact CD2-CD2 4.36Å; L367-L380 HydrophobicContact CG-CD1 4.13Å; T368-L380 HydrophobicContact CG2-CB 4.35Å; T368-L380 WeakPolarHBondContact OG1-CB 3.39Å; E371-L380 HydrophobicContact CB-CD1 4.26Å; E371-L380 HydrophobicContact CG-CD1 4.33Å; L376-L380 HydrophobicContact CD1-CD1 4.26Å; L376-L380 HydrophobicContact CD1-CD2 4.41Å; L376-L380 HydrophobicContact CD1-CG 4.01Å; L376-L380 HydrophobicContact CG-CD1 4.04Å; L376-L380 HydrophobicContact CG-CG 4.29Å; L376-L380 WeakPolarHBondContact O-CG 3.28Å; L376-L380 PolarHBondContact O-N 2.85Å; L380-L383 PolarHBondContact O-N 2.81Å; L380-C384 WeakPolarHBondContact O-CB 3.36Å; L380-C384 PolarHBondContact O-N 3.31Å
381	S	90.1	Very high	89.5	Confident	44 Å²	44	55.3 Å²	55.3	31%	0.308	28%	0.283	S	S	.	.	H	α-helix	trans	-60	-47.7	173	-59	0	0	0	0	111.5	T368 S377 R378 L383 C384 E385	T368-S381 WeakPolarHBondContact CG2-OG 3.32Å; S377-S381 WeakPolarHBondContact O-CB 3.37Å; S377-S381 PolarHBondContact O-N 3.45Å; S377-S381 PolarHBondContact O-OG 2.72Å; R378-S381 WeakPolarHBondContact O-CB 3.27Å; R378-S381 PolarHBondContact O-N 3.43Å; S381-L383 VanDerWaalsContact C-N 3.33Å; S381-L383 PolarHBondContact O-N 3.43Å; S381-C384 WeakPolarHBondContact O-CB 3.33Å; S381-C384 PolarHBondContact O-N 2.95Å; S381-C384 VanDerWaalsContact O-N 3.17Å; S381-E385 WeakPolarHBondContact O-CG 3.36Å; S381-E385 PolarHBondContact O-N 3.49Å
382	L	89.2	Confident	89.5	Confident	42 Å²	42	58.4 Å²	58.4	22%	0.22	30%	0.298	C	S	.	.	H	α-helix	trans	-63.4	-38.2	177.2	-72.3	171	0	0	0	112.4	R378 A379 T386 F530	R378-L382 WeakPolarHBondContact O-CG 3.43Å; R378-L382 PolarHBondContact O-N 2.6Å; A379-L382 PolarHBondContact O-N 2.71Å; L382-T386 PolarHBondContact O-N 2.99Å; L382-T386 PolarHBondContact O-OG1 3.35Å; L382-F530 HydrophobicContact CD1-CB 4.41Å; L382-F530 HydrophobicContact CD1-CD1 3.33Å; L382-F530 HydrophobicContact CD1-CE1 3.69Å; L382-F530 HydrophobicContact CD1-CG 3.94Å
383	L	87.5	Confident	89.3	Confident	35 Å²	35	50 Å²	50	18%	0.183	26%	0.259	C	S	.	.	H	α-helix	trans	-63.8	-43.7	173.2	-178	62.2	0	0	0	110.7	L364 A379 L380 S381 E385 T386 M387 L531	L364-L383 HydrophobicContact CD1-CD2 4.26Å; L364-L383 HydrophobicContact CD2-CB 3.91Å; L364-L383 HydrophobicContact CD2-CD2 3.69Å; L364-L383 HydrophobicContact CD2-CG 3.53Å; A379-L383 PolarHBondContact O-N 3.23Å; L380-L383 PolarHBondContact O-N 2.81Å; S381-L383 VanDerWaalsContact C-N 3.33Å; S381-L383 PolarHBondContact O-N 3.43Å; L383-E385 PolarHBondContact O-N 3.01Å; L383-T386 WeakPolarHBondContact O-CB 3.38Å; L383-T386 PolarHBondContact O-N 3.25Å; L383-T386 VanDerWaalsContact O-N 3.15Å; L383-M387 HydrophobicContact CD1-CG 4.1Å; L383-M387 HydrophobicContact CG-CG 4.3Å; L383-M387 WeakPolarHBondContact O-CB 3.47Å; L383-M387 VanDerWaalsContact O-CG 3.28Å; L383-M387 WeakPolarHBondContact O-CG 3.44Å; L383-M387 PolarHBondContact O-N 3.49Å; L383-L531 HydrophobicContact CB-CD1 4.29Å; L383-L531 HydrophobicContact CD1-CD1 4.09Å
384	C	89.9	Confident	89.2	Confident	10 Å²	10	48.1 Å²	48.1	7%	0.068	25%	0.248	C	C	.	.	H	α-helix	trans	-57.3	-50.7	176.4	-166.4	0	0	0	0	111.5	L364 S365 L380 S381 T386 M387 E388	L364-C384 HydrophobicContact CD2-CB 4.05Å; L364-C384 HydrophobicContact CG-CB 4.31Å; S365-C384 PolarHBondContact OG-SG 3.02Å; L380-C384 WeakPolarHBondContact O-CB 3.36Å; L380-C384 PolarHBondContact O-N 3.31Å; S381-C384 WeakPolarHBondContact O-CB 3.33Å; S381-C384 PolarHBondContact O-N 2.95Å; S381-C384 VanDerWaalsContact O-N 3.17Å; C384-T386 VanDerWaalsContact C-N 3.28Å; C384-T386 PolarHBondContact O-N 3.43Å; C384-M387 PolarHBondContact O-N 2.82Å; C384-M387 VanDerWaalsContact O-N 3.17Å; C384-E388 WeakPolarHBondContact O-CG 3.35Å; C384-E388 PolarHBondContact O-N 2.67Å
385	E	89.9	Confident	89.2	Confident	99 Å²	99	47 Å²	47	46%	0.463	24%	0.239	S	C	.	.	H	α-helix	trans	-59.3	-37.9	175.9	-69.1	175	-175.7	0	0	112.7	S381 L383 N389 K527	S381-E385 WeakPolarHBondContact O-CG 3.36Å; S381-E385 PolarHBondContact O-N 3.49Å; L383-E385 PolarHBondContact O-N 3.01Å; E385-N389 WeakPolarHBondContact O-CB 3.45Å; E385-N389 PolarHBondContact O-N 3.42Å; E385-N389 VanDerWaalsContact O-N 3.13Å; E385-K527 VanDerWaalsContact CB-NZ 3.34Å; E385-K527 IonicContact OE2-NZ 2.63Å; E385-K527 PolarHBondContact OE2-NZ 2.69Å
386	T	87	Confident	89.3	Confident	8 Å²	8	48.5 Å²	48.5	5%	0.049	24%	0.243	C	C	.	.	H	α-helix	trans	-63.6	-48.1	176	-52.3	0	0	0	0	110.7	L382 L383 C384 N389 V390 A523 K527	L382-T386 PolarHBondContact O-N 2.99Å; L382-T386 PolarHBondContact O-OG1 3.35Å; L383-T386 WeakPolarHBondContact O-CB 3.38Å; L383-T386 PolarHBondContact O-N 3.25Å; L383-T386 VanDerWaalsContact O-N 3.15Å; C384-T386 VanDerWaalsContact C-N 3.28Å; C384-T386 PolarHBondContact O-N 3.43Å; T386-N389 PolarHBondContact O-N 2.88Å; T386-V390 HydrophobicContact CG2-CG2 4.44Å; T386-V390 VanDerWaalsContact O-CG2 3.3Å; T386-V390 WeakPolarHBondContact O-CG2 3.43Å; T386-V390 PolarHBondContact O-N 3.36Å; T386-A523 HydrophobicContact CG2-CB 4.29Å; T386-A523 WeakPolarHBondContact CG2-O 3.4Å; T386-K527 WeakPolarHBondContact OG1-CD 3.31Å
387	M	87.2	Confident	89.3	Confident	43 Å²	43	46.4 Å²	46.4	21%	0.212	23%	0.232	C	C	.	.	H	α-helix	trans	-68.6	-35.4	-177.1	-67.6	-57.4	-68.1	0	0	111.6	T357 F360 C361 L383 C384 V390 S391	T357-M387 HydrophobicContact CG2-CE 3.76Å; F360-M387 HydrophobicContact CD1-CE 3.67Å; F360-M387 HydrophobicContact CD1-CG 4.31Å; F360-M387 HydrophobicContact CE1-CE 3.88Å; F360-M387 HydrophobicContact CE1-CG 4.1Å; C361-M387 WeakPolarHBondContact SG-CB 3.37Å; L383-M387 HydrophobicContact CD1-CG 4.1Å; L383-M387 HydrophobicContact CG-CG 4.3Å; L383-M387 WeakPolarHBondContact O-CB 3.47Å; L383-M387 VanDerWaalsContact O-CG 3.28Å; L383-M387 WeakPolarHBondContact O-CG 3.44Å; L383-M387 PolarHBondContact O-N 3.49Å; C384-M387 PolarHBondContact O-N 2.82Å; C384-M387 VanDerWaalsContact O-N 3.17Å; M387-V390 PolarHBondContact O-N 3.47Å; M387-S391 WeakPolarHBondContact O-CB 3.43Å; M387-S391 PolarHBondContact O-N 2.89Å
388	E	91.1	Very high	89.3	Confident	90 Å²	90	45 Å²	45	42%	0.421	22%	0.222	S	C	.	.	H	α-helix	trans	-61.8	-45.9	171.8	-76.5	176.5	-169.4	0	0	111.6	C361 C384 S391 Q392	C361-E388 HydrophobicContact CB-CG 3.91Å; C361-E388 PolarHBondContact SG-N 2.84Å; C384-E388 WeakPolarHBondContact O-CG 3.35Å; C384-E388 PolarHBondContact O-N 2.67Å; E388-S391 WeakPolarHBondContact O-CB 3.46Å; E388-S391 PolarHBondContact O-N 3.34Å; E388-Q392 WeakPolarHBondContact O-CG 3.34Å; E388-Q392 PolarHBondContact O-N 3.22Å
389	N	90.1	Very high	89.3	Confident	68 Å²	68	39.6 Å²	39.6	36%	0.364	21%	0.205	S	C	.	.	H	α-helix	trans	-61.7	-45.4	175.3	-174.8	12.2	0	0	0	111.4	E385 T386 S391 Q392 L393	E385-N389 WeakPolarHBondContact O-CB 3.45Å; E385-N389 PolarHBondContact O-N 3.42Å; E385-N389 VanDerWaalsContact O-N 3.13Å; T386-N389 PolarHBondContact O-N 2.88Å; N389-S391 VanDerWaalsContact C-N 3.31Å; N389-S391 PolarHBondContact O-N 2.82Å; N389-Q392 PolarHBondContact O-N 3.12Å; N389-L393 WeakPolarHBondContact O-CG 3.46Å; N389-L393 PolarHBondContact O-N 3.25Å
390	V	86.8	Confident	89.4	Confident	14 Å²	14	42.9 Å²	42.9	9%	0.085	22%	0.219	C	C	.	.	H	α-helix	trans	-60.1	-41.1	176.1	168.5	0	0	0	0	111.4	T357 T386 M387 Q392 L393 Q394 V520	T357-V390 HydrophobicContact CG2-CG1 4.49Å; T386-V390 HydrophobicContact CG2-CG2 4.44Å; T386-V390 VanDerWaalsContact O-CG2 3.3Å; T386-V390 WeakPolarHBondContact O-CG2 3.43Å; T386-V390 PolarHBondContact O-N 3.36Å; M387-V390 PolarHBondContact O-N 3.47Å; V390-Q392 PolarHBondContact O-N 3.5Å; V390-L393 PolarHBondContact O-N 3.24Å; V390-Q394 HydrophobicContact CG1-CG 4.36Å; V390-Q394 WeakPolarHBondContact O-CB 3.33Å; V390-Q394 WeakPolarHBondContact O-CG 3.21Å; V390-Q394 PolarHBondContact O-N 2.88Å; V390-V520 HydrophobicContact CG2-CG1 4.28Å
391	S	88.9	Confident	89.4	Confident	8 Å²	8	41.9 Å²	41.9	6%	0.056	21%	0.214	C	C	.	.	H	α-helix	trans	-59.6	-44.4	176	-169	0	0	0	0	112.1	S354 E358 M387 E388 N389 Q394 N395	S354-S391 PolarHBondContact O-OG 2.83Å; S354-S391 PolarHBondContact OG-O 3.39Å; E358-S391 PolarHBondContact N-OG 3.46Å; M387-S391 WeakPolarHBondContact O-CB 3.43Å; M387-S391 PolarHBondContact O-N 2.89Å; E388-S391 WeakPolarHBondContact O-CB 3.46Å; E388-S391 PolarHBondContact O-N 3.34Å; N389-S391 VanDerWaalsContact C-N 3.31Å; N389-S391 PolarHBondContact O-N 2.82Å; S391-Q394 PolarHBondContact O-N 2.9Å; S391-N395 PolarHBondContact O-N 2.75Å
392	Q	92.1	Very high	89.4	Confident	124 Å²	124	40.4 Å²	40.4	58%	0.579	20%	0.202	S	C	*	.	H	α-helix	trans	-64.6	-47.5	177	-70	174.8	8.5	0	0	111.5	E388 N389 V390 Q394 N395 D396	E388-Q392 WeakPolarHBondContact O-CG 3.34Å; E388-Q392 PolarHBondContact O-N 3.22Å; N389-Q392 PolarHBondContact O-N 3.12Å; V390-Q392 PolarHBondContact O-N 3.5Å; Q392-Q394 VanDerWaalsContact C-N 3.27Å; Q392-Q394 PolarHBondContact O-N 2.89Å; Q392-N395 WeakPolarHBondContact O-CB 3.33Å; Q392-N395 PolarHBondContact O-N 2.75Å; Q392-N395 VanDerWaalsContact O-N 3.12Å; Q392-D396 PolarHBondContact O-N 3.09Å
393	L	89.2	Confident	89.5	Confident	11 Å²	11	41.1 Å²	41.1	6%	0.058	20%	0.204	C	C	.	.	H	α-helix	trans	-58.8	-38.4	176.6	-71.1	173.8	0	0	0	112.5	N389 V390 Q397 T516 Q519 V520	N389-L393 WeakPolarHBondContact O-CG 3.46Å; N389-L393 PolarHBondContact O-N 3.25Å; V390-L393 PolarHBondContact O-N 3.24Å; L393-Q397 WeakPolarHBondContact O-CB 3.48Å; L393-Q397 PolarHBondContact O-N 2.94Å; L393-T516 HydrophobicContact CB-CG2 4.23Å; L393-Q519 HydrophobicContact CD1-CB 3.76Å; L393-Q519 HydrophobicContact CD2-CB 4.13Å; L393-V520 HydrophobicContact CB-CG2 4.43Å; L393-V520 HydrophobicContact CD1-CG2 3.95Å
394	Q	86.2	Confident	89.6	Confident	24 Å²	24	40.4 Å²	40.4	11%	0.112	20%	0.199	C	C	.	.	H	α-helix	trans	-67.3	-42.2	175.4	-72.6	167.8	7.4	0	0	112.1	Y353 T357 V390 S391 Q392 Q397 A398	Y353-Q394 VanDerWaalsContact CD1-CD 3.45Å; Y353-Q394 HydrophobicContact CD1-CG 4.13Å; Y353-Q394 HydrophobicContact CE1-CG 4.13Å; Y353-Q394 PolarHBondContact O-OE1 2.79Å; T357-Q394 PolarHBondContact OG1-OE1 2.96Å; T357-Q394 VanDerWaalsContact OG1-OE1 3.04Å; V390-Q394 HydrophobicContact CG1-CG 4.36Å; V390-Q394 WeakPolarHBondContact O-CB 3.33Å; V390-Q394 WeakPolarHBondContact O-CG 3.21Å; V390-Q394 PolarHBondContact O-N 2.88Å; S391-Q394 PolarHBondContact O-N 2.9Å; Q392-Q394 VanDerWaalsContact C-N 3.27Å; Q392-Q394 PolarHBondContact O-N 2.89Å; Q394-Q397 PolarHBondContact O-N 3.33Å; Q394-A398 PolarHBondContact O-N 2.81Å
395	N	90.7	Very high	89.5	Confident	62 Å²	62	40.8 Å²	40.8	33%	0.332	20%	0.201	S	C	.	.	H	α-helix	trans	-61.2	-48.4	176.1	-171.3	65.7	0	0	0	110.8	S354 S391 Q392 Q397 A398 D399	S354-N395 WeakPolarHBondContact OG-CB 3.27Å; S391-N395 PolarHBondContact O-N 2.75Å; Q392-N395 WeakPolarHBondContact O-CB 3.33Å; Q392-N395 PolarHBondContact O-N 2.75Å; Q392-N395 VanDerWaalsContact O-N 3.12Å; N395-Q397 VanDerWaalsContact C-N 3.27Å; N395-Q397 PolarHBondContact O-N 2.93Å; N395-A398 VanDerWaalsContact O-CB 3.31Å; N395-A398 WeakPolarHBondContact O-CB 3.27Å; N395-A398 PolarHBondContact O-N 3.24Å; N395-D399 PolarHBondContact O-N 3.26Å
396	D	92	Very high	89.6	Confident	79 Å²	79	37.6 Å²	37.6	42%	0.422	19%	0.185	S	C	.	.	H	α-helix	trans	-59.6	-38.3	177.1	-73.8	2	0	0	0	111.8	Q392 D399 K400	Q392-D396 PolarHBondContact O-N 3.09Å; D396-D399 PolarHBondContact O-N 3.03Å; D396-K400 VanDerWaalsContact O-CG 3.26Å; D396-K400 WeakPolarHBondContact O-CG 3.47Å; D396-K400 PolarHBondContact O-N 2.73Å
397	Q	88.9	Confident	89.8	Confident	3 Å²	3	38.2 Å²	38.2	1%	0.014	19%	0.187	C	C	.	.	H	α-helix	trans	-68.3	-38	175.1	-170.3	62.1	44.6	0	0	112.2	L393 Q394 N395 D399 K400 D401 T512 T516	L393-Q397 WeakPolarHBondContact O-CB 3.48Å; L393-Q397 PolarHBondContact O-N 2.94Å; Q394-Q397 PolarHBondContact O-N 3.33Å; N395-Q397 VanDerWaalsContact C-N 3.27Å; N395-Q397 PolarHBondContact O-N 2.93Å; Q397-D399 VanDerWaalsContact C-N 3.29Å; Q397-D399 PolarHBondContact O-N 3.35Å; Q397-K400 PolarHBondContact O-N 3.06Å; Q397-D401 PolarHBondContact NE2-OD1 2.63Å; Q397-D401 WeakPolarHBondContact O-CB 3.38Å; Q397-D401 PolarHBondContact O-N 3.48Å; Q397-T512 PolarHBondContact OE1-O 3.09Å; Q397-T516 HydrophobicContact CB-CG2 4.13Å; Q397-T516 HydrophobicContact CG-CG2 4.47Å; Q397-T516 VanDerWaalsContact OE1-CB 3.25Å; Q397-T516 PolarHBondContact OE1-OG1 3.12Å
398	A	89.6	Confident	89.8	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-59.8	-42.2	174.6	0	0	0	0	0	111.2	R350 K351 Q394 N395 F402	R350-A398 HydrophobicContact CB-CB 3.79Å; K351-A398 HydrophobicContact CG-CB 3.54Å; Q394-A398 PolarHBondContact O-N 2.81Å; N395-A398 VanDerWaalsContact O-CB 3.31Å; N395-A398 WeakPolarHBondContact O-CB 3.27Å; N395-A398 PolarHBondContact O-N 3.24Å; A398-F402 WeakPolarHBondContact O-CB 3.11Å; A398-F402 PolarHBondContact O-N 3.38Å
399	D	91.4	Very high	89.9	Confident	45 Å²	45	33.3 Å²	33.3	24%	0.241	16%	0.164	C	C	.	.	H	α-helix	trans	-69	-42.2	176.9	-70.9	-22.8	0	0	0	111.7	K351 N395 D396 Q397 D401 F402 F403	K351-D399 WeakPolarHBondContact CE-OD1 3.48Å; K351-D399 IonicContact NZ-OD1 2.67Å; K351-D399 PolarHBondContact NZ-OD1 3.38Å; N395-D399 PolarHBondContact O-N 3.26Å; D396-D399 PolarHBondContact O-N 3.03Å; Q397-D399 VanDerWaalsContact C-N 3.29Å; Q397-D399 PolarHBondContact O-N 3.35Å; D399-D401 PolarHBondContact O-N 3.4Å; D399-F402 WeakPolarHBondContact O-CB 2.97Å; D399-F402 PolarHBondContact O-N 2.93Å; D399-F403 WeakPolarHBondContact O-CD2 3.39Å; D399-F403 PolarHBondContact O-N 2.91Å
400	K	90.2	Very high	90	Very high	70 Å²	70	33.3 Å²	33.3	30%	0.304	16%	0.161	S	C	.	.	H	α-helix	trans	-58.4	-48.8	173.2	-71.9	168	-166.6	165.1	0	111.9	D396 Q397 F402 F403 I404 T512	D396-K400 VanDerWaalsContact O-CG 3.26Å; D396-K400 WeakPolarHBondContact O-CG 3.47Å; D396-K400 PolarHBondContact O-N 2.73Å; Q397-K400 PolarHBondContact O-N 3.06Å; K400-F402 VanDerWaalsContact C-N 3.26Å; K400-F402 PolarHBondContact O-N 3.09Å; K400-F403 PolarHBondContact O-N 3.4Å; K400-I404 HydrophobicContact CB-CD1 4.11Å; K400-I404 VanDerWaalsContact O-CB 3.28Å; K400-I404 WeakPolarHBondContact O-CB 3.3Å; K400-I404 VanDerWaalsContact O-CG1 3.23Å; K400-I404 WeakPolarHBondContact O-CG1 3.33Å; K400-I404 PolarHBondContact O-N 3.33Å; K400-T512 HydrophobicContact CD-CG2 4.25Å
401	D	88.6	Confident	90.3	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.005	16%	0.162	C	C	.	.	H	α-helix	trans	-59.4	-39	177.1	-80.2	23.9	0	0	0	111.3	V347 R350 Q397 D399 L405 Y406 L509	V347-D401 HydrophobicContact CG2-CB 4.1Å; R350-D401 WeakPolarHBondContact CD-OD2 3.47Å; R350-D401 IonicContact CZ-OD2 3.23Å; R350-D401 IonicContact NE-OD2 2.81Å; R350-D401 PolarHBondContact NE-OD2 2.99Å; R350-D401 IonicContact NH2-OD1 3.01Å; R350-D401 IonicContact NH2-OD2 3.81Å; R350-D401 PolarHBondContact NH2-OD2 3.41Å; Q397-D401 PolarHBondContact NE2-OD1 2.63Å; Q397-D401 WeakPolarHBondContact O-CB 3.38Å; Q397-D401 PolarHBondContact O-N 3.48Å; D399-D401 PolarHBondContact O-N 3.4Å; D401-L405 VanDerWaalsContact O-CB 3.31Å; D401-L405 WeakPolarHBondContact O-CB 3.38Å; D401-L405 PolarHBondContact O-N 2.93Å; D401-Y406 PolarHBondContact O-N 2.98Å; D401-L509 WeakPolarHBondContact OD1-CD1 3.24Å
402	F	91.4	Very high	90.5	Very high	12 Å²	12	33.3 Å²	33.3	5%	0.053	16%	0.16	C	C	.	.	I	π-helix	trans	-61.2	-51	175.8	178.7	-89	0	0	0	112.3	R248 V347 A398 D399 K400 Y406 E407	R248-F402 HydrophobicContact CG-CE1 3.69Å; R248-F402 HydrophobicContact CG-CZ 4.29Å; R248-F402 VanDerWaalsContact NE-CZ 3.32Å; R248-F402 VanDerWaalsContact NH1-CZ 3.3Å; V347-F402 HydrophobicContact CG1-CB 3.96Å; V347-F402 HydrophobicContact CG1-CD2 4.09Å; V347-F402 HydrophobicContact CG1-CG 4.49Å; V347-F402 HydrophobicContact CG2-CB 4.13Å; A398-F402 WeakPolarHBondContact O-CB 3.11Å; A398-F402 PolarHBondContact O-N 3.38Å; D399-F402 WeakPolarHBondContact O-CB 2.97Å; D399-F402 PolarHBondContact O-N 2.93Å; K400-F402 VanDerWaalsContact C-N 3.26Å; K400-F402 PolarHBondContact O-N 3.09Å; F402-Y406 AromaticContact CD2-CD1 3.61Å; F402-Y406 HydrophobicContact CD2-CD1 3.61Å; F402-Y406 HydrophobicContact CD2-CE1 4.21Å; F402-Y406 HydrophobicContact CD2-CG 4.28Å; F402-Y406 AromaticContact CE2-CD1 3.27Å; F402-Y406 HydrophobicContact CE2-CD1 3.27Å; F402-Y406 AromaticContact CE2-CE1 3.45Å; F402-Y406 HydrophobicContact CE2-CE1 3.45Å; F402-Y406 VanDerWaalsContact CE2-CE1 3.45Å; F402-Y406 HydrophobicContact CE2-CG 4.31Å; F402-Y406 HydrophobicContact CG-CD1 4.46Å; F402-Y406 AromaticContact CZ-CD1 3.84Å; F402-Y406 HydrophobicContact CZ-CD1 3.84Å; F402-Y406 AromaticContact CZ-CE1 3.92Å; F402-Y406 HydrophobicContact CZ-CE1 3.92Å; F402-Y406 PolarHBondContact O-N 3.29Å; F402-E407 HydrophobicContact CD1-CG 4.12Å; F402-E407 HydrophobicContact CE1-CG 3.42Å; F402-E407 VanDerWaalsContact CE1-CG 3.42Å; F402-E407 HydrophobicContact CZ-CG 3.67Å; F402-E407 VanDerWaalsContact CZ-OE1 3.3Å; F402-E407 WeakPolarHBondContact CZ-OE1 3.36Å; F402-E407 PolarHBondContact O-N 2.93Å
403	F	90.1	Very high	90.6	Very high	58 Å²	58	27.7 Å²	27.7	25%	0.254	13%	0.134	S	C	.	.	I	π-helix	trans	-75.7	-38.3	-175.7	-75.9	-72.7	0	0	0	113.7	E247 R248 D399 K400	E247-F403 HydrophobicContact CG-CE1 4.42Å; E247-F403 HydrophobicContact CG-CZ 4.17Å; R248-F403 HydrophobicContact CB-CE1 4.35Å; R248-F403 HydrophobicContact CG-CE1 3.65Å; R248-F403 HydrophobicContact CG-CZ 3.82Å; D399-F403 WeakPolarHBondContact O-CD2 3.39Å; D399-F403 PolarHBondContact O-N 2.91Å; K400-F403 PolarHBondContact O-N 3.4Å
404	I	89.6	Confident	90.8	Very high	19 Å²	19	28.5 Å²	28.5	10%	0.097	14%	0.142	C	C	.	.	I	π-helix	trans	-79.7	-49.6	-175.9	-61.3	167.8	0	0	0	110.5	K400 M408 M505 H508 L509 T512	K400-I404 HydrophobicContact CB-CD1 4.11Å; K400-I404 VanDerWaalsContact O-CB 3.28Å; K400-I404 WeakPolarHBondContact O-CB 3.3Å; K400-I404 VanDerWaalsContact O-CG1 3.23Å; K400-I404 WeakPolarHBondContact O-CG1 3.33Å; K400-I404 PolarHBondContact O-N 3.33Å; I404-M408 VanDerWaalsContact O-CB 3.24Å; I404-M408 WeakPolarHBondContact O-CB 3.37Å; I404-M505 HydrophobicContact CG2-CG 3.98Å; I404-M505 WeakPolarHBondContact O-CG 3.33Å; I404-H508 WeakPolarHBondContact CD1-CD2 3.47Å; I404-H508 WeakPolarHBondContact CD1-NE2 3.45Å; I404-L509 HydrophobicContact CG2-CB 4.13Å; I404-T512 HydrophobicContact CD1-CG2 3.82Å
405	L	88.7	Confident	91.2	Very high	19 Å²	19	28 Å²	28	10%	0.099	14%	0.14	C	C	.	.	I	π-helix	trans	-96.6	-63.7	-171.5	-179.4	65.4	0	0	0	111.9	A343 L346 D401 M408 L409 M505 L509	A343-L405 HydrophobicContact CB-CD2 3.99Å; A343-L405 HydrophobicContact CB-CG 4.04Å; L346-L405 HydrophobicContact CD2-CD2 4.26Å; D401-L405 VanDerWaalsContact O-CB 3.31Å; D401-L405 WeakPolarHBondContact O-CB 3.38Å; D401-L405 PolarHBondContact O-N 2.93Å; L405-M408 PolarHBondContact O-N 3.42Å; L405-L409 HydrophobicContact CD1-CD1 3.71Å; L405-L409 HydrophobicContact CD1-CG 4.14Å; L405-L409 HydrophobicContact CG-CD1 3.91Å; L405-L409 WeakPolarHBondContact O-CG 3.44Å; L405-L409 PolarHBondContact O-N 2.85Å; L405-M505 HydrophobicContact CD1-CE 3.96Å; L405-M505 HydrophobicContact CD1-SD 3.96Å; L405-L509 HydrophobicContact CB-CD1 4.43Å; L405-L509 HydrophobicContact CB-CD2 4.35Å; L405-L509 HydrophobicContact CD1-CD2 4.28Å; L405-L509 HydrophobicContact CD2-CD2 4.04Å; L405-L509 HydrophobicContact CG-CD2 4.46Å
406	Y	91.5	Very high	91.4	Very high	32 Å²	32	25.1 Å²	25.1	13%	0.125	12%	0.124	C	C	.	.	I	π-helix	trans	-61.7	-52	-170.9	167.8	-95.2	0	0	0	112.4	L340 E344 D401 F402 M408 L409 K410	L340-Y406 HydrophobicContact CD1-CD2 3.57Å; L340-Y406 HydrophobicContact CD1-CE2 3.54Å; L340-Y406 HydrophobicContact CD1-CG 4.46Å; L340-Y406 HydrophobicContact CG-CE2 4.35Å; E344-Y406 HydrophobicContact CB-CD2 3.95Å; E344-Y406 HydrophobicContact CB-CE2 3.78Å; E344-Y406 HydrophobicContact CG-CE2 4.08Å; D401-Y406 PolarHBondContact O-N 2.98Å; F402-Y406 AromaticContact CD2-CD1 3.61Å; F402-Y406 HydrophobicContact CD2-CD1 3.61Å; F402-Y406 HydrophobicContact CD2-CE1 4.21Å; F402-Y406 HydrophobicContact CD2-CG 4.28Å; F402-Y406 AromaticContact CE2-CD1 3.27Å; F402-Y406 HydrophobicContact CE2-CD1 3.27Å; F402-Y406 AromaticContact CE2-CE1 3.45Å; F402-Y406 HydrophobicContact CE2-CE1 3.45Å; F402-Y406 VanDerWaalsContact CE2-CE1 3.45Å; F402-Y406 HydrophobicContact CE2-CG 4.31Å; F402-Y406 HydrophobicContact CG-CD1 4.46Å; F402-Y406 AromaticContact CZ-CD1 3.84Å; F402-Y406 HydrophobicContact CZ-CD1 3.84Å; F402-Y406 AromaticContact CZ-CE1 3.92Å; F402-Y406 HydrophobicContact CZ-CE1 3.92Å; F402-Y406 PolarHBondContact O-N 3.29Å; Y406-M408 PolarHBondContact O-N 3.07Å; Y406-L409 PolarHBondContact O-N 3.05Å; Y406-K410 HydrophobicContact CE1-CD 4.07Å; Y406-K410 WeakPolarHBondContact O-CB 3.46Å; Y406-K410 PolarHBondContact O-N 3.28Å
407	E	90.6	Very high	91.5	Very high	20 Å²	20	25.2 Å²	25.2	9%	0.093	12%	0.122	C	C	.	.	H	α-helix	trans	-64.4	-30.6	-179.9	-79.7	-69.8	134.5	0	0	111.8	R255 F402 K410 D411	R255-E407 PolarHBondContact NH1-O 3.38Å; F402-E407 HydrophobicContact CD1-CG 4.12Å; F402-E407 HydrophobicContact CE1-CG 3.42Å; F402-E407 VanDerWaalsContact CE1-CG 3.42Å; F402-E407 HydrophobicContact CZ-CG 3.67Å; F402-E407 VanDerWaalsContact CZ-OE1 3.3Å; F402-E407 WeakPolarHBondContact CZ-OE1 3.36Å; F402-E407 PolarHBondContact O-N 2.93Å; E407-K410 IonicContact OE1-NZ 3.52Å; E407-K410 PolarHBondContact OE1-NZ 3.18Å; E407-D411 VanDerWaalsContact O-CB 3.29Å; E407-D411 WeakPolarHBondContact O-CB 3.19Å; E407-D411 PolarHBondContact O-N 3.04Å
408	M	89.2	Confident	91.8	Very high	30 Å²	30	25.5 Å²	25.5	15%	0.148	12%	0.124	C	C	.	.	H	α-helix	trans	-69.3	-47.9	174.8	-172.6	171.8	-50.9	0	0	112	I404 L405 Y406 K410 D411 Y412 M505	I404-M408 VanDerWaalsContact O-CB 3.24Å; I404-M408 WeakPolarHBondContact O-CB 3.37Å; L405-M408 PolarHBondContact O-N 3.42Å; Y406-M408 PolarHBondContact O-N 3.07Å; M408-K410 VanDerWaalsContact C-N 3.34Å; M408-K410 PolarHBondContact O-N 2.7Å; M408-D411 PolarHBondContact O-N 3.42Å; M408-Y412 HydrophobicContact CG-CD2 3.84Å; M408-Y412 HydrophobicContact CG-CE2 4.01Å; M408-Y412 WeakPolarHBondContact O-CD2 3.43Å; M408-Y412 PolarHBondContact O-N 3.23Å; M408-Y412 HydrophobicContact SD-CE2 4.25Å; M408-M505 HydrophobicContact CB-SD 3.7Å; M408-M505 HydrophobicContact CE-CB 3.67Å; M408-M505 HydrophobicContact CE-CG 3.76Å; M408-M505 HydrophobicContact CE-SD 4.16Å; M408-M505 HydrophobicContact CG-SD 3.77Å; M408-M505 HydrophobicContact SD-CB 3.46Å; M408-M505 WeakPolarHBondContact SD-CB 3.39Å; M408-M505 HydrophobicContact SD-CE 4.49Å; M408-M505 HydrophobicContact SD-CG 3.6Å; M408-M505 HydrophobicContact SD-SD 3.34Å
409	L	91.8	Very high	92.2	Very high	1 Å²	1	25.6 Å²	25.6	1%	0.005	13%	0.125	C	C	.	.	H	α-helix	trans	-59.6	-44.7	177.5	-70.6	171.8	0	0	0	111.9	M336 L339 L340 A343 L405 Y406 D411 Y412 V413 F502	M336-L409 HydrophobicContact SD-CD2 4.27Å; L339-L409 HydrophobicContact CD2-CD1 4.24Å; L339-L409 HydrophobicContact CD2-CD2 3.58Å; L339-L409 HydrophobicContact CG-CD1 3.81Å; L339-L409 HydrophobicContact CG-CD2 4.01Å; L340-L409 HydrophobicContact CB-CB 4.44Å; L340-L409 HydrophobicContact CD1-CB 3.91Å; A343-L409 HydrophobicContact CB-CD1 3.6Å; L405-L409 HydrophobicContact CD1-CD1 3.71Å; L405-L409 HydrophobicContact CD1-CG 4.14Å; L405-L409 HydrophobicContact CG-CD1 3.91Å; L405-L409 WeakPolarHBondContact O-CG 3.44Å; L405-L409 PolarHBondContact O-N 2.85Å; Y406-L409 PolarHBondContact O-N 3.05Å; L409-D411 VanDerWaalsContact C-N 3.28Å; L409-D411 PolarHBondContact O-N 3.3Å; L409-Y412 PolarHBondContact O-N 2.69Å; L409-V413 WeakPolarHBondContact O-CG2 3.12Å; L409-V413 PolarHBondContact O-N 3.21Å; L409-F502 HydrophobicContact CD2-CE1 3.69Å; L409-F502 HydrophobicContact CD2-CZ 4.01Å
410	K	92.6	Very high	92.3	Very high	67 Å²	67	25.5 Å²	25.5	29%	0.291	12%	0.122	S	C	.	.	H	α-helix	trans	-57.3	-44	179.1	179.2	-179.6	169.8	-170.3	0	112.3	L340 Y406 E407 M408 V413 A414	L340-K410 HydrophobicContact CD1-CB 3.83Å; L340-K410 HydrophobicContact CD2-CB 4.31Å; Y406-K410 HydrophobicContact CE1-CD 4.07Å; Y406-K410 WeakPolarHBondContact O-CB 3.46Å; Y406-K410 PolarHBondContact O-N 3.28Å; E407-K410 IonicContact OE1-NZ 3.52Å; E407-K410 PolarHBondContact OE1-NZ 3.18Å; M408-K410 VanDerWaalsContact C-N 3.34Å; M408-K410 PolarHBondContact O-N 2.7Å; K410-V413 PolarHBondContact O-N 2.73Å; K410-A414 PolarHBondContact O-N 3.42Å
411	D	92.2	Very high	92.5	Very high	20 Å²	20	24.6 Å²	24.6	11%	0.107	12%	0.119	C	C	.	.	H	α-helix	trans	-73.9	-31.9	180	164.7	76.4	0	0	0	112.2	R255 R259 E407 M408 L409 A414 L415	R255-D411 WeakPolarHBondContact CD-OD2 3.43Å; R255-D411 IonicContact CZ-OD2 3.64Å; R255-D411 IonicContact NE-OD2 3.82Å; R255-D411 IonicContact NH1-OD2 2.72Å; R255-D411 PolarHBondContact NH1-OD2 2.98Å; R255-D411 VanDerWaalsContact NH1-OD2 3.14Å; R259-D411 IonicContact CZ-OD2 2.74Å; R259-D411 VanDerWaalsContact NH1-CG 3.28Å; R259-D411 IonicContact NH1-OD1 4Å; R259-D411 PolarHBondContact NH1-OD1 2.99Å; R259-D411 IonicContact NH1-OD2 2.68Å; R259-D411 PolarHBondContact NH1-OD2 3.41Å; R259-D411 IonicContact NH2-OD2 3.83Å; R259-D411 PolarHBondContact NH2-OD2 3.01Å; E407-D411 VanDerWaalsContact O-CB 3.29Å; E407-D411 WeakPolarHBondContact O-CB 3.19Å; E407-D411 PolarHBondContact O-N 3.04Å; M408-D411 PolarHBondContact O-N 3.42Å; L409-D411 VanDerWaalsContact C-N 3.28Å; L409-D411 PolarHBondContact O-N 3.3Å; D411-A414 PolarHBondContact O-N 2.99Å; D411-L415 WeakPolarHBondContact O-CB 3.38Å; D411-L415 PolarHBondContact O-N 3.13Å
412	Y	92.9	Very high	92.9	Very high	3 Å²	3	24.6 Å²	24.6	1%	0.012	12%	0.119	C	C	.	.	H	α-helix	trans	-67.6	-37.4	169.1	-96.9	-75.6	0	0	0	113.4	M408 L409 A414 L415 I416 F494 R498 E501 F502	M408-Y412 HydrophobicContact CG-CD2 3.84Å; M408-Y412 HydrophobicContact CG-CE2 4.01Å; M408-Y412 WeakPolarHBondContact O-CD2 3.43Å; M408-Y412 PolarHBondContact O-N 3.23Å; M408-Y412 HydrophobicContact SD-CE2 4.25Å; L409-Y412 PolarHBondContact O-N 2.69Å; Y412-A414 VanDerWaalsContact C-N 3.31Å; Y412-A414 PolarHBondContact O-N 2.91Å; Y412-L415 HydrophobicContact CD1-CD2 4.25Å; Y412-L415 HydrophobicContact CE1-CD2 4.1Å; Y412-L415 PolarHBondContact O-N 3.01Å; Y412-I416 WeakPolarHBondContact O-CD1 3.43Å; Y412-I416 VanDerWaalsContact O-CG1 3.27Å; Y412-I416 WeakPolarHBondContact O-CG1 3.19Å; Y412-I416 PolarHBondContact O-N 3.2Å; Y412-F494 HydrophobicContact CD1-CE2 4.5Å; Y412-F494 HydrophobicContact CE1-CE2 4.4Å; Y412-R498 HydrophobicContact CD1-CG 4.25Å; Y412-R498 HydrophobicContact CE1-CB 3.85Å; Y412-R498 HydrophobicContact CE1-CG 3.75Å; Y412-R498 WeakPolarHBondContact OH-CA 3.15Å; Y412-E501 HydrophobicContact CE2-CB 4.26Å; Y412-E501 VanDerWaalsContact CE2-OE2 3.32Å; Y412-E501 WeakPolarHBondContact CE2-OE2 3.49Å; Y412-E501 VanDerWaalsContact CZ-OE2 3.25Å; Y412-E501 VanDerWaalsContact OH-CB 3.31Å; Y412-E501 WeakPolarHBondContact OH-CB 3.31Å; Y412-E501 PolarHBondContact OH-OE2 3.42Å; Y412-F502 AromaticContact CD1-CE2 3.67Å; Y412-F502 HydrophobicContact CD1-CE2 3.67Å; Y412-F502 HydrophobicContact CD1-CZ 4.48Å; Y412-F502 HydrophobicContact CD2-CD2 4.17Å; Y412-F502 AromaticContact CD2-CE2 3.42Å; Y412-F502 HydrophobicContact CD2-CE2 3.42Å; Y412-F502 VanDerWaalsContact CD2-CE2 3.42Å; Y412-F502 HydrophobicContact CD2-CZ 4.03Å; Y412-F502 HydrophobicContact CE1-CD2 4.31Å; Y412-F502 AromaticContact CE1-CE2 3.83Å; Y412-F502 HydrophobicContact CE1-CE2 3.83Å; Y412-F502 AromaticContact CE2-CD2 3.9Å; Y412-F502 HydrophobicContact CE2-CD2 3.9Å; Y412-F502 AromaticContact CE2-CE2 3.61Å; Y412-F502 HydrophobicContact CE2-CE2 3.61Å; Y412-F502 HydrophobicContact CG-CD2 4.49Å; Y412-F502 AromaticContact CG-CE2 3.46Å; Y412-F502 HydrophobicContact CG-CE2 3.46Å; Y412-F502 VanDerWaalsContact CG-CE2 3.46Å; Y412-F502 AromaticContact CG-CZ 3.98Å; Y412-F502 HydrophobicContact CG-CZ 3.98Å; Y412-F502 AromaticContact CZ-CD2 3.99Å; Y412-F502 AromaticContact CZ-CE2 3.81Å
413	V	94.3	Very high	93	Very high	6 Å²	6	24.6 Å²	24.6	4%	0.036	12%	0.119	C	C	.	.	H	α-helix	trans	-58.6	-45.8	171.6	170.1	0	0	0	0	110.1	M336 R337 L340 L409 K410 L415 I416 E417	M336-V413 HydrophobicContact CB-CG2 3.86Å; R337-V413 HydrophobicContact CG-CG1 3.99Å; R337-V413 HydrophobicContact CG-CG2 4.3Å; L340-V413 HydrophobicContact CD2-CG2 4.16Å; L409-V413 WeakPolarHBondContact O-CG2 3.12Å; L409-V413 PolarHBondContact O-N 3.21Å; K410-V413 PolarHBondContact O-N 2.73Å; V413-L415 VanDerWaalsContact C-N 3.33Å; V413-L415 PolarHBondContact O-N 3.42Å; V413-I416 PolarHBondContact O-N 2.54Å; V413-E417 PolarHBondContact O-N 3.32Å; V413-E417 VanDerWaalsContact O-N 3.1Å
414	A	94.3	Very high	93.2	Very high	27 Å²	27	22.9 Å²	22.9	22%	0.223	11%	0.112	C	C	.	.	H	α-helix	trans	-64.1	-36.2	175.6	0	0	0	0	0	112.8	P217 K410 D411 Y412 E417 V418	P217-A414 HydrophobicContact CB-CB 3.74Å; P217-A414 HydrophobicContact CG-CB 3.84Å; K410-A414 PolarHBondContact O-N 3.42Å; D411-A414 PolarHBondContact O-N 2.99Å; Y412-A414 VanDerWaalsContact C-N 3.31Å; Y412-A414 PolarHBondContact O-N 2.91Å; A414-E417 WeakPolarHBondContact O-CB 3.48Å; A414-E417 PolarHBondContact O-N 3.47Å; A414-V418 PolarHBondContact O-N 3.48Å
415	L	94.4	Very high	93.4	Very high	14 Å²	14	22.9 Å²	22.9	7%	0.073	11%	0.111	C	C	.	.	H	α-helix	trans	-67.2	-37.8	175.6	-173.7	61.4	0	0	0	111.9	I214 P217 D411 Y412 V413 E417 V418 V419 F494	I214-L415 HydrophobicContact CG2-CD1 3.68Å; P217-L415 HydrophobicContact CG-CB 4.42Å; D411-L415 WeakPolarHBondContact O-CB 3.38Å; D411-L415 PolarHBondContact O-N 3.13Å; Y412-L415 HydrophobicContact CD1-CD2 4.25Å; Y412-L415 HydrophobicContact CE1-CD2 4.1Å; Y412-L415 PolarHBondContact O-N 3.01Å; V413-L415 VanDerWaalsContact C-N 3.33Å; V413-L415 PolarHBondContact O-N 3.42Å; L415-E417 VanDerWaalsContact C-N 3.32Å; L415-V418 WeakPolarHBondContact O-CB 3.16Å; L415-V418 PolarHBondContact O-N 2.76Å; L415-V419 WeakPolarHBondContact O-CG2 3.47Å; L415-V419 PolarHBondContact O-N 3.27Å; L415-F494 HydrophobicContact CD2-CD2 3.83Å; L415-F494 HydrophobicContact CD2-CE2 3.65Å; L415-F494 HydrophobicContact CG-CD2 4.08Å; L415-F494 HydrophobicContact CG-CE2 3.78Å
416	I	95.2	Very high	93.6	Very high	1 Å²	1	22.5 Å²	22.5	1%	0.005	11%	0.108	C	C	.	.	H	α-helix	trans	-63.2	-38.6	174.4	-69.8	160.1	0	0	0	111	V329 L332 E333 M336 Y412 V413 V418 V419 K420 F494	V329-I416 HydrophobicContact CG1-CG2 4.05Å; L332-I416 HydrophobicContact CD2-CD1 3.73Å; L332-I416 HydrophobicContact CD2-CG1 3.95Å; L332-I416 HydrophobicContact CG-CD1 3.75Å; L332-I416 HydrophobicContact CG-CG1 4.46Å; E333-I416 HydrophobicContact CB-CG2 3.76Å; E333-I416 HydrophobicContact CG-CG2 4.08Å; M336-I416 HydrophobicContact CB-CD1 4.07Å; M336-I416 HydrophobicContact CG-CD1 3.71Å; Y412-I416 WeakPolarHBondContact O-CD1 3.43Å; Y412-I416 VanDerWaalsContact O-CG1 3.27Å; Y412-I416 WeakPolarHBondContact O-CG1 3.19Å; Y412-I416 PolarHBondContact O-N 3.2Å; V413-I416 PolarHBondContact O-N 2.54Å; I416-V418 VanDerWaalsContact C-N 3.31Å; I416-V418 PolarHBondContact O-N 2.52Å; I416-V419 WeakPolarHBondContact O-CB 3.39Å; I416-V419 PolarHBondContact O-N 2.75Å; I416-V419 VanDerWaalsContact O-N 3.13Å; I416-K420 PolarHBondContact O-N 3.35Å; I416-F494 HydrophobicContact CG1-CZ 4.04Å
417	E	94.8	Very high	93.7	Very high	82 Å²	82	22.4 Å²	22.4	38%	0.383	11%	0.111	S	C	.	.	H	α-helix	trans	-58.2	-43.4	172.8	-69	174.3	175.4	0	0	111.4	R337 V413 A414 L415 V419 K420 E421	R337-E417 IonicContact CZ-OE1 2.75Å; R337-E417 IonicContact NH1-OE1 3.22Å; R337-E417 IonicContact NH2-OE1 2.73Å; R337-E417 PolarHBondContact NH2-OE1 3.23Å; V413-E417 PolarHBondContact O-N 3.32Å; V413-E417 VanDerWaalsContact O-N 3.1Å; A414-E417 WeakPolarHBondContact O-CB 3.48Å; A414-E417 PolarHBondContact O-N 3.47Å; L415-E417 VanDerWaalsContact C-N 3.32Å; E417-V419 PolarHBondContact O-N 3.21Å; E417-K420 WeakPolarHBondContact O-CB 3.28Å; E417-K420 PolarHBondContact O-N 3.04Å; E417-E421 WeakPolarHBondContact O-CG 3.38Å; E417-E421 PolarHBondContact O-N 2.76Å
418	V	95.4	Very high	93.8	Very high	9 Å²	9	24 Å²	24	6%	0.055	12%	0.118	C	C	.	.	H	α-helix	trans	-63.9	-39.4	174.8	179.5	0	0	0	0	111.6	L209 I214 V215 A414 L415 I416 K420 E421 V422	L209-V418 HydrophobicContact CD1-CG1 4.3Å; I214-V418 HydrophobicContact CG2-CG1 4.24Å; V215-V418 WeakPolarHBondContact O-CG1 3.13Å; A414-V418 PolarHBondContact O-N 3.48Å; L415-V418 WeakPolarHBondContact O-CB 3.16Å; L415-V418 PolarHBondContact O-N 2.76Å; I416-V418 VanDerWaalsContact C-N 3.31Å; I416-V418 PolarHBondContact O-N 2.52Å; V418-K420 VanDerWaalsContact C-N 3.3Å; V418-K420 PolarHBondContact O-N 3.26Å; V418-E421 WeakPolarHBondContact O-CB 3.4Å; V418-E421 PolarHBondContact O-N 3.33Å; V418-V422 HydrophobicContact CG1-CG2 4.39Å; V418-V422 WeakPolarHBondContact O-CG2 3.48Å; V418-V422 PolarHBondContact O-N 3.4Å
419	V	96.3	Very high	94.1	Very high	1 Å²	1	23 Å²	23	1%	0.006	11%	0.114	C	C	.	.	H	α-helix	trans	-58.4	-44.6	174.9	176.7	0	0	0	0	110.3	I214 V329 L415 I416 E417 E421 V422 F423 Y491 F494	I214-V419 HydrophobicContact CD1-CG2 3.87Å; I214-V419 HydrophobicContact CG1-CG2 4.32Å; I214-V419 HydrophobicContact CG2-CG2 4.41Å; V329-V419 HydrophobicContact CG1-CG1 4.12Å; V329-V419 HydrophobicContact CG2-CG1 3.97Å; L415-V419 WeakPolarHBondContact O-CG2 3.47Å; L415-V419 PolarHBondContact O-N 3.27Å; I416-V419 WeakPolarHBondContact O-CB 3.39Å; I416-V419 PolarHBondContact O-N 2.75Å; I416-V419 VanDerWaalsContact O-N 3.13Å; E417-V419 PolarHBondContact O-N 3.21Å; V419-E421 VanDerWaalsContact C-N 3.33Å; V419-E421 PolarHBondContact O-N 3.28Å; V419-V422 WeakPolarHBondContact O-CB 3.3Å; V419-V422 PolarHBondContact O-N 3.47Å; V419-F423 HydrophobicContact CG1-CD2 4.01Å; V419-F423 HydrophobicContact CG1-CE2 3.85Å; V419-F423 VanDerWaalsContact O-CD2 3.29Å; V419-F423 WeakPolarHBondContact O-CD2 3.45Å; V419-F423 PolarHBondContact O-N 3.14Å; V419-Y491 HydrophobicContact CG1-CD2 4.36Å; V419-F494 HydrophobicContact CG2-CD1 4.19Å; V419-F494 HydrophobicContact CG2-CD2 4.09Å; V419-F494 HydrophobicContact CG2-CE1 4.21Å; V419-F494 HydrophobicContact CG2-CE2 4.11Å; V419-F494 HydrophobicContact CG2-CG 4.13Å; V419-F494 HydrophobicContact CG2-CZ 4.17Å
420	K	95	Very high	94.2	Very high	43 Å²	43	24 Å²	24	19%	0.187	12%	0.117	C	C	.	.	H	α-helix	trans	-61.4	-40	176.1	-69.5	176.8	53.6	162.2	0	112.6	V329 E330 E333 I416 E417 V418 V422 F423 F424	V329-K420 HydrophobicContact CG1-CD 4.25Å; V329-K420 HydrophobicContact CG1-CG 3.53Å; E330-K420 WeakPolarHBondContact OE1-CE 3.39Å; E330-K420 IonicContact OE1-NZ 3.54Å; E330-K420 PolarHBondContact OE1-NZ 2.95Å; E330-K420 IonicContact OE2-NZ 3.35Å; E330-K420 PolarHBondContact OE2-NZ 3.46Å; E333-K420 WeakPolarHBondContact OE2-CD 3.36Å; E333-K420 WeakPolarHBondContact OE2-CE 3.24Å; E333-K420 IonicContact OE2-NZ 2.74Å; E333-K420 PolarHBondContact OE2-NZ 3.46Å; I416-K420 PolarHBondContact O-N 3.35Å; E417-K420 WeakPolarHBondContact O-CB 3.28Å; E417-K420 PolarHBondContact O-N 3.04Å; V418-K420 VanDerWaalsContact C-N 3.3Å; V418-K420 PolarHBondContact O-N 3.26Å; K420-V422 VanDerWaalsContact C-N 3.35Å; K420-F423 PolarHBondContact O-N 2.99Å; K420-F424 PolarHBondContact O-N 3.43Å
421	E	94.4	Very high	94.1	Very high	51 Å²	51	22 Å²	22	24%	0.238	11%	0.11	C	C	.	.	H	α-helix	trans	-62.4	-42.3	174.5	-69.5	175.4	164.1	0	0	111.9	Y205 L209 E417 V418 V419 F423 F424 E425	Y205-E421 VanDerWaalsContact OH-CD 3.28Å; Y205-E421 PolarHBondContact OH-OE2 2.94Å; L209-E421 HydrophobicContact CD1-CB 4.36Å; E417-E421 WeakPolarHBondContact O-CG 3.38Å; E417-E421 PolarHBondContact O-N 2.76Å; V418-E421 WeakPolarHBondContact O-CB 3.4Å; V418-E421 PolarHBondContact O-N 3.33Å; V419-E421 VanDerWaalsContact C-N 3.33Å; V419-E421 PolarHBondContact O-N 3.28Å; E421-F423 VanDerWaalsContact C-N 3.33Å; E421-F423 PolarHBondContact O-N 3.28Å; E421-F424 CarbonylContact O-C 3.59Å; E421-F424 WeakPolarHBondContact O-CA 3.31Å; E421-F424 WeakPolarHBondContact O-CB 3.44Å; E421-F424 PolarHBondContact O-N 2.88Å; E421-E425 PolarHBondContact O-N 2.91Å
422	V	95.8	Very high	94.2	Very high	2 Å²	2	22.8 Å²	22.8	1%	0.012	12%	0.123	C	C	.	.	H	α-helix	trans	-61.1	-40.3	175.1	165.3	0	0	0	0	111.7	L209 R213 I214 V418 V419 K420 F424 E425 I487	L209-V422 HydrophobicContact CD1-CG2 3.67Å; R213-V422 WeakPolarHBondContact O-CG2 3.43Å; I214-V422 HydrophobicContact CG1-CG1 4.48Å; I214-V422 HydrophobicContact CG1-CG2 4.15Å; V418-V422 HydrophobicContact CG1-CG2 4.39Å; V418-V422 WeakPolarHBondContact O-CG2 3.48Å; V418-V422 PolarHBondContact O-N 3.4Å; V419-V422 WeakPolarHBondContact O-CB 3.3Å; V419-V422 PolarHBondContact O-N 3.47Å; K420-V422 VanDerWaalsContact C-N 3.35Å; V422-F424 VanDerWaalsContact C-N 3.31Å; V422-F424 PolarHBondContact O-N 3.33Å; V422-E425 WeakPolarHBondContact O-CB 3.31Å; V422-E425 PolarHBondContact O-N 2.84Å; V422-I487 HydrophobicContact CG1-CB 4.43Å; V422-I487 HydrophobicContact CG1-CD1 4.13Å; V422-I487 HydrophobicContact CG1-CG1 3.59Å; V422-I487 HydrophobicContact CG1-CG2 4.29Å; V422-I487 WeakPolarHBondContact O-CD1 3.34Å
423	F	94.3	Very high	94.3	Very high	11 Å²	11	24.4 Å²	24.4	5%	0.048	13%	0.129	C	C	.	.	H	α-helix	trans	-63.4	-38.2	171.7	-87.2	-112.2	0	0	0	111.8	W321 F322 R325 H326 V419 K420 E421 E425 R426 V427 I487 Y491	W321-F423 HydrophobicContact CZ3-CZ 4.29Å; F322-F423 HydrophobicContact CD1-CD1 4.1Å; F322-F423 AromaticContact CD1-CE1 3.87Å; F322-F423 HydrophobicContact CD1-CE1 3.87Å; R325-F423 HydrophobicContact CB-CE1 4Å; R325-F423 HydrophobicContact CB-CZ 3.84Å; H326-F423 HydrophobicContact CB-CD1 3.99Å; H326-F423 HydrophobicContact CB-CE1 4.14Å; V419-F423 HydrophobicContact CG1-CD2 4.01Å; V419-F423 HydrophobicContact CG1-CE2 3.85Å; V419-F423 VanDerWaalsContact O-CD2 3.29Å; V419-F423 WeakPolarHBondContact O-CD2 3.45Å; V419-F423 PolarHBondContact O-N 3.14Å; K420-F423 PolarHBondContact O-N 2.99Å; E421-F423 VanDerWaalsContact C-N 3.33Å; E421-F423 PolarHBondContact O-N 3.28Å; F423-E425 VanDerWaalsContact C-N 3.31Å; F423-E425 PolarHBondContact O-N 2.69Å; F423-R426 WeakPolarHBondContact O-CB 3.49Å; F423-R426 PolarHBondContact O-N 3.44Å; F423-V427 PolarHBondContact O-N 3Å; F423-I487 HydrophobicContact CD2-CG2 4.1Å; F423-I487 HydrophobicContact CE2-CG2 3.86Å; F423-I487 HydrophobicContact CZ-CG2 4.22Å; F423-Y491 HydrophobicContact CE2-CD2 4.14Å; F423-Y491 HydrophobicContact CZ-CD2 4.28Å
424	F	93.1	Very high	94.3	Very high	23 Å²	23	26.4 Å²	26.4	10%	0.101	14%	0.138	C	C	.	.	H	α-helix	trans	-66.6	-30.2	176.9	-171.6	-115.1	0	0	0	113	R309 K420 E421 V422 R426 V427 K428	R309-F424 HydrophobicContact CB-CE2 4.11Å; R309-F424 HydrophobicContact CB-CZ 4.02Å; R309-F424 HydrophobicContact CG-CD1 4.06Å; R309-F424 HydrophobicContact CG-CD2 3.93Å; R309-F424 HydrophobicContact CG-CE1 3.53Å; R309-F424 HydrophobicContact CG-CE2 3.44Å; R309-F424 VanDerWaalsContact CG-CE2 3.44Å; R309-F424 HydrophobicContact CG-CG 4.24Å; R309-F424 HydrophobicContact CG-CZ 3.22Å; K420-F424 PolarHBondContact O-N 3.43Å; E421-F424 CarbonylContact O-C 3.59Å; E421-F424 WeakPolarHBondContact O-CA 3.31Å; E421-F424 WeakPolarHBondContact O-CB 3.44Å; E421-F424 PolarHBondContact O-N 2.88Å; V422-F424 VanDerWaalsContact C-N 3.31Å; V422-F424 PolarHBondContact O-N 3.33Å; F424-R426 VanDerWaalsContact C-N 3.27Å; F424-R426 PolarHBondContact O-N 2.77Å; F424-V427 HydrophobicContact CD2-CB 4.18Å; F424-V427 HydrophobicContact CE2-CB 4.44Å; F424-V427 HydrophobicContact CE2-CG1 4.41Å; F424-V427 WeakPolarHBondContact O-CB 3.23Å; F424-V427 PolarHBondContact O-N 2.83Å; F424-V427 VanDerWaalsContact O-N 3.07Å; F424-K428 HydrophobicContact CD1-CD 4.32Å; F424-K428 HydrophobicContact CD1-CG 4.25Å; F424-K428 HydrophobicContact CE1-CD 4.18Å; F424-K428 HydrophobicContact CE1-CG 3.97Å; F424-K428 HydrophobicContact CZ-CG 4.33Å; F424-K428 PolarHBondContact O-N 2.92Å
425	E	94.4	Very high	94.3	Very high	19 Å²	19	29.3 Å²	29.3	9%	0.089	15%	0.149	C	C	.	.	H	α-helix	trans	-61.2	-34.2	172.3	-68.5	-57.3	129.6	0	0	112.5	L209 E421 V422 F423 V427 K428 A429	L209-E425 HydrophobicContact CD2-CG 4.27Å; L209-E425 HydrophobicContact CG-CG 4.08Å; E421-E425 PolarHBondContact O-N 2.91Å; V422-E425 WeakPolarHBondContact O-CB 3.31Å; V422-E425 PolarHBondContact O-N 2.84Å; F423-E425 VanDerWaalsContact C-N 3.31Å; F423-E425 PolarHBondContact O-N 2.69Å; E425-V427 VanDerWaalsContact C-N 3.34Å; E425-V427 PolarHBondContact O-N 3.43Å; E425-K428 PolarHBondContact O-N 3.35Å; E425-K428 WeakPolarHBondContact OE1-CD 3.48Å; E425-K428 WeakPolarHBondContact OE1-CE 3.44Å; E425-K428 IonicContact OE1-NZ 3.04Å; E425-K428 PolarHBondContact OE1-NZ 3.22Å; E425-K428 IonicContact OE2-NZ 3.89Å; E425-A429 WeakPolarHBondContact O-CB 3.4Å; E425-A429 PolarHBondContact O-N 3.46Å
426	R	94.1	Very high	94.4	Very high	10 Å²	10	29 Å²	29	4%	0.038	15%	0.149	C	C	.	.	H	α-helix	trans	-62.4	-42.7	171.5	-177.5	174.8	179.8	-98.4	2.3	111.9	M315 E317 D319 F322 F423 F424 K428 A429 W430 F480 V483 S484 I487	M315-R426 VanDerWaalsContact CE-CZ 3.48Å; E317-R426 IonicContact OE1-NH2 2.67Å; E317-R426 PolarHBondContact OE1-NH2 3.38Å; D319-R426 IonicContact OD2-NH2 3.41Å; D319-R426 PolarHBondContact OD2-NH2 3.22Å; F322-R426 VanDerWaalsContact CD1-CD 3.47Å; F322-R426 VanDerWaalsContact CE2-CZ 3.47Å; F322-R426 VanDerWaalsContact CZ-CD 3.41Å; F423-R426 WeakPolarHBondContact O-CB 3.49Å; F423-R426 PolarHBondContact O-N 3.44Å; F424-R426 VanDerWaalsContact C-N 3.27Å; F424-R426 PolarHBondContact O-N 2.77Å; R426-K428 VanDerWaalsContact C-N 3.33Å; R426-A429 PolarHBondContact O-N 2.92Å; R426-W430 WeakPolarHBondContact O-CB 3.4Å; R426-W430 PolarHBondContact O-N 3.02Å; R426-F480 HydrophobicContact CG-CD2 4.3Å; R426-F480 HydrophobicContact CG-CE2 3.67Å; R426-V483 HydrophobicContact CB-CG1 4.18Å; R426-S484 WeakPolarHBondContact CD-OG 3.1Å; R426-S484 PolarHBondContact NE-OG 3.46Å; R426-I487 HydrophobicContact CB-CD1 3.65Å
427	V	92.2	Very high	94.4	Very high	30 Å²	30	32 Å²	32	18%	0.182	17%	0.165	C	C	.	.	H	α-helix	trans	-63.7	-40.9	177.5	-176.2	0	0	0	0	110.2	I312 M315 F423 F424 E425 W430 N431	I312-V427 HydrophobicContact CG2-CG1 3.97Å; M315-V427 HydrophobicContact SD-CG2 4.33Å; F423-V427 PolarHBondContact O-N 3Å; F424-V427 HydrophobicContact CD2-CB 4.18Å; F424-V427 HydrophobicContact CE2-CB 4.44Å; F424-V427 HydrophobicContact CE2-CG1 4.41Å; F424-V427 WeakPolarHBondContact O-CB 3.23Å; F424-V427 PolarHBondContact O-N 2.83Å; F424-V427 VanDerWaalsContact O-N 3.07Å; E425-V427 VanDerWaalsContact C-N 3.34Å; E425-V427 PolarHBondContact O-N 3.43Å; V427-W430 PolarHBondContact O-N 3.02Å; V427-N431 PolarHBondContact O-N 3.01Å; V427-N431 PolarHBondContact O-ND2 3.2Å
428	K	93.6	Very high	94.5	Very high	55 Å²	55	33.2 Å²	33.2	24%	0.239	17%	0.17	C	C	.	.	H	α-helix	trans	-61.2	-47.6	172.9	-69.8	179.6	-177.4	171.9	0	111.8	E305 F424 E425 R426 W430 N431 G432	E305-K428 IonicContact OE1-NZ 3.76Å; E305-K428 PolarHBondContact OE1-NZ 2.9Å; F424-K428 HydrophobicContact CD1-CD 4.32Å; F424-K428 HydrophobicContact CD1-CG 4.25Å; F424-K428 HydrophobicContact CE1-CD 4.18Å; F424-K428 HydrophobicContact CE1-CG 3.97Å; F424-K428 HydrophobicContact CZ-CG 4.33Å; F424-K428 PolarHBondContact O-N 2.92Å; E425-K428 PolarHBondContact O-N 3.35Å; E425-K428 WeakPolarHBondContact OE1-CD 3.48Å; E425-K428 WeakPolarHBondContact OE1-CE 3.44Å; E425-K428 IonicContact OE1-NZ 3.04Å; E425-K428 PolarHBondContact OE1-NZ 3.22Å; E425-K428 IonicContact OE2-NZ 3.89Å; R426-K428 VanDerWaalsContact C-N 3.33Å; K428-W430 PolarHBondContact O-N 3.05Å; K428-N431 PolarHBondContact O-N 3.05Å; K428-G432 PolarHBondContact O-N 2.88Å
429	A	94	Very high	94.5	Very high	7 Å²	7	34.7 Å²	34.7	6%	0.058	18%	0.179	C	C	.	.	H	α-helix	trans	-60.8	-43.9	179.2	0	0	0	0	0	111.7	E425 R426 G432 W433 F480	E425-A429 WeakPolarHBondContact O-CB 3.4Å; E425-A429 PolarHBondContact O-N 3.46Å; R426-A429 PolarHBondContact O-N 2.92Å; A429-G432 PolarHBondContact O-N 3.43Å; A429-W433 PolarHBondContact O-N 3.28Å; A429-F480 HydrophobicContact CB-CB 4.35Å; A429-F480 HydrophobicContact CB-CD2 4.22Å
430	W	94	Very high	94.6	Very high	22 Å²	22	34.9 Å²	34.9	8%	0.083	18%	0.18	C	C	.	.	H	α-helix	trans	-60.4	-47.8	175.5	-176.5	84.9	0	0	0	112	K314 M315 D316 E317 R426 V427 K428 G432 W433 Q434 F480	K314-W430 WeakPolarHBondContact O-CH2 3.29Å; K314-W430 WeakPolarHBondContact O-CZ3 3.42Å; M315-W430 HydrophobicContact CB-CD2 4.44Å; M315-W430 HydrophobicContact CB-CE3 4.19Å; M315-W430 HydrophobicContact CB-CZ3 4.36Å; M315-W430 HydrophobicContact CE-CB 3.99Å; M315-W430 HydrophobicContact CE-CD2 4.39Å; M315-W430 HydrophobicContact CE-CG 3.74Å; M315-W430 HydrophobicContact CG-CD2 3.78Å; M315-W430 HydrophobicContact CG-CE3 4.04Å; M315-W430 HydrophobicContact CG-CG 4.07Å; M315-W430 HydrophobicContact CG-CZ2 4.42Å; M315-W430 HydrophobicContact CG-CZ3 4.49Å; M315-W430 HydrophobicContact SD-CB 4.2Å; M315-W430 HydrophobicContact SD-CD2 4.45Å; M315-W430 HydrophobicContact SD-CG 4.15Å; D316-W430 HydrophobicContact CB-CH2 4.22Å; D316-W430 HydrophobicContact CB-CZ2 4.2Å; E317-W430 PolarHBondContact OE2-NE1 2.82Å; E317-W430 VanDerWaalsContact OE2-NE1 3.14Å; R426-W430 WeakPolarHBondContact O-CB 3.4Å; R426-W430 PolarHBondContact O-N 3.02Å; V427-W430 PolarHBondContact O-N 3.02Å; K428-W430 PolarHBondContact O-N 3.05Å; W430-G432 VanDerWaalsContact C-N 3.3Å; W430-G432 PolarHBondContact O-N 2.82Å; W430-W433 WeakPolarHBondContact O-CB 3.44Å; W430-W433 PolarHBondContact O-N 3.5Å; W430-W433 VanDerWaalsContact O-N 3.15Å; W430-Q434 HydrophobicContact CD2-CG 3.78Å; W430-Q434 HydrophobicContact CE3-CG 3.86Å; W430-Q434 HydrophobicContact CH2-CG 3.69Å; W430-Q434 HydrophobicContact CZ2-CG 3.6Å; W430-Q434 HydrophobicContact CZ3-CG 3.8Å; W430-Q434 WeakPolarHBondContact O-CG 3.22Å; W430-Q434 PolarHBondContact O-N 3.26Å; W430-F480 HydrophobicContact CB-CD2 3.8Å; W430-F480 HydrophobicContact CB-CE2 3.66Å; W430-F480 HydrophobicContact CB-CZ 4.49Å; W430-F480 AromaticContact CD1-CE2 3.93Å; W430-F480 AromaticContact CD1-CZ 3.93Å; W430-F480 HydrophobicContact CG-CE2 4.21Å
431	N	92	Very high	94.6	Very high	27 Å²	27	35.8 Å²	35.8	14%	0.144	19%	0.19	C	C	.	.	H	α-helix	trans	-64.2	-36.8	177.7	-82.6	-86.6	0	0	0	112	I312 V427 K428 W433 Q434 N435	I312-N431 HydrophobicContact CG2-CB 3.89Å; I312-N431 WeakPolarHBondContact CG2-ND2 3Å; I312-N431 PolarHBondContact O-ND2 3.16Å; V427-N431 PolarHBondContact O-N 3.01Å; V427-N431 PolarHBondContact O-ND2 3.2Å; K428-N431 PolarHBondContact O-N 3.05Å; N431-W433 VanDerWaalsContact C-N 3.33Å; N431-Q434 PolarHBondContact O-N 3.35Å; N431-N435 VanDerWaalsContact O-CB 3.31Å; N431-N435 WeakPolarHBondContact O-CB 3.42Å; N431-N435 PolarHBondContact O-N 2.94Å; N431-N435 PolarHBondContact O-ND2 3.2Å
432	G	93.4	Very high	94.8	Very high	35 Å²	35	39.2 Å²	39.2	36%	0.361	20%	0.204	S	C	.	.	H	α-helix	trans	-57.8	-45.9	171.7	0	0	0	0	0	112.1	K428 A429 W430 N435 A436	K428-G432 PolarHBondContact O-N 2.88Å; A429-G432 PolarHBondContact O-N 3.43Å; W430-G432 VanDerWaalsContact C-N 3.3Å; W430-G432 PolarHBondContact O-N 2.82Å; G432-N435 PolarHBondContact O-N 3.41Å; G432-A436 PolarHBondContact O-N 3.38Å
433	W	95.5	Very high	94.8	Very high	38 Å²	38	41.8 Å²	41.8	14%	0.144	22%	0.215	C	C	.	.	H	α-helix	trans	-63.9	-47.8	175.5	176.6	34.6	0	0	0	112.6	A429 W430 N431 N435 A436 L437 A476 E477 F480	A429-W433 PolarHBondContact O-N 3.28Å; W430-W433 WeakPolarHBondContact O-CB 3.44Å; W430-W433 PolarHBondContact O-N 3.5Å; W430-W433 VanDerWaalsContact O-N 3.15Å; N431-W433 VanDerWaalsContact C-N 3.33Å; W433-N435 VanDerWaalsContact C-N 3.32Å; W433-N435 PolarHBondContact O-N 3.01Å; W433-A436 WeakPolarHBondContact O-CB 3.35Å; W433-A436 PolarHBondContact O-N 3.38Å; W433-A436 VanDerWaalsContact O-N 3.13Å; W433-L437 PolarHBondContact O-N 3.13Å; W433-A476 HydrophobicContact CB-CB 4.04Å; W433-E477 HydrophobicContact CD2-CB 4.25Å; W433-E477 HydrophobicContact CD2-CG 4.43Å; W433-E477 HydrophobicContact CG-CB 4.37Å; W433-E477 HydrophobicContact CH2-CG 4.13Å; W433-E477 HydrophobicContact CZ2-CB 4.1Å; W433-E477 HydrophobicContact CZ2-CG 3.57Å; W433-F480 HydrophobicContact CE3-CB 4.4Å; W433-F480 AromaticContact CE3-CD1 3.81Å; W433-F480 HydrophobicContact CE3-CD1 3.81Å; W433-F480 HydrophobicContact CE3-CE1 4.36Å; W433-F480 HydrophobicContact CE3-CG 4.13Å; W433-F480 AromaticContact CZ3-CD1 3.75Å; W433-F480 HydrophobicContact CZ3-CD1 3.75Å; W433-F480 HydrophobicContact CZ3-CE1 4Å
434	Q	94.5	Very high	94.9	Very high	48 Å²	48	46.8 Å²	46.8	22%	0.224	23%	0.233	C	C	.	.	H	α-helix	trans	-59.9	-41.2	177	-67.9	-54.9	-49.5	0	0	112.4	W430 N431 A436 L437 Q438	W430-Q434 HydrophobicContact CD2-CG 3.78Å; W430-Q434 HydrophobicContact CE3-CG 3.86Å; W430-Q434 HydrophobicContact CH2-CG 3.69Å; W430-Q434 HydrophobicContact CZ2-CG 3.6Å; W430-Q434 HydrophobicContact CZ3-CG 3.8Å; W430-Q434 WeakPolarHBondContact O-CG 3.22Å; W430-Q434 PolarHBondContact O-N 3.26Å; N431-Q434 PolarHBondContact O-N 3.35Å; Q434-A436 VanDerWaalsContact C-N 3.35Å; Q434-A436 PolarHBondContact O-N 3.29Å; Q434-L437 PolarHBondContact O-N 3.24Å; Q434-Q438 WeakPolarHBondContact O-CB 3.5Å; Q434-Q438 WeakPolarHBondContact O-CG 3.42Å; Q434-Q438 PolarHBondContact O-N 3.31Å
435	N	94.4	Very high	95.1	Very high	87 Å²	87	50.9 Å²	50.9	47%	0.465	25%	0.253	S	S	.	.	H	α-helix	trans	-64.1	-39.5	176	-73.6	-32.3	0	0	0	112.1	N431 G432 W433 T439	N431-N435 VanDerWaalsContact O-CB 3.31Å; N431-N435 WeakPolarHBondContact O-CB 3.42Å; N431-N435 PolarHBondContact O-N 2.94Å; N431-N435 PolarHBondContact O-ND2 3.2Å; G432-N435 PolarHBondContact O-N 3.41Å; W433-N435 VanDerWaalsContact C-N 3.32Å; W433-N435 PolarHBondContact O-N 3.01Å; N435-T439 WeakPolarHBondContact O-CB 3.34Å; N435-T439 PolarHBondContact O-N 2.98Å; N435-T439 PolarHBondContact O-OG1 3.37Å
436	A	95.8	Very high	95.1	Very high	8 Å²	8	52 Å²	52	7%	0.066	26%	0.261	C	S	.	.	H	α-helix	trans	-63.1	-44.9	174.4	0	0	0	0	0	111.1	G432 W433 Q434 T439 L440 W469 A476	G432-A436 PolarHBondContact O-N 3.38Å; W433-A436 WeakPolarHBondContact O-CB 3.35Å; W433-A436 PolarHBondContact O-N 3.38Å; W433-A436 VanDerWaalsContact O-N 3.13Å; Q434-A436 VanDerWaalsContact C-N 3.35Å; Q434-A436 PolarHBondContact O-N 3.29Å; A436-T439 PolarHBondContact O-N 3.31Å; A436-L440 WeakPolarHBondContact O-CB 3.37Å; A436-L440 PolarHBondContact O-N 3.04Å; A436-W469 HydrophobicContact CB-CZ3 4.44Å; A436-A476 HydrophobicContact CB-CB 4.36Å
437	L	95.9	Very high	95.2	Very high	65 Å²	65	54.1 Å²	54.1	34%	0.34	27%	0.27	S	S	.	.	H	α-helix	trans	-64.9	-42.6	178.8	-171.6	63.2	0	0	0	112.8	W433 Q434 T439 L440 T441	W433-L437 PolarHBondContact O-N 3.13Å; Q434-L437 PolarHBondContact O-N 3.24Å; L437-T439 VanDerWaalsContact C-N 3.32Å; L437-T439 PolarHBondContact O-N 3.07Å; L437-L440 HydrophobicContact CD1-CD2 4.49Å; L437-L440 PolarHBondContact O-N 2.83Å; L437-T441 PolarHBondContact O-N 3.48Å; L437-T441 PolarHBondContact O-OG1 2.78Å; L437-T441 VanDerWaalsContact O-OG1 3.09Å
438	Q	95.6	Very high	95.3	Very high	106 Å²	106	55.2 Å²	55.2	50%	0.495	28%	0.279	S	S	.	.	H	α-helix	trans	-63.1	-39.7	174.2	-73.5	179.9	15.3	0	0	111.9	Q434 T441 K442	Q434-Q438 WeakPolarHBondContact O-CB 3.5Å; Q434-Q438 WeakPolarHBondContact O-CG 3.42Å; Q434-Q438 PolarHBondContact O-N 3.31Å; Q438-T441 PolarHBondContact O-N 2.93Å; Q438-K442 WeakPolarHBondContact O-CG 3.42Å; Q438-K442 PolarHBondContact O-N 3.43Å
439	T	96.7	Very high	95.4	Very high	40 Å²	40	60.5 Å²	60.5	25%	0.245	30%	0.298	C	S	.	.	H	α-helix	trans	-68.2	-42.7	178.3	-56.4	0	0	0	0	110.9	N435 A436 L437 T441 K442 K443 W469	N435-T439 WeakPolarHBondContact O-CB 3.34Å; N435-T439 PolarHBondContact O-N 2.98Å; N435-T439 PolarHBondContact O-OG1 3.37Å; A436-T439 PolarHBondContact O-N 3.31Å; L437-T439 VanDerWaalsContact C-N 3.32Å; L437-T439 PolarHBondContact O-N 3.07Å; T439-T441 VanDerWaalsContact C-N 3.34Å; T439-T441 PolarHBondContact O-N 3.19Å; T439-K442 PolarHBondContact O-N 2.73Å; T439-K443 WeakPolarHBondContact O-CG 3.4Å; T439-K443 PolarHBondContact O-N 2.91Å; T439-W469 HydrophobicContact CG2-CD2 3.61Å; T439-W469 VanDerWaalsContact CG2-CE2 3.46Å; T439-W469 HydrophobicContact CG2-CE3 3.82Å; T439-W469 HydrophobicContact CG2-CG 4.29Å; T439-W469 HydrophobicContact CG2-CH2 3.76Å; T439-W469 HydrophobicContact CG2-CZ2 3.55Å; T439-W469 HydrophobicContact CG2-CZ3 3.89Å
440	L	97.1	Very high	95.5	Very high	5 Å²	5	62.6 Å²	62.6	3%	0.026	31%	0.305	C	S	.	.	H	α-helix	trans	-56.3	-46	173.2	172.7	56.4	0	0	0	111.9	A436 L437 K442 K443 R444 V466 W469 E470	A436-L440 WeakPolarHBondContact O-CB 3.37Å; A436-L440 PolarHBondContact O-N 3.04Å; L437-L440 HydrophobicContact CD1-CD2 4.49Å; L437-L440 PolarHBondContact O-N 2.83Å; L440-K442 PolarHBondContact O-N 2.68Å; L440-K443 PolarHBondContact O-N 2.98Å; L440-K443 VanDerWaalsContact O-N 3.12Å; L440-R444 HydrophobicContact CD1-CG 4.13Å; L440-R444 WeakPolarHBondContact O-CG 3.12Å; L440-R444 PolarHBondContact O-N 3.49Å; L440-V466 HydrophobicContact CD1-CG1 4.14Å; L440-W469 HydrophobicContact CB-CB 4.2Å; L440-W469 HydrophobicContact CD1-CB 4.09Å; L440-E470 HydrophobicContact CD1-CB 4.46Å; L440-E470 HydrophobicContact CD1-CG 3.47Å; L440-E470 VanDerWaalsContact CD1-CG 3.47Å; L440-E470 HydrophobicContact CD2-CG 3.87Å; L440-E470 HydrophobicContact CG-CG 4.31Å
441	T	97	Very high	95.5	Very high	62 Å²	62	66 Å²	66	38%	0.38	32%	0.322	S	S	.	.	H	α-helix	trans	-56.2	-47.7	175.6	-61.9	0	0	0	0	111.6	L437 Q438 T439 K443 R444 E445	L437-T441 PolarHBondContact O-N 3.48Å; L437-T441 PolarHBondContact O-OG1 2.78Å; L437-T441 VanDerWaalsContact O-OG1 3.09Å; Q438-T441 PolarHBondContact O-N 2.93Å; T439-T441 VanDerWaalsContact C-N 3.34Å; T439-T441 PolarHBondContact O-N 3.19Å; T441-K443 VanDerWaalsContact C-N 3.3Å; T441-K443 PolarHBondContact O-N 3.44Å; T441-R444 PolarHBondContact O-N 3Å; T441-E445 WeakPolarHBondContact O-CG 3.31Å; T441-E445 PolarHBondContact O-N 3.19Å
442	K	97.2	Very high	95.6	Very high	124 Å²	124	71.9 Å²	71.9	54%	0.539	35%	0.352	S	S	.	.	H	α-helix	trans	-61.2	-35.9	176.6	-68.6	171.4	-176.3	169.9	0	112.8	Q438 T439 L440 T446	Q438-K442 WeakPolarHBondContact O-CG 3.42Å; Q438-K442 PolarHBondContact O-N 3.43Å; T439-K442 PolarHBondContact O-N 2.73Å; L440-K442 PolarHBondContact O-N 2.68Å; K442-T446 WeakPolarHBondContact O-CB 3.4Å; K442-T446 PolarHBondContact O-N 2.88Å; K442-T446 PolarHBondContact O-OG1 2.77Å
443	K	97	Very high	95.7	Very high	56 Å²	56	73.1 Å²	73.1	24%	0.243	36%	0.359	C	S	.	.	H	α-helix	trans	-68.6	-42.5	175.9	-65.7	-56.6	-172.8	171.3	0	111.8	T439 L440 T441 T446 K447 E465 V466 W469	T439-K443 WeakPolarHBondContact O-CG 3.4Å; T439-K443 PolarHBondContact O-N 2.91Å; L440-K443 PolarHBondContact O-N 2.98Å; L440-K443 VanDerWaalsContact O-N 3.12Å; T441-K443 VanDerWaalsContact C-N 3.3Å; T441-K443 PolarHBondContact O-N 3.44Å; K443-T446 WeakPolarHBondContact O-CB 3.48Å; K443-T446 PolarHBondContact O-N 3.25Å; K443-K447 PolarHBondContact O-N 3.35Å; K443-E465 HydrophobicContact CD-CB 4.27Å; K443-E465 WeakPolarHBondContact CE-OE2 3.06Å; K443-E465 IonicContact NZ-OE2 2.71Å; K443-E465 PolarHBondContact NZ-OE2 2.96Å; K443-V466 HydrophobicContact CB-CG2 3.89Å; K443-W469 HydrophobicContact CG-CG 4.22Å
444	R	96.5	Very high	95.6	Very high	116 Å²	116	73.9 Å²	73.9	44%	0.438	38%	0.378	S	S	.	.	H	α-helix	trans	-61.4	-43.1	174.3	-71.9	175.6	171.9	169.1	-1.8	111.9	L440 T441 T446 K447 S448 V466 E470	L440-R444 HydrophobicContact CD1-CG 4.13Å; L440-R444 WeakPolarHBondContact O-CG 3.12Å; L440-R444 PolarHBondContact O-N 3.49Å; T441-R444 PolarHBondContact O-N 3Å; R444-T446 VanDerWaalsContact C-N 3.35Å; R444-T446 PolarHBondContact O-N 3.42Å; R444-K447 WeakPolarHBondContact O-CB 3.44Å; R444-K447 PolarHBondContact O-N 3.48Å; R444-S448 PolarHBondContact O-N 3.29Å; R444-V466 HydrophobicContact CG-CG1 3.88Å; R444-V466 HydrophobicContact CG-CG2 4.07Å; R444-E470 IonicContact CZ-OE1 3.38Å; R444-E470 IonicContact NE-OE1 2.75Å; R444-E470 PolarHBondContact NE-OE1 2.87Å; R444-E470 IonicContact NH2-OE1 3.34Å; R444-E470 PolarHBondContact NH2-OE1 3.49Å
445	E	96.5	Very high	95.4	Very high	108 Å²	108	75.8 Å²	75.8	51%	0.505	39%	0.386	S	S	.	.	H	α-helix	trans	-62.2	-40.2	173.6	-72	174.2	-176	0	0	112.6	T441 S448 R449	T441-E445 WeakPolarHBondContact O-CG 3.31Å; T441-E445 PolarHBondContact O-N 3.19Å; E445-S448 PolarHBondContact O-N 2.96Å; E445-R449 WeakPolarHBondContact O-CB 3.3Å; E445-R449 PolarHBondContact O-N 3.4Å
446	T	95.1	Very high	95.3	Very high	43 Å²	43	76.9 Å²	76.9	26%	0.264	40%	0.396	S	S	.	.	H	α-helix	trans	-64.2	-43.1	177.4	-60.3	0	0	0	0	111.3	K442 K443 R444 R449 Y450	K442-T446 WeakPolarHBondContact O-CB 3.4Å; K442-T446 PolarHBondContact O-N 2.88Å; K442-T446 PolarHBondContact O-OG1 2.77Å; K443-T446 WeakPolarHBondContact O-CB 3.48Å; K443-T446 PolarHBondContact O-N 3.25Å; R444-T446 VanDerWaalsContact C-N 3.35Å; R444-T446 PolarHBondContact O-N 3.42Å; T446-R449 PolarHBondContact O-N 2.97Å; T446-Y450 HydrophobicContact CG2-CD2 4.25Å; T446-Y450 HydrophobicContact CG2-CE2 3.66Å; T446-Y450 WeakPolarHBondContact O-CD2 3.17Å; T446-Y450 PolarHBondContact O-N 2.79Å; T446-Y450 VanDerWaalsContact O-N 3.15Å
447	K	95.1	Very high	95.2	Very high	54 Å²	54	82.2 Å²	82.2	24%	0.235	42%	0.423	C	S	.	.	H	α-helix	trans	-57.8	-51.7	172.3	177.1	-168.3	161.3	-172.3	0	111	K443 R444 R449 Y450 E451 A462 L463 V466	K443-K447 PolarHBondContact O-N 3.35Å; R444-K447 WeakPolarHBondContact O-CB 3.44Å; R444-K447 PolarHBondContact O-N 3.48Å; K447-R449 VanDerWaalsContact C-N 3.27Å; K447-R449 PolarHBondContact O-N 3.15Å; K447-Y450 PolarHBondContact O-N 2.74Å; K447-E451 WeakPolarHBondContact CE-OE1 3.38Å; K447-E451 IonicContact NZ-OE1 3.91Å; K447-E451 PolarHBondContact O-N 3.3Å; K447-A462 HydrophobicContact CB-CB 3.93Å; K447-A462 HydrophobicContact CG-CB 4.35Å; K447-L463 HydrophobicContact CD-CD2 3.73Å; K447-L463 HydrophobicContact CD-CG 4.19Å; K447-V466 HydrophobicContact CB-CG2 4.3Å; K447-V466 HydrophobicContact CD-CG2 4.4Å
448	S	95.1	Very high	95.1	Very high	53 Å²	53	84 Å²	84	37%	0.371	43%	0.426	S	S	.	.	H	α-helix	trans	-58.5	-38.4	178.9	-178.9	0	0	0	0	112.3	R444 E445 Y450 E451 L452	R444-S448 PolarHBondContact O-N 3.29Å; E445-S448 PolarHBondContact O-N 2.96Å; S448-Y450 VanDerWaalsContact C-N 3.34Å; S448-Y450 PolarHBondContact O-N 3.26Å; S448-E451 PolarHBondContact O-N 2.91Å; S448-L452 WeakPolarHBondContact O-CG 3.42Å; S448-L452 PolarHBondContact O-N 3.03Å
449	R	95.7	Very high	95	Very high	166 Å²	166	80.7 Å²	80.7	63%	0.626	41%	0.411	S	S	*	.	H	α-helix	trans	-62.7	-37.6	175.2	-168.8	-177.1	-58.6	179.2	3.3	112.7	E445 T446 K447 A453	E445-R449 WeakPolarHBondContact O-CB 3.3Å; E445-R449 PolarHBondContact O-N 3.4Å; T446-R449 PolarHBondContact O-N 2.97Å; K447-R449 VanDerWaalsContact C-N 3.27Å; K447-R449 PolarHBondContact O-N 3.15Å; R449-A453 WeakPolarHBondContact O-CB 3.49Å; R449-A453 PolarHBondContact O-N 2.86Å
450	Y	95.6	Very high	94.9	Very high	52 Å²	52	82.7 Å²	82.7	20%	0.204	42%	0.424	C	S	.	.	H	α-helix	trans	-71.3	-36.6	176	-66.9	-36.9	0	0	0	112.7	T446 K447 S448 A453 G454 K455 R458 A462	T446-Y450 HydrophobicContact CG2-CD2 4.25Å; T446-Y450 HydrophobicContact CG2-CE2 3.66Å; T446-Y450 WeakPolarHBondContact O-CD2 3.17Å; T446-Y450 PolarHBondContact O-N 2.79Å; T446-Y450 VanDerWaalsContact O-N 3.15Å; K447-Y450 PolarHBondContact O-N 2.74Å; S448-Y450 VanDerWaalsContact C-N 3.34Å; S448-Y450 PolarHBondContact O-N 3.26Å; Y450-A453 PolarHBondContact O-N 3.44Å; Y450-G454 PolarHBondContact O-N 3.42Å; Y450-G454 VanDerWaalsContact O-N 3.15Å; Y450-K455 HydrophobicContact CD1-CB 4.21Å; Y450-K455 HydrophobicContact CD1-CD 3.96Å; Y450-K455 HydrophobicContact CE1-CD 4.27Å; Y450-K455 PolarHBondContact O-N 2.93Å; Y450-R458 HydrophobicContact CD1-CB 4.21Å; Y450-R458 HydrophobicContact CD2-CB 3.74Å; Y450-R458 HydrophobicContact CE1-CB 4.31Å; Y450-R458 VanDerWaalsContact CE1-CD 3.48Å; Y450-R458 HydrophobicContact CE2-CB 3.86Å; Y450-R458 HydrophobicContact CG-CB 3.92Å; Y450-R458 PolarHBondContact OH-NH1 2.65Å; Y450-A462 HydrophobicContact CD2-CB 3.81Å; Y450-A462 HydrophobicContact CE2-CB 4.14Å
451	E	93.8	Very high	94.8	Very high	93 Å²	93	88.3 Å²	88.3	44%	0.435	45%	0.451	S	S	.	.	H	α-helix	trans	-61.1	-50	173	-70	170.6	169.3	0	0	111	K447 S448 A453 G454 I459	K447-E451 WeakPolarHBondContact CE-OE1 3.38Å; K447-E451 IonicContact NZ-OE1 3.91Å; K447-E451 PolarHBondContact O-N 3.3Å; S448-E451 PolarHBondContact O-N 2.91Å; E451-A453 VanDerWaalsContact C-N 3.32Å; E451-A453 PolarHBondContact O-N 3.09Å; E451-G454 PolarHBondContact O-N 2.9Å; E451-I459 HydrophobicContact CG-CD1 3.9Å; E451-I459 HydrophobicContact CG-CG1 4.27Å
452	L	94.7	Very high	94.7	Very high	151 Å²	151	85.6 Å²	85.6	79%	0.791	43%	0.434	S	S	*	.	H	α-helix	trans	-65.6	-32.1	178.4	-69.4	172.8	0	0	0	113.3	S448 G454	S448-L452 WeakPolarHBondContact O-CG 3.42Å; S448-L452 PolarHBondContact O-N 3.03Å; L452-G454 VanDerWaalsContact C-N 3.32Å
453	A	95.5	Very high	94.7	Very high	61 Å²	61	83.2 Å²	83.2	50%	0.504	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-1.6	178.3	0	0	0	0	0	113.9	R449 Y450 E451 K455	R449-A453 WeakPolarHBondContact O-CB 3.49Å; R449-A453 PolarHBondContact O-N 2.86Å; Y450-A453 PolarHBondContact O-N 3.44Å; E451-A453 VanDerWaalsContact C-N 3.32Å; E451-A453 PolarHBondContact O-N 3.09Å; A453-K455 HydrophobicContact CB-CD 4.47Å; A453-K455 HydrophobicContact CB-CG 4.15Å; A453-K455 PolarHBondContact O-N 2.94Å
454	G	92.2	Very high	94.7	Very high	53 Å²	53	86.6 Å²	86.6	55%	0.546	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.1	20.8	-177.6	0	0	0	0	0	114.6	Y450 E451 L452 T456	Y450-G454 PolarHBondContact O-N 3.42Å; Y450-G454 VanDerWaalsContact O-N 3.15Å; E451-G454 PolarHBondContact O-N 2.9Å; L452-G454 VanDerWaalsContact C-N 3.32Å; G454-T456 VanDerWaalsContact C-N 3.26Å; G454-T456 PolarHBondContact O-N 3.48Å
455	K	91.9	Very high	94.6	Very high	89 Å²	89	83.3 Å²	83.3	39%	0.387	43%	0.431	S	S	.	.			trans	-83.3	66.8	-179.7	-66.6	-173.3	-178.4	177.4	0	111	Y450 A453 D457 R458 I459	Y450-K455 HydrophobicContact CD1-CB 4.21Å; Y450-K455 HydrophobicContact CD1-CD 3.96Å; Y450-K455 HydrophobicContact CE1-CD 4.27Å; Y450-K455 PolarHBondContact O-N 2.93Å; A453-K455 HydrophobicContact CB-CD 4.47Å; A453-K455 HydrophobicContact CB-CG 4.15Å; A453-K455 PolarHBondContact O-N 2.94Å; K455-D457 VanDerWaalsContact C-OD1 3.3Å; K455-D457 PolarHBondContact O-N 3.25Å; K455-R458 HydrophobicContact CB-CB 4.45Å; K455-R458 HydrophobicContact CB-CG 4.41Å; K455-R458 PolarHBondContact O-N 2.96Å; K455-I459 PolarHBondContact O-N 2.92Å
456	T	91.4	Very high	94.7	Very high	109 Å²	109	78.5 Å²	78.5	67%	0.669	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-26.1	-173.2	54.6	0	0	0	0	113.8	G454 R458 I459 P460	G454-T456 VanDerWaalsContact C-N 3.26Å; G454-T456 PolarHBondContact O-N 3.48Å; T456-R458 VanDerWaalsContact C-N 3.29Å; T456-R458 PolarHBondContact O-N 3.33Å; T456-I459 HydrophobicContact CG2-CD1 4.47Å; T456-P460 VanDerWaalsContact O-CD 3.3Å; T456-P460 WeakPolarHBondContact O-CD 3.4Å
457	D	93.7	Very high	94.8	Very high	120 Å²	120	83 Å²	83	64%	0.642	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-29.5	174.2	63.5	-50.3	0	0	0	113.2	K455	K455-D457 VanDerWaalsContact C-OD1 3.3Å; K455-D457 PolarHBondContact O-N 3.25Å
458	R	93.9	Very high	94.9	Very high	104 Å²	104	84.4 Å²	84.4	39%	0.392	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-18.4	-176.7	-59.3	-169.7	179.9	-159.5	-4.4	114.4	Y450 K455 T456 Q461 A462	Y450-R458 HydrophobicContact CD1-CB 4.21Å; Y450-R458 HydrophobicContact CD2-CB 3.74Å; Y450-R458 HydrophobicContact CE1-CB 4.31Å; Y450-R458 VanDerWaalsContact CE1-CD 3.48Å; Y450-R458 HydrophobicContact CE2-CB 3.86Å; Y450-R458 HydrophobicContact CG-CB 3.92Å; Y450-R458 PolarHBondContact OH-NH1 2.65Å; K455-R458 HydrophobicContact CB-CB 4.45Å; K455-R458 HydrophobicContact CB-CG 4.41Å; K455-R458 PolarHBondContact O-N 2.96Å; T456-R458 VanDerWaalsContact C-N 3.29Å; T456-R458 PolarHBondContact O-N 3.33Å; R458-Q461 PolarHBondContact O-N 3.11Å; R458-A462 PolarHBondContact O-N 3.35Å
459	I	93.5	Very high	95	Very high	35 Å²	35	85 Å²	85	18%	0.179	43%	0.429	C	S	.	.	H	α-helix	trans	-58.7	-44.7	-177.9	-64.3	173.3	0	0	0	111.9	E451 K455 T456 Q461 A462 L463	E451-I459 HydrophobicContact CG-CD1 3.9Å; E451-I459 HydrophobicContact CG-CG1 4.27Å; K455-I459 PolarHBondContact O-N 2.92Å; T456-I459 HydrophobicContact CG2-CD1 4.47Å; I459-Q461 VanDerWaalsContact C-N 3.33Å; I459-Q461 PolarHBondContact O-N 2.96Å; I459-A462 PolarHBondContact O-N 3.32Å; I459-L463 HydrophobicContact CG2-CD1 3.86Å; I459-L463 HydrophobicContact CG2-CG 4.25Å; I459-L463 WeakPolarHBondContact O-CB 3.39Å; I459-L463 WeakPolarHBondContact O-CG 3.34Å; I459-L463 PolarHBondContact O-N 2.96Å
460	P	95.2	Very high	95.1	Very high	82 Å²	82	80.1 Å²	80.1	53%	0.532	41%	0.413	S	S	.	.	H	α-helix	trans	-60.4	-39.1	178.9	-24.9	35	0	0	0	113.5	T456 K464	T456-P460 VanDerWaalsContact O-CD 3.3Å; T456-P460 WeakPolarHBondContact O-CD 3.4Å; P460-K464 PolarHBondContact O-N 3.13Å; P460-K464 VanDerWaalsContact O-N 3.13Å
461	Q	94.4	Very high	95.2	Very high	124 Å²	124	82.7 Å²	82.7	58%	0.579	43%	0.427	S	S	*	.	H	α-helix	trans	-66.9	-45.9	175.9	-178.1	-176.8	-8.2	0	0	111.1	R458 I459 L463 K464 E465	R458-Q461 PolarHBondContact O-N 3.11Å; I459-Q461 VanDerWaalsContact C-N 3.33Å; I459-Q461 PolarHBondContact O-N 2.96Å; Q461-L463 VanDerWaalsContact C-N 3.3Å; Q461-L463 PolarHBondContact O-N 2.89Å; Q461-K464 PolarHBondContact O-N 3.04Å; Q461-E465 PolarHBondContact NE2-OE1 2.91Å; Q461-E465 VanDerWaalsContact NE2-OE1 3.07Å; Q461-E465 WeakPolarHBondContact O-CG 3.37Å; Q461-E465 PolarHBondContact O-N 3.19Å
462	A	95.2	Very high	95.3	Very high	4 Å²	4	83 Å²	83	3%	0.033	43%	0.427	C	S	.	.	H	α-helix	trans	-64.6	-35.3	179.3	0	0	0	0	0	112.4	K447 Y450 R458 I459 E465 V466	K447-A462 HydrophobicContact CB-CB 3.93Å; K447-A462 HydrophobicContact CG-CB 4.35Å; Y450-A462 HydrophobicContact CD2-CB 3.81Å; Y450-A462 HydrophobicContact CE2-CB 4.14Å; R458-A462 PolarHBondContact O-N 3.35Å; I459-A462 PolarHBondContact O-N 3.32Å; A462-E465 PolarHBondContact O-N 2.66Å; A462-V466 VanDerWaalsContact O-CG2 3.28Å; A462-V466 WeakPolarHBondContact O-CG2 3.49Å; A462-V466 PolarHBondContact O-N 3.07Å
463	L	96.1	Very high	95.4	Very high	75 Å²	75	76 Å²	76	39%	0.393	39%	0.39	S	S	.	.	H	α-helix	trans	-60.4	-48.5	171.9	-82.6	168	0	0	0	111.8	K447 I459 Q461 E465 V466 E467	K447-L463 HydrophobicContact CD-CD2 3.73Å; K447-L463 HydrophobicContact CD-CG 4.19Å; I459-L463 HydrophobicContact CG2-CD1 3.86Å; I459-L463 HydrophobicContact CG2-CG 4.25Å; I459-L463 WeakPolarHBondContact O-CB 3.39Å; I459-L463 WeakPolarHBondContact O-CG 3.34Å; I459-L463 PolarHBondContact O-N 2.96Å; Q461-L463 VanDerWaalsContact C-N 3.3Å; Q461-L463 PolarHBondContact O-N 2.89Å; L463-E465 VanDerWaalsContact C-N 3.34Å; L463-E465 PolarHBondContact O-N 3.48Å; L463-V466 WeakPolarHBondContact O-CB 3.48Å; L463-V466 PolarHBondContact O-N 3.21Å; L463-V466 VanDerWaalsContact O-N 3.16Å; L463-E467 PolarHBondContact O-N 3.26Å
464	K	96.8	Very high	95.5	Very high	127 Å²	127	76.6 Å²	76.6	55%	0.552	39%	0.385	S	S	*	.	H	α-helix	trans	-60.7	-43.1	177.1	-172.2	-176.5	179.4	-167.7	0	111.9	P460 Q461 V466 E467 E468	P460-K464 PolarHBondContact O-N 3.13Å; P460-K464 VanDerWaalsContact O-N 3.13Å; Q461-K464 PolarHBondContact O-N 3.04Å; K464-V466 VanDerWaalsContact C-N 3.3Å; K464-V466 PolarHBondContact O-N 3.37Å; K464-E467 PolarHBondContact O-N 3.49Å; K464-E468 WeakPolarHBondContact CE-OE1 3.27Å; K464-E468 IonicContact NZ-OE1 3.87Å; K464-E468 WeakPolarHBondContact O-CB 3.34Å; K464-E468 WeakPolarHBondContact O-CG 3.48Å; K464-E468 PolarHBondContact O-N 3.13Å
465	E	96.3	Very high	95.8	Very high	46 Å²	46	77.8 Å²	77.8	22%	0.215	38%	0.379	C	S	.	.	H	α-helix	trans	-63.9	-35.5	176	-71.5	-179.6	-160.3	0	0	112.3	K443 Q461 A462 L463 W469	K443-E465 HydrophobicContact CD-CB 4.27Å; K443-E465 WeakPolarHBondContact CE-OE2 3.06Å; K443-E465 IonicContact NZ-OE2 2.71Å; K443-E465 PolarHBondContact NZ-OE2 2.96Å; Q461-E465 PolarHBondContact NE2-OE1 2.91Å; Q461-E465 VanDerWaalsContact NE2-OE1 3.07Å; Q461-E465 WeakPolarHBondContact O-CG 3.37Å; Q461-E465 PolarHBondContact O-N 3.19Å; A462-E465 PolarHBondContact O-N 2.66Å; L463-E465 VanDerWaalsContact C-N 3.34Å; L463-E465 PolarHBondContact O-N 3.48Å; E465-W469 VanDerWaalsContact O-CD1 3.23Å; E465-W469 PolarHBondContact O-N 2.87Å
466	V	97	Very high	96.1	Very high	8 Å²	8	74.5 Å²	74.5	5%	0.048	37%	0.369	C	S	.	.	H	α-helix	trans	-64.8	-51.1	173.7	168.6	0	0	0	0	110.1	L440 K443 R444 K447 A462 L463 K464 E468 W469 E470	L440-V466 HydrophobicContact CD1-CG1 4.14Å; K443-V466 HydrophobicContact CB-CG2 3.89Å; R444-V466 HydrophobicContact CG-CG1 3.88Å; R444-V466 HydrophobicContact CG-CG2 4.07Å; K447-V466 HydrophobicContact CB-CG2 4.3Å; K447-V466 HydrophobicContact CD-CG2 4.4Å; A462-V466 VanDerWaalsContact O-CG2 3.28Å; A462-V466 WeakPolarHBondContact O-CG2 3.49Å; A462-V466 PolarHBondContact O-N 3.07Å; L463-V466 WeakPolarHBondContact O-CB 3.48Å; L463-V466 PolarHBondContact O-N 3.21Å; L463-V466 VanDerWaalsContact O-N 3.16Å; K464-V466 VanDerWaalsContact C-N 3.3Å; K464-V466 PolarHBondContact O-N 3.37Å; V466-E468 VanDerWaalsContact C-N 3.33Å; V466-E468 PolarHBondContact O-N 3.18Å; V466-W469 CarbonylContact O-C 3.57Å; V466-W469 PolarHBondContact O-N 3.03Å; V466-W469 VanDerWaalsContact O-N 3.08Å; V466-E470 HydrophobicContact CG1-CG 4.16Å; V466-E470 WeakPolarHBondContact CG1-OE1 3.41Å; V466-E470 WeakPolarHBondContact O-CG 3.16Å; V466-E470 PolarHBondContact O-N 3.31Å
467	E	97.2	Very high	96.3	Very high	137 Å²	137	72.8 Å²	72.8	64%	0.64	35%	0.353	S	S	*	.	H	α-helix	trans	-57.8	-42.9	178.9	-174.4	178.2	-164.3	0	0	112.2	L463 K464 W469 E470 Q471	L463-E467 PolarHBondContact O-N 3.26Å; K464-E467 PolarHBondContact O-N 3.49Å; E467-W469 VanDerWaalsContact C-N 3.33Å; E467-W469 PolarHBondContact O-N 3.42Å; E467-E470 PolarHBondContact O-N 3.03Å; E467-Q471 PolarHBondContact O-N 3.4Å
468	E	97.1	Very high	96.5	Very high	84 Å²	84	73 Å²	73	39%	0.393	35%	0.351	S	S	.	.	H	α-helix	trans	-61.5	-38.1	175.6	-75.7	176.8	-167.4	0	0	113	K464 V466 K472	K464-E468 WeakPolarHBondContact CE-OE1 3.27Å; K464-E468 IonicContact NZ-OE1 3.87Å; K464-E468 WeakPolarHBondContact O-CB 3.34Å; K464-E468 WeakPolarHBondContact O-CG 3.48Å; K464-E468 PolarHBondContact O-N 3.13Å; V466-E468 VanDerWaalsContact C-N 3.33Å; V466-E468 PolarHBondContact O-N 3.18Å; E468-K472 WeakPolarHBondContact O-CG 3.28Å; E468-K472 PolarHBondContact O-N 3.26Å
469	W	97.2	Very high	96.7	Very high	65 Å²	65	71.6 Å²	71.6	25%	0.246	35%	0.348	C	S	.	.	H	α-helix	trans	-83.6	-23	178.6	-82	99.5	0	0	0	113.2	A436 T439 L440 K443 E465 V466 E467 K472 S473	A436-W469 HydrophobicContact CB-CZ3 4.44Å; T439-W469 HydrophobicContact CG2-CD2 3.61Å; T439-W469 VanDerWaalsContact CG2-CE2 3.46Å; T439-W469 HydrophobicContact CG2-CE3 3.82Å; T439-W469 HydrophobicContact CG2-CG 4.29Å; T439-W469 HydrophobicContact CG2-CH2 3.76Å; T439-W469 HydrophobicContact CG2-CZ2 3.55Å; T439-W469 HydrophobicContact CG2-CZ3 3.89Å; L440-W469 HydrophobicContact CB-CB 4.2Å; L440-W469 HydrophobicContact CD1-CB 4.09Å; K443-W469 HydrophobicContact CG-CG 4.22Å; E465-W469 VanDerWaalsContact O-CD1 3.23Å; E465-W469 PolarHBondContact O-N 2.87Å; V466-W469 CarbonylContact O-C 3.57Å; V466-W469 PolarHBondContact O-N 3.03Å; V466-W469 VanDerWaalsContact O-N 3.08Å; E467-W469 VanDerWaalsContact C-N 3.33Å; E467-W469 PolarHBondContact O-N 3.42Å; W469-K472 HydrophobicContact CD2-CD 4.15Å; W469-K472 HydrophobicContact CE3-CB 4.15Å; W469-K472 HydrophobicContact CE3-CD 3.96Å; W469-K472 HydrophobicContact CH2-CD 4.39Å; W469-K472 HydrophobicContact CZ3-CD 4.09Å; W469-S473 VanDerWaalsContact O-CB 3.31Å; W469-S473 WeakPolarHBondContact O-CB 3.24Å; W469-S473 PolarHBondContact O-N 2.92Å
470	E	97.6	Very high	96.8	Very high	64 Å²	64	70 Å²	70	30%	0.299	34%	0.34	S	S	.	.	H	α-helix	trans	-62.1	-53.7	167.1	-73.9	176.3	162.6	0	0	109.1	L440 R444 V466 E467 K472 S473 D474	L440-E470 HydrophobicContact CD1-CB 4.46Å; L440-E470 HydrophobicContact CD1-CG 3.47Å; L440-E470 VanDerWaalsContact CD1-CG 3.47Å; L440-E470 HydrophobicContact CD2-CG 3.87Å; L440-E470 HydrophobicContact CG-CG 4.31Å; R444-E470 IonicContact CZ-OE1 3.38Å; R444-E470 IonicContact NE-OE1 2.75Å; R444-E470 PolarHBondContact NE-OE1 2.87Å; R444-E470 IonicContact NH2-OE1 3.34Å; R444-E470 PolarHBondContact NH2-OE1 3.49Å; V466-E470 HydrophobicContact CG1-CG 4.16Å; V466-E470 WeakPolarHBondContact CG1-OE1 3.41Å; V466-E470 WeakPolarHBondContact O-CG 3.16Å; V466-E470 PolarHBondContact O-N 3.31Å; E467-E470 PolarHBondContact O-N 3.03Å; E470-K472 VanDerWaalsContact C-N 3.34Å; E470-K472 PolarHBondContact O-N 3.48Å; E470-S473 WeakPolarHBondContact O-CB 3.37Å; E470-S473 PolarHBondContact O-N 2.9Å; E470-S473 VanDerWaalsContact O-N 3.09Å; E470-D474 PolarHBondContact O-N 3.4Å
471	Q	97.7	Very high	96.8	Very high	106 Å²	106	70.9 Å²	70.9	50%	0.495	34%	0.337	S	S	.	.	H	α-helix	trans	-58.3	-43.7	176.9	-173.3	62.7	52.2	0	0	112.6	E467 S473 D474 D475	E467-Q471 PolarHBondContact O-N 3.4Å; Q471-S473 VanDerWaalsContact C-N 3.3Å; Q471-S473 PolarHBondContact O-N 3.3Å; Q471-D474 PolarHBondContact O-N 2.89Å; Q471-D475 PolarHBondContact NE2-OD1 2.93Å; Q471-D475 WeakPolarHBondContact O-CB 3.44Å; Q471-D475 PolarHBondContact O-N 2.77Å
472	K	97.6	Very high	97	Very high	98 Å²	98	69.5 Å²	69.5	43%	0.426	33%	0.33	S	S	.	.	H	α-helix	trans	-64.6	-33.7	177.6	-75.7	173.4	-178.3	170.2	0	113.3	E468 W469 E470 A476	E468-K472 WeakPolarHBondContact O-CG 3.28Å; E468-K472 PolarHBondContact O-N 3.26Å; W469-K472 HydrophobicContact CD2-CD 4.15Å; W469-K472 HydrophobicContact CE3-CB 4.15Å; W469-K472 HydrophobicContact CE3-CD 3.96Å; W469-K472 HydrophobicContact CH2-CD 4.39Å; W469-K472 HydrophobicContact CZ3-CD 4.09Å; E470-K472 VanDerWaalsContact C-N 3.34Å; E470-K472 PolarHBondContact O-N 3.48Å; K472-A476 WeakPolarHBondContact O-CB 3.3Å; K472-A476 PolarHBondContact O-N 3.5Å; K472-A476 VanDerWaalsContact O-N 3.13Å
473	S	96.8	Very high	97	Very high	4 Å²	4	69.3 Å²	69.3	3%	0.028	33%	0.328	C	S	.	.	H	α-helix	trans	-67.9	-45	175.2	-175.3	0	0	0	0	110.3	W469 E470 Q471 A476 E477	W469-S473 VanDerWaalsContact O-CB 3.31Å; W469-S473 WeakPolarHBondContact O-CB 3.24Å; W469-S473 PolarHBondContact O-N 2.92Å; E470-S473 WeakPolarHBondContact O-CB 3.37Å; E470-S473 PolarHBondContact O-N 2.9Å; E470-S473 VanDerWaalsContact O-N 3.09Å; Q471-S473 VanDerWaalsContact C-N 3.3Å; Q471-S473 PolarHBondContact O-N 3.3Å; S473-A476 PolarHBondContact O-N 2.87Å; S473-E477 WeakPolarHBondContact O-CB 3.26Å; S473-E477 PolarHBondContact O-N 3.49Å
474	D	97.8	Very high	97.1	Very high	74 Å²	74	66.3 Å²	66.3	40%	0.396	31%	0.314	S	S	.	.	H	α-helix	trans	-63.9	-42.7	178.3	-65.6	-4.9	0	0	0	111.5	E470 Q471 A476 E477 Q478	E470-D474 PolarHBondContact O-N 3.4Å; Q471-D474 PolarHBondContact O-N 2.89Å; D474-A476 VanDerWaalsContact C-N 3.33Å; D474-A476 PolarHBondContact O-N 3.39Å; D474-E477 PolarHBondContact O-N 3.25Å; D474-Q478 VanDerWaalsContact O-CG 3.31Å; D474-Q478 WeakPolarHBondContact O-CG 3.49Å; D474-Q478 PolarHBondContact O-N 3.4Å
475	D	97.8	Very high	97.1	Very high	78 Å²	78	62.5 Å²	62.5	42%	0.417	30%	0.303	S	S	.	.	H	α-helix	trans	-62.1	-40.6	175.7	-68.5	-16.2	0	0	0	111.6	Q471 Q478 H479	Q471-D475 PolarHBondContact NE2-OD1 2.93Å; Q471-D475 WeakPolarHBondContact O-CB 3.44Å; Q471-D475 PolarHBondContact O-N 2.77Å; D475-Q478 PolarHBondContact O-N 3.27Å; D475-H479 WeakPolarHBondContact O-CB 3.31Å; D475-H479 PolarHBondContact O-N 3.26Å
476	A	97.1	Very high	97.1	Very high	21 Å²	21	60.5 Å²	60.5	17%	0.174	29%	0.294	C	S	.	.	H	α-helix	trans	-70	-37.3	178.5	0	0	0	0	0	112.5	W433 A436 K472 S473 D474 H479 F480	W433-A476 HydrophobicContact CB-CB 4.04Å; A436-A476 HydrophobicContact CB-CB 4.36Å; K472-A476 WeakPolarHBondContact O-CB 3.3Å; K472-A476 PolarHBondContact O-N 3.5Å; K472-A476 VanDerWaalsContact O-N 3.13Å; S473-A476 PolarHBondContact O-N 2.87Å; D474-A476 VanDerWaalsContact C-N 3.33Å; D474-A476 PolarHBondContact O-N 3.39Å; A476-H479 PolarHBondContact O-N 3.15Å; A476-F480 WeakPolarHBondContact O-CB 3.47Å; A476-F480 PolarHBondContact O-N 2.75Å
477	E	97.2	Very high	97.1	Very high	72 Å²	72	60.1 Å²	60.1	34%	0.336	29%	0.292	S	S	.	.	H	α-helix	trans	-61.7	-48.5	172.3	-176.2	171	-175.4	0	0	111.1	W433 S473 D474 H479 F480 H481	W433-E477 HydrophobicContact CD2-CB 4.25Å; W433-E477 HydrophobicContact CD2-CG 4.43Å; W433-E477 HydrophobicContact CG-CB 4.37Å; W433-E477 HydrophobicContact CH2-CG 4.13Å; W433-E477 HydrophobicContact CZ2-CB 4.1Å; W433-E477 HydrophobicContact CZ2-CG 3.57Å; S473-E477 WeakPolarHBondContact O-CB 3.26Å; S473-E477 PolarHBondContact O-N 3.49Å; D474-E477 PolarHBondContact O-N 3.25Å; E477-H479 VanDerWaalsContact C-N 3.32Å; E477-H479 PolarHBondContact O-N 3.06Å; E477-F480 WeakPolarHBondContact O-CB 3.43Å; E477-F480 PolarHBondContact O-N 3.11Å; E477-H481 PolarHBondContact O-CD2 2.87Å; E477-H481 PolarHBondContact O-N 3.11Å; E477-H481 IonicContact OE1-NE2 2.69Å
478	Q	97.5	Very high	97.1	Very high	126 Å²	126	57.2 Å²	57.2	59%	0.589	28%	0.278	S	S	*	.	H	α-helix	trans	-60.5	-41.5	176.5	-71.7	176.5	27.9	0	0	111.9	D474 D475 H481 H482	D474-Q478 VanDerWaalsContact O-CG 3.31Å; D474-Q478 WeakPolarHBondContact O-CG 3.49Å; D474-Q478 PolarHBondContact O-N 3.4Å; D475-Q478 PolarHBondContact O-N 3.27Å; Q478-H481 PolarHBondContact O-N 3.3Å; Q478-H482 VanDerWaalsContact O-CB 3.31Å; Q478-H482 WeakPolarHBondContact O-CB 3.3Å; Q478-H482 PolarHBondContact O-N 2.76Å
479	H	96.9	Very high	97.1	Very high	73 Å²	73	59.6 Å²	59.6	34%	0.338	29%	0.288	S	S	.	.	H	α-helix	trans	-61.5	-45.4	175.3	178	62.5	0	0	0	111.7	P210 D475 A476 E477 H481 H482 V483	P210-H479 PolarHBondContact O-CE1 3.46Å; D475-H479 WeakPolarHBondContact O-CB 3.31Å; D475-H479 PolarHBondContact O-N 3.26Å; A476-H479 PolarHBondContact O-N 3.15Å; E477-H479 VanDerWaalsContact C-N 3.32Å; E477-H479 PolarHBondContact O-N 3.06Å; H479-H481 PolarHBondContact O-N 3.24Å; H479-H482 PolarHBondContact O-N 3.27Å; H479-V483 VanDerWaalsContact CE1-CG2 3.47Å; H479-V483 WeakPolarHBondContact CE1-CG2 3.16Å; H479-V483 WeakPolarHBondContact O-CG2 3.34Å; H479-V483 PolarHBondContact O-N 2.79Å
480	F	96	Very high	97	Very high	2 Å²	2	56.8 Å²	56.8	1%	0.009	28%	0.277	C	S	.	.	H	α-helix	trans	-59	-46.1	176.4	171.4	-105.8	0	0	0	112.6	M315 E317 R426 A429 W430 W433 A476 E477 V483 S484	M315-F480 HydrophobicContact CE-CE2 3.88Å; M315-F480 HydrophobicContact CE-CZ 3.86Å; E317-F480 WeakPolarHBondContact OE1-CZ 3.23Å; E317-F480 WeakPolarHBondContact OE2-CE1 3.25Å; E317-F480 WeakPolarHBondContact OE2-CZ 3.44Å; R426-F480 HydrophobicContact CG-CD2 4.3Å; R426-F480 HydrophobicContact CG-CE2 3.67Å; A429-F480 HydrophobicContact CB-CB 4.35Å; A429-F480 HydrophobicContact CB-CD2 4.22Å; W430-F480 HydrophobicContact CB-CD2 3.8Å; W430-F480 HydrophobicContact CB-CE2 3.66Å; W430-F480 HydrophobicContact CB-CZ 4.49Å; W430-F480 AromaticContact CD1-CE2 3.93Å; W430-F480 AromaticContact CD1-CZ 3.93Å; W430-F480 HydrophobicContact CG-CE2 4.21Å; W433-F480 HydrophobicContact CE3-CB 4.4Å; W433-F480 AromaticContact CE3-CD1 3.81Å; W433-F480 HydrophobicContact CE3-CD1 3.81Å; W433-F480 HydrophobicContact CE3-CE1 4.36Å; W433-F480 HydrophobicContact CE3-CG 4.13Å; W433-F480 AromaticContact CZ3-CD1 3.75Å; W433-F480 HydrophobicContact CZ3-CD1 3.75Å; W433-F480 HydrophobicContact CZ3-CE1 4Å; A476-F480 WeakPolarHBondContact O-CB 3.47Å; A476-F480 PolarHBondContact O-N 2.75Å; E477-F480 WeakPolarHBondContact O-CB 3.43Å; E477-F480 PolarHBondContact O-N 3.11Å; F480-V483 PolarHBondContact O-N 3.1Å; F480-S484 WeakPolarHBondContact O-CB 3.46Å; F480-S484 PolarHBondContact O-N 3.41Å; F480-S484 PolarHBondContact O-OG 2.82Å
481	H	96.4	Very high	97	Very high	101 Å²	101	54.8 Å²	54.8	47%	0.468	27%	0.267	S	S	.	.	H	α-helix	trans	-65.6	-38.7	176	-72.6	-56.2	0	0	0	112.5	E477 Q478 H479 S484 S485	E477-H481 PolarHBondContact O-CD2 2.87Å; E477-H481 PolarHBondContact O-N 3.11Å; E477-H481 IonicContact OE1-NE2 2.69Å; Q478-H481 PolarHBondContact O-N 3.3Å; H479-H481 PolarHBondContact O-N 3.24Å; H481-S484 PolarHBondContact O-N 2.69Å; H481-S485 WeakPolarHBondContact O-CB 3.29Å; H481-S485 PolarHBondContact O-N 3.45Å
482	H	97.2	Very high	96.9	Very high	94 Å²	94	56.2 Å²	56.2	44%	0.435	27%	0.271	S	S	.	.	H	α-helix	trans	-61.9	-50.7	176	-178.6	82.7	0	0	0	111.7	Q478 H479 S484 S485 S486	Q478-H482 VanDerWaalsContact O-CB 3.31Å; Q478-H482 WeakPolarHBondContact O-CB 3.3Å; Q478-H482 PolarHBondContact O-N 2.76Å; H479-H482 PolarHBondContact O-N 3.27Å; H482-S484 VanDerWaalsContact C-N 3.34Å; H482-S484 PolarHBondContact O-N 3.35Å; H482-S485 PolarHBondContact O-N 2.89Å; H482-S486 VanDerWaalsContact O-CB 3.24Å; H482-S486 WeakPolarHBondContact O-CB 3.47Å; H482-S486 PolarHBondContact O-N 3.38Å
483	V	96.7	Very high	96.8	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-59.2	-47.2	177.4	171.4	0	0	0	0	109.9	P210 R426 H479 F480 S485 S486 I487	P210-V483 WeakPolarHBondContact O-CG2 3.47Å; R426-V483 HydrophobicContact CB-CG1 4.18Å; H479-V483 VanDerWaalsContact CE1-CG2 3.47Å; H479-V483 WeakPolarHBondContact CE1-CG2 3.16Å; H479-V483 WeakPolarHBondContact O-CG2 3.34Å; H479-V483 PolarHBondContact O-N 2.79Å; F480-V483 PolarHBondContact O-N 3.1Å; V483-S485 PolarHBondContact O-N 3.17Å; V483-S486 WeakPolarHBondContact O-CB 3.38Å; V483-S486 PolarHBondContact O-N 3.16Å; V483-S486 VanDerWaalsContact O-N 3.16Å; V483-I487 HydrophobicContact CG1-CD1 3.65Å; V483-I487 HydrophobicContact CG1-CG1 4.25Å; V483-I487 VanDerWaalsContact O-CG1 3.23Å; V483-I487 WeakPolarHBondContact O-CG1 3.41Å; V483-I487 PolarHBondContact O-N 2.96Å
484	S	96.3	Very high	96.7	Very high	12 Å²	12	54 Å²	54	8%	0.084	26%	0.26	C	S	.	.	H	α-helix	trans	-57.9	-48.5	178.6	-61.2	0	0	0	0	112.5	R426 F480 H481 H482 S486 I487 Q488	R426-S484 WeakPolarHBondContact CD-OG 3.1Å; R426-S484 PolarHBondContact NE-OG 3.46Å; F480-S484 WeakPolarHBondContact O-CB 3.46Å; F480-S484 PolarHBondContact O-N 3.41Å; F480-S484 PolarHBondContact O-OG 2.82Å; H481-S484 PolarHBondContact O-N 2.69Å; H482-S484 VanDerWaalsContact C-N 3.34Å; H482-S484 PolarHBondContact O-N 3.35Å; S484-S486 VanDerWaalsContact C-N 3.32Å; S484-S486 PolarHBondContact O-N 3.17Å; S484-I487 PolarHBondContact O-N 2.64Å; S484-Q488 WeakPolarHBondContact O-CG 3.31Å; S484-Q488 PolarHBondContact O-N 3.12Å
485	S	96.9	Very high	96.5	Very high	48 Å²	48	53 Å²	53	34%	0.336	26%	0.255	S	S	.	.	H	α-helix	trans	-65.3	-35.8	177.3	-174.4	0	0	0	0	112.7	H481 H482 V483 K489	H481-S485 WeakPolarHBondContact O-CB 3.29Å; H481-S485 PolarHBondContact O-N 3.45Å; H482-S485 PolarHBondContact O-N 2.89Å; V483-S485 PolarHBondContact O-N 3.17Å; S485-K489 WeakPolarHBondContact O-CG 3.18Å; S485-K489 PolarHBondContact O-N 3.1Å
486	S	97.3	Very high	96.3	Very high	3 Å²	3	54.5 Å²	54.5	2%	0.021	26%	0.259	C	S	.	.	H	α-helix	trans	-63	-49.6	176.4	-166.7	0	0	0	0	110.9	H211 G212 R213 H482 V483 S484 Q488 K489 E490	H211-S486 WeakPolarHBondContact O-CB 3.38Å; H211-S486 PolarHBondContact O-OG 2.89Å; G212-S486 PolarHBondContact O-OG 3.17Å; R213-S486 WeakPolarHBondContact CD-OG 3.41Å; R213-S486 PolarHBondContact NE-OG 2.87Å; R213-S486 VanDerWaalsContact NE-OG 3.1Å; R213-S486 PolarHBondContact NH2-OG 2.74Å; H482-S486 VanDerWaalsContact O-CB 3.24Å; H482-S486 WeakPolarHBondContact O-CB 3.47Å; H482-S486 PolarHBondContact O-N 3.38Å; V483-S486 WeakPolarHBondContact O-CB 3.38Å; V483-S486 PolarHBondContact O-N 3.16Å; V483-S486 VanDerWaalsContact O-N 3.16Å; S484-S486 VanDerWaalsContact C-N 3.32Å; S484-S486 PolarHBondContact O-N 3.17Å; S486-Q488 VanDerWaalsContact C-N 3.34Å; S486-Q488 PolarHBondContact O-N 3.04Å; S486-K489 PolarHBondContact O-N 3.26Å; S486-K489 VanDerWaalsContact O-N 3.15Å; S486-E490 VanDerWaalsContact O-CG 3.3Å; S486-E490 WeakPolarHBondContact O-CG 3.23Å; S486-E490 PolarHBondContact O-N 3.48Å
487	I	97.3	Very high	96.1	Very high	1 Å²	1	56.5 Å²	56.5	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-59.9	-43	179.8	-64.9	170.6	0	0	0	111.5	F322 V422 F423 R426 V483 S484 K489 E490 Y491	F322-I487 HydrophobicContact CE1-CB 4.07Å; F322-I487 HydrophobicContact CE1-CD1 4.33Å; F322-I487 HydrophobicContact CE1-CG2 3.79Å; V422-I487 HydrophobicContact CG1-CB 4.43Å; V422-I487 HydrophobicContact CG1-CD1 4.13Å; V422-I487 HydrophobicContact CG1-CG1 3.59Å; V422-I487 HydrophobicContact CG1-CG2 4.29Å; V422-I487 WeakPolarHBondContact O-CD1 3.34Å; F423-I487 HydrophobicContact CD2-CG2 4.1Å; F423-I487 HydrophobicContact CE2-CG2 3.86Å; F423-I487 HydrophobicContact CZ-CG2 4.22Å; R426-I487 HydrophobicContact CB-CD1 3.65Å; V483-I487 HydrophobicContact CG1-CD1 3.65Å; V483-I487 HydrophobicContact CG1-CG1 4.25Å; V483-I487 VanDerWaalsContact O-CG1 3.23Å; V483-I487 WeakPolarHBondContact O-CG1 3.41Å; V483-I487 PolarHBondContact O-N 2.96Å; S484-I487 PolarHBondContact O-N 2.64Å; I487-K489 VanDerWaalsContact C-N 3.32Å; I487-K489 PolarHBondContact O-N 2.83Å; I487-E490 PolarHBondContact O-N 3.38Å; I487-Y491 VanDerWaalsContact O-CB 3.3Å; I487-Y491 WeakPolarHBondContact O-CB 3.48Å; I487-Y491 PolarHBondContact O-N 2.84Å
488	Q	96.8	Very high	95.9	Very high	75 Å²	75	55.6 Å²	55.6	35%	0.35	26%	0.258	S	S	.	.	H	α-helix	trans	-59.8	-42.6	177.8	-73.4	178.4	-30.8	0	0	112.4	W321 F322 S484 S486 K492	W321-Q488 HydrophobicContact CD2-CG 4.15Å; W321-Q488 HydrophobicContact CE3-CG 3.88Å; W321-Q488 HydrophobicContact CH2-CB 4.21Å; W321-Q488 HydrophobicContact CH2-CG 3.72Å; W321-Q488 HydrophobicContact CZ2-CB 4.32Å; W321-Q488 HydrophobicContact CZ2-CG 3.93Å; W321-Q488 HydrophobicContact CZ3-CG 3.68Å; F322-Q488 HydrophobicContact CZ-CG 4.09Å; S484-Q488 WeakPolarHBondContact O-CG 3.31Å; S484-Q488 PolarHBondContact O-N 3.12Å; S486-Q488 VanDerWaalsContact C-N 3.34Å; S486-Q488 PolarHBondContact O-N 3.04Å; Q488-K492 PolarHBondContact O-N 3.24Å
489	K	96.6	Very high	95.6	Very high	135 Å²	135	53.8 Å²	53.8	59%	0.587	26%	0.256	S	S	*	.	H	α-helix	trans	-66.7	-42.9	176.8	-69.4	173.4	-176.2	174.6	0	111.5	S485 S486 I487 R493	S485-K489 WeakPolarHBondContact O-CG 3.18Å; S485-K489 PolarHBondContact O-N 3.1Å; S486-K489 PolarHBondContact O-N 3.26Å; S486-K489 VanDerWaalsContact O-N 3.15Å; I487-K489 VanDerWaalsContact C-N 3.32Å; I487-K489 PolarHBondContact O-N 2.83Å; K489-R493 PolarHBondContact O-N 3.14Å
490	E	96.4	Very high	95.3	Very high	6 Å²	6	55 Å²	55	3%	0.028	26%	0.26	C	S	.	.	H	α-helix	trans	-70.8	-38.7	-178.8	-68.1	-64	153.3	0	0	112.4	R213 I214 H263 S486 I487 R493 F494	R213-E490 VanDerWaalsContact CD-OE1 3.29Å; R213-E490 WeakPolarHBondContact CD-OE1 3.49Å; R213-E490 IonicContact CZ-OE1 3.88Å; R213-E490 IonicContact NE-OE1 3.26Å; R213-E490 IonicContact NH1-OE1 2.7Å; R213-E490 PolarHBondContact NH1-OE1 2.92Å; I214-E490 HydrophobicContact CD1-CB 3.86Å; I214-E490 HydrophobicContact CG1-CB 4.08Å; H263-E490 IonicContact CD2-OE2 3.83Å; H263-E490 IonicContact CE1-OE1 2.86Å; H263-E490 PolarHBondContact CE1-OE1 2.84Å; H263-E490 VanDerWaalsContact CE1-OE1 3.24Å; H263-E490 IonicContact CE1-OE2 2.64Å; H263-E490 IonicContact NE2-OE1 3.48Å; H263-E490 PolarHBondContact NE2-OE1 2.92Å; H263-E490 IonicContact NE2-OE2 3.85Å; H263-E490 PolarHBondContact NE2-OE2 2.92Å; H263-E490 VanDerWaalsContact NE2-OE2 3.11Å; S486-E490 VanDerWaalsContact O-CG 3.3Å; S486-E490 WeakPolarHBondContact O-CG 3.23Å; S486-E490 PolarHBondContact O-N 3.48Å; I487-E490 PolarHBondContact O-N 3.38Å; E490-R493 PolarHBondContact O-N 2.84Å; E490-F494 WeakPolarHBondContact O-CB 3.21Å; E490-F494 PolarHBondContact O-N 3.25Å
491	Y	96.5	Very high	95	Very high	21 Å²	21	56.9 Å²	56.9	8%	0.082	27%	0.269	C	S	.	.	H	α-helix	trans	-61.8	-46.6	174.3	-175.5	-101.7	0	0	0	111.3	W321 R325 E328 V329 V419 F423 I487 R493 F494 D495	W321-Y491 HydrophobicContact CH2-CD1 4.02Å; W321-Y491 HydrophobicContact CH2-CG 4.13Å; W321-Y491 HydrophobicContact CZ2-CD1 4.01Å; R325-Y491 HydrophobicContact CB-CE1 4.37Å; R325-Y491 HydrophobicContact CG-CD1 4.01Å; R325-Y491 HydrophobicContact CG-CE1 3.55Å; E328-Y491 PolarHBondContact OE2-OH 3.48Å; E328-Y491 VanDerWaalsContact OE2-OH 3.05Å; V329-Y491 HydrophobicContact CG2-CD2 4.37Å; V329-Y491 HydrophobicContact CG2-CE2 3.53Å; V419-Y491 HydrophobicContact CG1-CD2 4.36Å; F423-Y491 HydrophobicContact CE2-CD2 4.14Å; F423-Y491 HydrophobicContact CZ-CD2 4.28Å; I487-Y491 VanDerWaalsContact O-CB 3.3Å; I487-Y491 WeakPolarHBondContact O-CB 3.48Å; I487-Y491 PolarHBondContact O-N 2.84Å; Y491-R493 VanDerWaalsContact C-N 3.3Å; Y491-R493 PolarHBondContact O-N 2.94Å; Y491-F494 HydrophobicContact CD2-CD1 4.44Å; Y491-F494 PolarHBondContact O-N 3.2Å; Y491-D495 WeakPolarHBondContact O-CB 3.27Å; Y491-D495 PolarHBondContact O-N 2.89Å
492	K	95.8	Very high	94.7	Very high	136 Å²	136	53.5 Å²	53.5	59%	0.591	25%	0.253	S	S	*	.	H	α-helix	trans	-58.1	-44.1	175	-175.2	179.2	-179.4	-179.8	0	111.3	Q488 Q496	Q488-K492 PolarHBondContact O-N 3.24Å; K492-Q496 VanDerWaalsContact O-CG 3.26Å; K492-Q496 WeakPolarHBondContact O-CG 3.25Å; K492-Q496 PolarHBondContact O-N 3.48Å; K492-Q496 VanDerWaalsContact O-N 3.13Å
493	R	95.3	Very high	94.5	Very high	45 Å²	45	55.7 Å²	55.7	17%	0.17	26%	0.261	C	S	.	.	H	α-helix	trans	-62.5	-50.2	176.6	-178.3	179	170.1	-89.3	-14.1	111.1	D262 H263 K489 E490 Y491 D495 Q496 H497	D262-R493 PolarHBondContact O-NH2 3.47Å; H263-R493 PolarHBondContact CD2-NH1 2.86Å; H263-R493 VanDerWaalsContact CD2-NH1 3.29Å; K489-R493 PolarHBondContact O-N 3.14Å; E490-R493 PolarHBondContact O-N 2.84Å; Y491-R493 VanDerWaalsContact C-N 3.3Å; Y491-R493 PolarHBondContact O-N 2.94Å; R493-D495 VanDerWaalsContact C-N 3.33Å; R493-D495 PolarHBondContact O-N 3.31Å; R493-Q496 PolarHBondContact O-N 3.36Å; R493-H497 VanDerWaalsContact CG-CE1 3.47Å; R493-H497 WeakPolarHBondContact CG-CE1 3.37Å; R493-H497 PolarHBondContact O-N 2.87Å; R493-H497 PolarHBondContact O-ND1 3.15Å
494	F	95	Very high	94.2	Very high	11 Å²	11	61 Å²	61	5%	0.048	29%	0.286	C	S	.	.	H	α-helix	trans	-54.9	-48.2	178.1	162.1	-101.8	0	0	0	111.4	I214 L332 Y412 L415 I416 V419 E490 Y491 Q496 H497 R498	I214-F494 HydrophobicContact CD1-CB 3.74Å; I214-F494 HydrophobicContact CD1-CG 4.35Å; L332-F494 HydrophobicContact CD2-CE1 4.48Å; Y412-F494 HydrophobicContact CD1-CE2 4.5Å; Y412-F494 HydrophobicContact CE1-CE2 4.4Å; L415-F494 HydrophobicContact CD2-CD2 3.83Å; L415-F494 HydrophobicContact CD2-CE2 3.65Å; L415-F494 HydrophobicContact CG-CD2 4.08Å; L415-F494 HydrophobicContact CG-CE2 3.78Å; I416-F494 HydrophobicContact CG1-CZ 4.04Å; V419-F494 HydrophobicContact CG2-CD1 4.19Å; V419-F494 HydrophobicContact CG2-CD2 4.09Å; V419-F494 HydrophobicContact CG2-CE1 4.21Å; V419-F494 HydrophobicContact CG2-CE2 4.11Å; V419-F494 HydrophobicContact CG2-CG 4.13Å; V419-F494 HydrophobicContact CG2-CZ 4.17Å; E490-F494 WeakPolarHBondContact O-CB 3.21Å; E490-F494 PolarHBondContact O-N 3.25Å; Y491-F494 HydrophobicContact CD2-CD1 4.44Å; Y491-F494 PolarHBondContact O-N 3.2Å; F494-Q496 PolarHBondContact O-N 3.02Å; F494-H497 PolarHBondContact O-N 3.18Å; F494-R498 VanDerWaalsContact O-CB 3.27Å; F494-R498 WeakPolarHBondContact O-CB 3.42Å; F494-R498 PolarHBondContact O-N 3.44Å
495	D	93.6	Very high	93.9	Very high	52 Å²	52	60.8 Å²	60.8	28%	0.278	28%	0.284	S	S	.	.	H	α-helix	trans	-62.8	-46	-178.3	-174.3	42.8	0	0	0	112.3	Y491 R493 H497 R498 V499	Y491-D495 WeakPolarHBondContact O-CB 3.27Å; Y491-D495 PolarHBondContact O-N 2.89Å; R493-D495 VanDerWaalsContact C-N 3.33Å; R493-D495 PolarHBondContact O-N 3.31Å; D495-H497 PolarHBondContact O-N 3.13Å; D495-R498 WeakPolarHBondContact O-CB 3.43Å; D495-R498 PolarHBondContact O-N 2.95Å; D495-R498 IonicContact OD1-CZ 2.97Å; D495-R498 IonicContact OD1-NE 3.24Å; D495-R498 PolarHBondContact OD1-NE 2.92Å; D495-R498 IonicContact OD1-NH2 3.44Å; D495-R498 PolarHBondContact OD1-NH2 3.47Å; D495-V499 WeakPolarHBondContact O-CG2 3.28Å; D495-V499 PolarHBondContact O-N 2.98Å
496	Q	93.3	Very high	93.5	Very high	111 Å²	111	62.6 Å²	62.6	52%	0.519	29%	0.289	S	S	.	.	H	α-helix	trans	-60.2	-42.8	175.7	-71.7	174.2	-18.9	0	0	112.5	K492 R493 F494 K500	K492-Q496 VanDerWaalsContact O-CG 3.26Å; K492-Q496 WeakPolarHBondContact O-CG 3.25Å; K492-Q496 PolarHBondContact O-N 3.48Å; K492-Q496 VanDerWaalsContact O-N 3.13Å; R493-Q496 PolarHBondContact O-N 3.36Å; F494-Q496 PolarHBondContact O-N 3.02Å; Q496-K500 WeakPolarHBondContact O-CB 3.09Å; Q496-K500 PolarHBondContact O-N 3.5Å
497	H	92.4	Very high	93.2	Very high	62 Å²	62	66.1 Å²	66.1	29%	0.287	31%	0.307	S	S	.	.	H	α-helix	trans	-67.9	-42.8	177.8	-74.1	72.8	0	0	0	111.2	R493 F494 D495 K500 E501	R493-H497 VanDerWaalsContact CG-CE1 3.47Å; R493-H497 WeakPolarHBondContact CG-CE1 3.37Å; R493-H497 PolarHBondContact O-N 2.87Å; R493-H497 PolarHBondContact O-ND1 3.15Å; F494-H497 PolarHBondContact O-N 3.18Å; D495-H497 PolarHBondContact O-N 3.13Å; H497-K500 PolarHBondContact O-N 2.94Å; H497-E501 PolarHBondContact O-N 3.2Å
498	R	93	Very high	92.9	Very high	53 Å²	53	70.4 Å²	70.4	20%	0.2	33%	0.327	C	S	.	.	H	α-helix	trans	-54.6	-55.3	175.9	-179.3	-174.3	66.2	148.2	0.2	111.1	Y412 F494 D495 K500 E501 F502	Y412-R498 HydrophobicContact CD1-CG 4.25Å; Y412-R498 HydrophobicContact CE1-CB 3.85Å; Y412-R498 HydrophobicContact CE1-CG 3.75Å; Y412-R498 WeakPolarHBondContact OH-CA 3.15Å; F494-R498 VanDerWaalsContact O-CB 3.27Å; F494-R498 WeakPolarHBondContact O-CB 3.42Å; F494-R498 PolarHBondContact O-N 3.44Å; D495-R498 WeakPolarHBondContact O-CB 3.43Å; D495-R498 PolarHBondContact O-N 2.95Å; D495-R498 IonicContact OD1-CZ 2.97Å; D495-R498 IonicContact OD1-NE 3.24Å; D495-R498 PolarHBondContact OD1-NE 2.92Å; D495-R498 IonicContact OD1-NH2 3.44Å; D495-R498 PolarHBondContact OD1-NH2 3.47Å; R498-K500 VanDerWaalsContact C-N 3.27Å; R498-K500 PolarHBondContact O-N 2.88Å; R498-E501 PolarHBondContact O-N 3.24Å; R498-F502 HydrophobicContact CG-CD2 3.75Å; R498-F502 HydrophobicContact CG-CE2 3.79Å; R498-F502 WeakPolarHBondContact O-CB 3.41Å; R498-F502 VanDerWaalsContact O-CD2 3.24Å; R498-F502 WeakPolarHBondContact O-CD2 3.01Å; R498-F502 PolarHBondContact O-N 3.43Å
499	V	91.7	Very high	92.4	Very high	88 Å²	88	67.9 Å²	67.9	53%	0.533	32%	0.316	S	S	.	.	H	α-helix	trans	-58.1	-42.1	-179.8	174	0	0	0	0	111.3	D495 K503	D495-V499 WeakPolarHBondContact O-CG2 3.28Å; D495-V499 PolarHBondContact O-N 2.98Å; V499-K503 VanDerWaalsContact O-CB 3.3Å; V499-K503 WeakPolarHBondContact O-CB 3.35Å; V499-K503 PolarHBondContact O-N 3.46Å
500	K	91.5	Very high	91.9	Very high	98 Å²	98	67.2 Å²	67.2	43%	0.426	32%	0.318	S	S	.	.	H	α-helix	trans	-66.1	-50.3	179.8	-176.3	-179.4	177.1	-177.8	0	112.6	Q496 H497 R498 K503 Q504	Q496-K500 WeakPolarHBondContact O-CB 3.09Å; Q496-K500 PolarHBondContact O-N 3.5Å; H497-K500 PolarHBondContact O-N 2.94Å; R498-K500 VanDerWaalsContact C-N 3.27Å; R498-K500 PolarHBondContact O-N 2.88Å; K500-K503 PolarHBondContact O-N 2.88Å; K500-Q504 WeakPolarHBondContact O-CG 3.32Å; K500-Q504 PolarHBondContact O-N 3.5Å
501	E	90	Very high	91.5	Very high	42 Å²	42	72.6 Å²	72.6	20%	0.196	34%	0.343	C	S	.	.	H	α-helix	trans	-67.3	-41.3	-179	-72	-164.5	157.2	0	0	111.5	R259 Y412 H497 R498 K503 Q504 M505	R259-E501 IonicContact CZ-OE2 2.87Å; R259-E501 IonicContact NE-OE1 3.11Å; R259-E501 IonicContact NE-OE2 3.93Å; R259-E501 PolarHBondContact NE-OE2 2.88Å; R259-E501 IonicContact NH2-OE2 3.74Å; R259-E501 PolarHBondContact NH2-OE2 2.93Å; Y412-E501 HydrophobicContact CE2-CB 4.26Å; Y412-E501 VanDerWaalsContact CE2-OE2 3.32Å; Y412-E501 WeakPolarHBondContact CE2-OE2 3.49Å; Y412-E501 VanDerWaalsContact CZ-OE2 3.25Å; Y412-E501 VanDerWaalsContact OH-CB 3.31Å; Y412-E501 WeakPolarHBondContact OH-CB 3.31Å; Y412-E501 PolarHBondContact OH-OE2 3.42Å; H497-E501 PolarHBondContact O-N 3.2Å; R498-E501 PolarHBondContact O-N 3.24Å; E501-K503 VanDerWaalsContact C-N 3.34Å; E501-K503 PolarHBondContact O-N 2.95Å; E501-Q504 PolarHBondContact O-N 3.44Å; E501-M505 WeakPolarHBondContact O-CB 3.49Å; E501-M505 PolarHBondContact O-N 3.16Å
502	F	90	Very high	91.1	Very high	31 Å²	31	72.6 Å²	72.6	14%	0.136	35%	0.345	C	S	.	.	H	α-helix	trans	-61.7	-42.6	175.7	-91.2	-100.4	0	0	0	111.8	M336 L409 Y412 R498 Q504 M505 L506	M336-F502 HydrophobicContact CE-CE1 4.48Å; M336-F502 HydrophobicContact SD-CE1 3.92Å; M336-F502 HydrophobicContact SD-CZ 3.59Å; M336-F502 VanDerWaalsContact SD-CZ 3.59Å; L409-F502 HydrophobicContact CD2-CE1 3.69Å; L409-F502 HydrophobicContact CD2-CZ 4.01Å; Y412-F502 AromaticContact CD1-CE2 3.67Å; Y412-F502 HydrophobicContact CD1-CE2 3.67Å; Y412-F502 HydrophobicContact CD1-CZ 4.48Å; Y412-F502 HydrophobicContact CD2-CD2 4.17Å; Y412-F502 AromaticContact CD2-CE2 3.42Å; Y412-F502 HydrophobicContact CD2-CE2 3.42Å; Y412-F502 VanDerWaalsContact CD2-CE2 3.42Å; Y412-F502 HydrophobicContact CD2-CZ 4.03Å; Y412-F502 HydrophobicContact CE1-CD2 4.31Å; Y412-F502 AromaticContact CE1-CE2 3.83Å; Y412-F502 HydrophobicContact CE1-CE2 3.83Å; Y412-F502 AromaticContact CE2-CD2 3.9Å; Y412-F502 HydrophobicContact CE2-CD2 3.9Å; Y412-F502 AromaticContact CE2-CE2 3.61Å; Y412-F502 HydrophobicContact CE2-CE2 3.61Å; Y412-F502 HydrophobicContact CG-CD2 4.49Å; Y412-F502 AromaticContact CG-CE2 3.46Å; Y412-F502 HydrophobicContact CG-CE2 3.46Å; Y412-F502 VanDerWaalsContact CG-CE2 3.46Å; Y412-F502 AromaticContact CG-CZ 3.98Å; Y412-F502 HydrophobicContact CG-CZ 3.98Å; Y412-F502 AromaticContact CZ-CD2 3.99Å; Y412-F502 AromaticContact CZ-CE2 3.81Å; R498-F502 HydrophobicContact CG-CD2 3.75Å; R498-F502 HydrophobicContact CG-CE2 3.79Å; R498-F502 WeakPolarHBondContact O-CB 3.41Å; R498-F502 VanDerWaalsContact O-CD2 3.24Å; R498-F502 WeakPolarHBondContact O-CD2 3.01Å; R498-F502 PolarHBondContact O-N 3.43Å; F502-Q504 VanDerWaalsContact C-N 3.35Å; F502-Q504 PolarHBondContact O-N 3.37Å; F502-M505 HydrophobicContact CD1-CE 3.65Å; F502-M505 HydrophobicContact CE1-CE 4.05Å; F502-M505 HydrophobicContact CG-CE 4.31Å; F502-M505 WeakPolarHBondContact O-CB 3.47Å; F502-M505 PolarHBondContact O-N 2.95Å; F502-L506 WeakPolarHBondContact O-CB 3.49Å; F502-L506 VanDerWaalsContact O-CG 3.31Å; F502-L506 WeakPolarHBondContact O-CG 3.44Å; F502-L506 PolarHBondContact O-N 3.48Å
503	K	92.1	Very high	90.5	Very high	140 Å²	140	68.5 Å²	68.5	61%	0.609	33%	0.331	S	S	*	.	H	α-helix	trans	-59.3	-47.4	174.7	178.8	179.7	176.4	179.6	0	111.2	V499 K500 E501 L506 I507	V499-K503 VanDerWaalsContact O-CB 3.3Å; V499-K503 WeakPolarHBondContact O-CB 3.35Å; V499-K503 PolarHBondContact O-N 3.46Å; K500-K503 PolarHBondContact O-N 2.88Å; E501-K503 VanDerWaalsContact C-N 3.34Å; E501-K503 PolarHBondContact O-N 2.95Å; K503-L506 PolarHBondContact O-N 3.3Å; K503-I507 HydrophobicContact CG-CD1 3.91Å; K503-I507 VanDerWaalsContact O-CG1 3.28Å; K503-I507 WeakPolarHBondContact O-CG1 3.44Å; K503-I507 PolarHBondContact O-N 2.78Å
504	Q	91.7	Very high	89.7	Confident	111 Å²	111	69.1 Å²	69.1	52%	0.519	35%	0.347	S	S	.	.	H	α-helix	trans	-63.1	-42	179.1	-72.4	173.8	-14.5	0	0	111.9	K500 E501 F502 H508	K500-Q504 WeakPolarHBondContact O-CG 3.32Å; K500-Q504 PolarHBondContact O-N 3.5Å; E501-Q504 PolarHBondContact O-N 3.44Å; F502-Q504 VanDerWaalsContact C-N 3.35Å; F502-Q504 PolarHBondContact O-N 3.37Å; Q504-H508 WeakPolarHBondContact O-CB 3.35Å; Q504-H508 PolarHBondContact O-N 3.04Å
505	M	90	Very high	89.2	Confident	7 Å²	7	69.9 Å²	69.9	3%	0.034	36%	0.357	C	S	.	.	H	α-helix	trans	-59	-49.6	174.5	179.9	-167.5	62.2	0	0	112.1	I404 L405 M408 E501 F502 H508 L509	I404-M505 HydrophobicContact CG2-CG 3.98Å; I404-M505 WeakPolarHBondContact O-CG 3.33Å; L405-M505 HydrophobicContact CD1-CE 3.96Å; L405-M505 HydrophobicContact CD1-SD 3.96Å; M408-M505 HydrophobicContact CB-SD 3.7Å; M408-M505 HydrophobicContact CE-CB 3.67Å; M408-M505 HydrophobicContact CE-CG 3.76Å; M408-M505 HydrophobicContact CE-SD 4.16Å; M408-M505 HydrophobicContact CG-SD 3.77Å; M408-M505 HydrophobicContact SD-CB 3.46Å; M408-M505 WeakPolarHBondContact SD-CB 3.39Å; M408-M505 HydrophobicContact SD-CE 4.49Å; M408-M505 HydrophobicContact SD-CG 3.6Å; M408-M505 HydrophobicContact SD-SD 3.34Å; E501-M505 WeakPolarHBondContact O-CB 3.49Å; E501-M505 PolarHBondContact O-N 3.16Å; F502-M505 HydrophobicContact CD1-CE 3.65Å; F502-M505 HydrophobicContact CE1-CE 4.05Å; F502-M505 HydrophobicContact CG-CE 4.31Å; F502-M505 WeakPolarHBondContact O-CB 3.47Å; F502-M505 PolarHBondContact O-N 2.95Å; M505-H508 PolarHBondContact O-N 3.42Å; M505-L509 VanDerWaalsContact O-CB 3.31Å; M505-L509 WeakPolarHBondContact O-CB 3.36Å; M505-L509 PolarHBondContact O-N 3.32Å
506	L	87.7	Confident	88.6	Confident	87 Å²	87	68 Å²	68	46%	0.455	35%	0.347	S	S	.	.	H	α-helix	trans	-64.8	-41.6	-178.1	-72.5	173.1	0	0	0	111.7	F502 K503 L509 L510	F502-L506 WeakPolarHBondContact O-CB 3.49Å; F502-L506 VanDerWaalsContact O-CG 3.31Å; F502-L506 WeakPolarHBondContact O-CG 3.44Å; F502-L506 PolarHBondContact O-N 3.48Å; K503-L506 PolarHBondContact O-N 3.3Å; L506-L509 PolarHBondContact O-N 2.82Å; L506-L510 WeakPolarHBondContact O-CB 3.42Å; L506-L510 VanDerWaalsContact O-CG 3.25Å; L506-L510 WeakPolarHBondContact O-CG 3.39Å; L506-L510 PolarHBondContact O-N 3.31Å
507	I	89.9	Confident	87.9	Confident	77 Å²	77	68.4 Å²	68.4	40%	0.395	35%	0.35	S	S	.	.	H	α-helix	trans	-59.5	-51	173.9	-68.7	167.2	0	0	0	109.8	K503 L509 L510 E511	K503-I507 HydrophobicContact CG-CD1 3.91Å; K503-I507 VanDerWaalsContact O-CG1 3.28Å; K503-I507 WeakPolarHBondContact O-CG1 3.44Å; K503-I507 PolarHBondContact O-N 2.78Å; I507-L509 VanDerWaalsContact C-N 3.34Å; I507-L509 PolarHBondContact O-N 2.83Å; I507-L510 PolarHBondContact O-N 3Å; I507-E511 HydrophobicContact CG2-CG 4.39Å; I507-E511 WeakPolarHBondContact O-CG 3.33Å; I507-E511 PolarHBondContact O-N 3.11Å
508	H	92.4	Very high	87.4	Confident	90 Å²	90	70.9 Å²	70.9	42%	0.417	36%	0.361	S	S	.	.	H	α-helix	trans	-62.2	-40.5	-179	-172.3	47.5	0	0	0	112.5	I404 Q504 M505 E511 T512	I404-H508 WeakPolarHBondContact CD1-CD2 3.47Å; I404-H508 WeakPolarHBondContact CD1-NE2 3.45Å; Q504-H508 WeakPolarHBondContact O-CB 3.35Å; Q504-H508 PolarHBondContact O-N 3.04Å; M505-H508 PolarHBondContact O-N 3.42Å; H508-E511 PolarHBondContact O-N 3.4Å; H508-T512 WeakPolarHBondContact O-CG2 3.48Å; H508-T512 PolarHBondContact O-N 3.19Å; H508-T512 PolarHBondContact O-OG1 2.94Å
509	L	84.8	Confident	87	Confident	22 Å²	22	72.8 Å²	72.8	12%	0.115	37%	0.372	C	S	.	.	H	α-helix	trans	-60.1	-49.7	174.5	-178.5	67.2	0	0	0	111	D401 I404 L405 M505 L506 I507 E511 T512 V513	D401-L509 WeakPolarHBondContact OD1-CD1 3.24Å; I404-L509 HydrophobicContact CG2-CB 4.13Å; L405-L509 HydrophobicContact CB-CD1 4.43Å; L405-L509 HydrophobicContact CB-CD2 4.35Å; L405-L509 HydrophobicContact CD1-CD2 4.28Å; L405-L509 HydrophobicContact CD2-CD2 4.04Å; L405-L509 HydrophobicContact CG-CD2 4.46Å; M505-L509 VanDerWaalsContact O-CB 3.31Å; M505-L509 WeakPolarHBondContact O-CB 3.36Å; M505-L509 PolarHBondContact O-N 3.32Å; L506-L509 PolarHBondContact O-N 2.82Å; I507-L509 VanDerWaalsContact C-N 3.34Å; I507-L509 PolarHBondContact O-N 2.83Å; L509-E511 VanDerWaalsContact C-N 3.35Å; L509-E511 PolarHBondContact O-N 2.77Å; L509-T512 PolarHBondContact O-N 3.24Å; L509-T512 PolarHBondContact O-OG1 3.43Å; L509-V513 HydrophobicContact CD1-CG2 4.42Å; L509-V513 WeakPolarHBondContact O-CG2 3.41Å; L509-V513 PolarHBondContact O-N 2.99Å
510	L	86.2	Confident	86.2	Confident	122 Å²	122	70.4 Å²	70.4	64%	0.639	36%	0.358	S	S	*	.	H	α-helix	trans	-62.2	-41.2	179.7	-71.7	171.6	0	0	0	112.2	L506 I507 V513 A514	L506-L510 WeakPolarHBondContact O-CB 3.42Å; L506-L510 VanDerWaalsContact O-CG 3.25Å; L506-L510 WeakPolarHBondContact O-CG 3.39Å; L506-L510 PolarHBondContact O-N 3.31Å; I507-L510 PolarHBondContact O-N 3Å; L510-V513 PolarHBondContact O-N 3.23Å; L510-A514 VanDerWaalsContact O-CB 3.23Å; L510-A514 WeakPolarHBondContact O-CB 3.31Å; L510-A514 PolarHBondContact O-N 3.4Å
511	E	89.8	Confident	85.3	Confident	118 Å²	118	68.1 Å²	68.1	55%	0.551	35%	0.354	S	S	*	.	H	α-helix	trans	-60.4	-44.5	174.9	-72.9	171	166.5	0	0	111.7	I507 H508 L509 G515	I507-E511 HydrophobicContact CG2-CG 4.39Å; I507-E511 WeakPolarHBondContact O-CG 3.33Å; I507-E511 PolarHBondContact O-N 3.11Å; H508-E511 PolarHBondContact O-N 3.4Å; L509-E511 VanDerWaalsContact C-N 3.35Å; L509-E511 PolarHBondContact O-N 2.77Å; E511-G515 PolarHBondContact O-N 3Å
512	T	86.8	Confident	84.8	Confident	22 Å²	22	71.4 Å²	71.4	14%	0.135	37%	0.368	C	S	.	.	H	α-helix	trans	-67.4	-42.8	178.6	61.1	0	0	0	0	112.5	Q397 K400 I404 H508 L509 G515 T516	Q397-T512 PolarHBondContact OE1-O 3.09Å; K400-T512 HydrophobicContact CD-CG2 4.25Å; I404-T512 HydrophobicContact CD1-CG2 3.82Å; H508-T512 WeakPolarHBondContact O-CG2 3.48Å; H508-T512 PolarHBondContact O-N 3.19Å; H508-T512 PolarHBondContact O-OG1 2.94Å; L509-T512 PolarHBondContact O-N 3.24Å; L509-T512 PolarHBondContact O-OG1 3.43Å; T512-G515 PolarHBondContact O-N 3.2Å; T512-T516 PolarHBondContact O-N 3.33Å; T512-T516 PolarHBondContact O-OG1 3.01Å; T512-T516 VanDerWaalsContact O-OG1 3.1Å
513	V	82.9	Confident	83.9	Confident	49 Å²	49	70.5 Å²	70.5	30%	0.297	37%	0.366	S	S	.	.	H	α-helix	trans	-62.7	-46.4	176.5	171.9	0	0	0	0	110.7	L509 L510 T516 Q517	L509-V513 HydrophobicContact CD1-CG2 4.42Å; L509-V513 WeakPolarHBondContact O-CG2 3.41Å; L509-V513 PolarHBondContact O-N 2.99Å; L510-V513 PolarHBondContact O-N 3.23Å; V513-T516 PolarHBondContact O-N 3.41Å; V513-Q517 WeakPolarHBondContact O-CB 3.41Å; V513-Q517 PolarHBondContact O-N 2.92Å
514	A	79.9	Confident	82.5	Confident	59 Å²	59	64.7 Å²	64.7	49%	0.488	35%	0.345	S	S	.	.	H	α-helix	trans	-61.9	-44.6	177.4	0	0	0	0	0	111.7	L510 T516 Q517 Q518	L510-A514 VanDerWaalsContact O-CB 3.23Å; L510-A514 WeakPolarHBondContact O-CB 3.31Å; L510-A514 PolarHBondContact O-N 3.4Å; A514-T516 VanDerWaalsContact C-N 3.34Å; A514-T516 PolarHBondContact O-N 3.18Å; A514-Q517 PolarHBondContact O-N 2.8Å; A514-Q518 WeakPolarHBondContact O-CB 3.5Å; A514-Q518 PolarHBondContact O-N 2.96Å
515	G	84.4	Confident	80.9	Confident	26 Å²	26	64.8 Å²	64.8	27%	0.268	35%	0.346	S	S	.	.	H	α-helix	trans	-62.2	-38.7	177.3	0	0	0	0	0	113.1	E511 T512 Q519	E511-G515 PolarHBondContact O-N 3Å; T512-G515 PolarHBondContact O-N 3.2Å; G515-Q519 WeakPolarHBondContact O-CG 3.42Å; G515-Q519 PolarHBondContact O-N 2.93Å; G515-Q519 PolarHBondContact O-NE2 3.21Å; G515-Q519 VanDerWaalsContact O-NE2 3.16Å
516	T	80.9	Confident	79.1	Confident	12 Å²	12	69.4 Å²	69.4	7%	0.074	38%	0.378	C	S	.	.	H	α-helix	trans	-69.5	-44.6	174.4	-62.3	0	0	0	0	111.2	L393 Q397 T512 V513 A514 Q518 Q519 V520	L393-T516 HydrophobicContact CB-CG2 4.23Å; Q397-T516 HydrophobicContact CB-CG2 4.13Å; Q397-T516 HydrophobicContact CG-CG2 4.47Å; Q397-T516 VanDerWaalsContact OE1-CB 3.25Å; Q397-T516 PolarHBondContact OE1-OG1 3.12Å; T512-T516 PolarHBondContact O-N 3.33Å; T512-T516 PolarHBondContact O-OG1 3.01Å; T512-T516 VanDerWaalsContact O-OG1 3.1Å; V513-T516 PolarHBondContact O-N 3.41Å; A514-T516 VanDerWaalsContact C-N 3.34Å; A514-T516 PolarHBondContact O-N 3.18Å; T516-Q518 VanDerWaalsContact C-N 3.29Å; T516-Q518 PolarHBondContact O-N 3.28Å; T516-Q519 WeakPolarHBondContact O-CB 3.48Å; T516-Q519 PolarHBondContact O-N 3.28Å; T516-Q519 VanDerWaalsContact O-N 3.09Å; T516-V520 WeakPolarHBondContact O-CG2 3.5Å; T516-V520 PolarHBondContact O-N 3.09Å
517	Q	78.3	Confident	77.4	Confident	121 Å²	121	67.8 Å²	67.8	57%	0.565	37%	0.367	S	S	*	.	H	α-helix	trans	-60.5	-39.5	178.2	-174.2	60.1	32	0	0	111.9	V513 A514 Q519 V520 S521	V513-Q517 WeakPolarHBondContact O-CB 3.41Å; V513-Q517 PolarHBondContact O-N 2.92Å; A514-Q517 PolarHBondContact O-N 2.8Å; Q517-Q519 VanDerWaalsContact C-N 3.32Å; Q517-Q519 PolarHBondContact O-N 2.87Å; Q517-V520 PolarHBondContact O-N 2.98Å; Q517-S521 PolarHBondContact O-N 3.5Å
518	Q	81.2	Confident	75.5	Confident	113 Å²	113	70 Å²	70	53%	0.528	37%	0.374	S	S	.	.	H	α-helix	trans	-62.9	-38.5	175.5	-169.4	-177.2	15	0	0	112	A514 T516 S521 K522	A514-Q518 WeakPolarHBondContact O-CB 3.5Å; A514-Q518 PolarHBondContact O-N 2.96Å; T516-Q518 VanDerWaalsContact C-N 3.29Å; T516-Q518 PolarHBondContact O-N 3.28Å; Q518-S521 PolarHBondContact O-N 2.97Å; Q518-K522 WeakPolarHBondContact O-CG 3.4Å; Q518-K522 PolarHBondContact O-N 3.45Å
519	Q	83.9	Confident	73.4	Confident	94 Å²	94	71.2 Å²	71.2	44%	0.439	38%	0.384	S	S	.	.	H	α-helix	trans	-68.8	-39.7	176.5	-72.6	174.3	72.7	0	0	112	L393 G515 T516 Q517 K522 A523	L393-Q519 HydrophobicContact CD1-CB 3.76Å; L393-Q519 HydrophobicContact CD2-CB 4.13Å; G515-Q519 WeakPolarHBondContact O-CG 3.42Å; G515-Q519 PolarHBondContact O-N 2.93Å; G515-Q519 PolarHBondContact O-NE2 3.21Å; G515-Q519 VanDerWaalsContact O-NE2 3.16Å; T516-Q519 WeakPolarHBondContact O-CB 3.48Å; T516-Q519 PolarHBondContact O-N 3.28Å; T516-Q519 VanDerWaalsContact O-N 3.09Å; Q517-Q519 VanDerWaalsContact C-N 3.32Å; Q517-Q519 PolarHBondContact O-N 2.87Å; Q519-K522 PolarHBondContact O-N 2.95Å; Q519-A523 WeakPolarHBondContact O-CB 3.31Å; Q519-A523 PolarHBondContact O-N 3.1Å
520	V	76.5	Confident	71.5	Confident	37 Å²	37	75.3 Å²	75.3	22%	0.224	40%	0.401	C	S	.	.	H	α-helix	trans	-61.5	-43.9	173	173.6	0	0	0	0	110.9	V390 L393 T516 Q517 A523 G524	V390-V520 HydrophobicContact CG2-CG1 4.28Å; L393-V520 HydrophobicContact CB-CG2 4.43Å; L393-V520 HydrophobicContact CD1-CG2 3.95Å; T516-V520 WeakPolarHBondContact O-CG2 3.5Å; T516-V520 PolarHBondContact O-N 3.09Å; Q517-V520 PolarHBondContact O-N 2.98Å; V520-A523 PolarHBondContact O-N 3.41Å; V520-G524 PolarHBondContact O-N 3.13Å
521	S	72.9	Confident	69.5	Low	50 Å²	50	70.4 Å²	70.4	35%	0.35	38%	0.375	S	S	.	.	H	α-helix	trans	-60.8	-46.5	176.6	-151.5	0	0	0	0	111.7	Q517 Q518 A523 G524 E525	Q517-S521 PolarHBondContact O-N 3.5Å; Q518-S521 PolarHBondContact O-N 2.97Å; S521-A523 PolarHBondContact O-N 3.37Å; S521-G524 CarbonylContact O-C 3.56Å; S521-G524 WeakPolarHBondContact O-CA 3.43Å; S521-G524 PolarHBondContact O-N 3.49Å; S521-G524 VanDerWaalsContact O-N 3.16Å; S521-E525 WeakPolarHBondContact O-CB 3.28Å; S521-E525 WeakPolarHBondContact O-CG 3.45Å; S521-E525 PolarHBondContact O-N 2.82Å; S521-E525 PolarHBondContact OG-OE1 3.28Å
522	K	78.6	Confident	67.4	Low	112 Å²	112	72.6 Å²	72.6	49%	0.487	38%	0.379	S	S	.	.	H	α-helix	trans	-61.8	-41.7	177	-73.6	174.8	179.7	177.4	0	112.3	Q518 Q519 G524 C526	Q518-K522 WeakPolarHBondContact O-CG 3.4Å; Q518-K522 PolarHBondContact O-N 3.45Å; Q519-K522 PolarHBondContact O-N 2.95Å; K522-G524 VanDerWaalsContact C-N 3.29Å; K522-G524 PolarHBondContact O-N 2.7Å; K522-C526 WeakPolarHBondContact O-CB 3.48Å; K522-C526 PolarHBondContact O-N 3.42Å; K522-C526 VanDerWaalsContact O-N 3.14Å; K522-C526 PolarHBondContact O-SG 2.88Å
523	A	71.5	Confident	65.7	Low	12 Å²	12	77.6 Å²	77.6	10%	0.099	40%	0.401	C	S	.	.	H	α-helix	trans	-62.9	-39.3	175.7	0	0	0	0	0	111.4	T386 Q519 V520 S521	T386-A523 HydrophobicContact CG2-CB 4.29Å; T386-A523 WeakPolarHBondContact CG2-O 3.4Å; Q519-A523 WeakPolarHBondContact O-CB 3.31Å; Q519-A523 PolarHBondContact O-N 3.1Å; V520-A523 PolarHBondContact O-N 3.41Å; S521-A523 PolarHBondContact O-N 3.37Å
524	G	62	Low	64	Low	17 Å²	17	76.1 Å²	76.1	18%	0.175	39%	0.393	C	S	.	.	H	α-helix	trans	-65.4	-60.6	173.7	0	0	0	0	0	112.5	V520 S521 K522 C526 K527 F528	V520-G524 PolarHBondContact O-N 3.13Å; S521-G524 CarbonylContact O-C 3.56Å; S521-G524 WeakPolarHBondContact O-CA 3.43Å; S521-G524 PolarHBondContact O-N 3.49Å; S521-G524 VanDerWaalsContact O-N 3.16Å; K522-G524 VanDerWaalsContact C-N 3.29Å; K522-G524 PolarHBondContact O-N 2.7Å; G524-C526 PolarHBondContact O-N 3.4Å; G524-K527 PolarHBondContact O-N 3.18Å; G524-K527 VanDerWaalsContact O-N 3.14Å; G524-F528 VanDerWaalsContact O-CB 3.27Å; G524-F528 WeakPolarHBondContact O-CB 3.49Å; G524-F528 PolarHBondContact O-N 3.19Å
525	E	58.3	Low	62.6	Low	114 Å²	114	77.4 Å²	77.4	53%	0.533	39%	0.391	S	S	.	.	H	α-helix	trans	-60	-43.3	-173.2	-73.7	165.8	-149.1	0	0	113.4	S521 K527 N529	S521-E525 WeakPolarHBondContact O-CB 3.28Å; S521-E525 WeakPolarHBondContact O-CG 3.45Å; S521-E525 PolarHBondContact O-N 2.82Å; S521-E525 PolarHBondContact OG-OE1 3.28Å; E525-K527 PolarHBondContact O-N 2.95Å; E525-K527 VanDerWaalsContact O-N 3.14Å; E525-N529 PolarHBondContact O-N 2.98Å; E525-N529 PolarHBondContact O-ND2 3.07Å
526	C	51.7	Low	61.1	Low	103 Å²	103	78.6 Å²	78.6	70%	0.696	39%	0.394	S	S	*	.	H	α-helix	trans	-64.2	-20.3	-179.6	-74.6	0	0	0	0	113.1	K522 G524	K522-C526 WeakPolarHBondContact O-CB 3.48Å; K522-C526 PolarHBondContact O-N 3.42Å; K522-C526 VanDerWaalsContact O-N 3.14Å; K522-C526 PolarHBondContact O-SG 2.88Å; G524-C526 PolarHBondContact O-N 3.4Å
527	K	53.2	Low	60	Low	54 Å²	54	82.5 Å²	82.5	24%	0.235	41%	0.414	C	S	.	.	H	α-helix	trans	-120.5	-22.7	-174.7	-67.2	-178	174.2	-167.3	0	113.7	E385 T386 G524 E525 F530 L531	E385-K527 VanDerWaalsContact CB-NZ 3.34Å; E385-K527 IonicContact OE2-NZ 2.63Å; E385-K527 PolarHBondContact OE2-NZ 2.69Å; T386-K527 WeakPolarHBondContact OG1-CD 3.31Å; G524-K527 PolarHBondContact O-N 3.18Å; G524-K527 VanDerWaalsContact O-N 3.14Å; E525-K527 PolarHBondContact O-N 2.95Å; E525-K527 VanDerWaalsContact O-N 3.14Å; K527-F530 WeakPolarHBondContact O-CB 3.48Å; K527-F530 PolarHBondContact O-N 3.36Å; K527-L531 PolarHBondContact O-N 3.48Å
528	F	50	Low	58.7	Low	124 Å²	124	79.5 Å²	79.5	54%	0.544	40%	0.401	S	S	.	.	H	α-helix	trans	-69.9	-30.7	170.4	-101.3	-85.7	0	0	0	112.7	G524 F530 L531 Y532	G524-F528 VanDerWaalsContact O-CB 3.27Å; G524-F528 WeakPolarHBondContact O-CB 3.49Å; G524-F528 PolarHBondContact O-N 3.19Å; F528-F530 PolarHBondContact O-N 2.9Å; F528-L531 PolarHBondContact O-N 3.35Å; F528-Y532 WeakPolarHBondContact O-CB 3.33Å; F528-Y532 PolarHBondContact O-N 3.25Å
529	N	46.7	Very low	57.5	Low	115 Å²	115	80.5 Å²	80.5	62%	0.615	40%	0.404	S	S	*	.	H	α-helix	trans	-59.3	-37.8	169.7	-78.7	-28.8	0	0	0	111.2	E525 Y532 E533	E525-N529 PolarHBondContact O-N 2.98Å; E525-N529 PolarHBondContact O-ND2 3.07Å; N529-Y532 PolarHBondContact O-N 2.71Å; N529-E533 PolarHBondContact O-N 3.03Å; N529-E533 VanDerWaalsContact O-N 3.11Å
530	F	45.3	Very low	56.3	Low	107 Å²	107	82 Å²	82	47%	0.469	41%	0.412	S	S	.	.	H	α-helix	trans	-72.3	-37.6	177.5	-148.3	-90.6	0	0	0	112.7	L382 K527 F528 S534	L382-F530 HydrophobicContact CD1-CB 4.41Å; L382-F530 HydrophobicContact CD1-CD1 3.33Å; L382-F530 HydrophobicContact CD1-CE1 3.69Å; L382-F530 HydrophobicContact CD1-CG 3.94Å; K527-F530 WeakPolarHBondContact O-CB 3.48Å; K527-F530 PolarHBondContact O-N 3.36Å; F528-F530 PolarHBondContact O-N 2.9Å; F530-S534 VanDerWaalsContact O-CB 3.3Å; F530-S534 WeakPolarHBondContact O-CB 3.47Å; F530-S534 PolarHBondContact O-N 3.04Å; F530-S534 PolarHBondContact O-OG 3.34Å
531	L	44.2	Very low	55.2	Low	20 Å²	20	84.6 Å²	84.6	11%	0.105	42%	0.424	C	S	.	.	H	α-helix	trans	-68.5	-36.3	172.2	-82.2	156.9	0	0	0	112	A379 L383 K527 F528 S534 I535	A379-L531 HydrophobicContact CB-CD2 3.94Å; L383-L531 HydrophobicContact CB-CD1 4.29Å; L383-L531 HydrophobicContact CD1-CD1 4.09Å; K527-L531 PolarHBondContact O-N 3.48Å; F528-L531 PolarHBondContact O-N 3.35Å; L531-S534 PolarHBondContact O-N 3.15Å; L531-I535 HydrophobicContact CB-CD1 4.48Å; L531-I535 WeakPolarHBondContact O-CB 3.4Å; L531-I535 WeakPolarHBondContact O-CD1 3.49Å; L531-I535 WeakPolarHBondContact O-CG1 3.43Å; L531-I535 PolarHBondContact O-N 3.06Å
532	Y	47.2	Very low	54.4	Low	163 Å²	163	84.8 Å²	84.8	64%	0.639	43%	0.428	S	S	*	.	H	α-helix	trans	-65.2	-45.2	176.5	-170.6	-93.4	0	0	0	111.1	F528 N529 I535 C536	F528-Y532 WeakPolarHBondContact O-CB 3.33Å; F528-Y532 PolarHBondContact O-N 3.25Å; N529-Y532 PolarHBondContact O-N 2.71Å; Y532-I535 PolarHBondContact O-N 2.96Å; Y532-C536 WeakPolarHBondContact O-CB 3.48Å; Y532-C536 PolarHBondContact O-N 3.32Å; Y532-C536 PolarHBondContact O-SG 3.08Å
533	E	49.2	Very low	53.4	Low	128 Å²	128	85.6 Å²	85.6	60%	0.598	43%	0.431	S	S	*	.	H	α-helix	trans	-62.8	-43.3	173	-75.1	-172.7	162.5	0	0	112	N529 C536 I537	N529-E533 PolarHBondContact O-N 3.03Å; N529-E533 VanDerWaalsContact O-N 3.11Å; E533-C536 PolarHBondContact O-N 3.36Å; E533-I537 VanDerWaalsContact O-CG1 3.26Å; E533-I537 WeakPolarHBondContact O-CG1 3.19Å; E533-I537 PolarHBondContact O-N 3.32Å
534	S	47.5	Very low	52.8	Low	18 Å²	18	88.6 Å²	88.6	13%	0.126	45%	0.451	C	S	.	.	H	α-helix	trans	-68.1	-37.7	179	-60	0	0	0	0	112.9	F530 L531 I537 L538	F530-S534 VanDerWaalsContact O-CB 3.3Å; F530-S534 WeakPolarHBondContact O-CB 3.47Å; F530-S534 PolarHBondContact O-N 3.04Å; F530-S534 PolarHBondContact O-OG 3.34Å; L531-S534 PolarHBondContact O-N 3.15Å; S534-I537 PolarHBondContact O-N 3.3Å; S534-L538 WeakPolarHBondContact O-CB 3.43Å; S534-L538 WeakPolarHBondContact O-CG 3.28Å; S534-L538 PolarHBondContact O-N 3.31Å
535	I	51.2	Low	51.9	Low	85 Å²	85	96.8 Å²	96.8	44%	0.436	48%	0.476	S	S	.	.	H	α-helix	trans	-70.1	-38.8	174.7	-71.4	165.4	0	0	0	110.3	L531 Y532 I537 L538 F539	L531-I535 HydrophobicContact CB-CD1 4.48Å; L531-I535 WeakPolarHBondContact O-CB 3.4Å; L531-I535 WeakPolarHBondContact O-CD1 3.49Å; L531-I535 WeakPolarHBondContact O-CG1 3.43Å; L531-I535 PolarHBondContact O-N 3.06Å; Y532-I535 PolarHBondContact O-N 2.96Å; I535-I537 VanDerWaalsContact C-N 3.3Å; I535-I537 PolarHBondContact O-N 2.8Å; I535-L538 PolarHBondContact O-N 3.05Å; I535-F539 HydrophobicContact CG2-CD2 4.35Å; I535-F539 WeakPolarHBondContact O-CB 3.45Å; I535-F539 PolarHBondContact O-N 2.87Å
536	C	53.3	Low	51.8	Low	51 Å²	51	98.2 Å²	98.2	35%	0.345	48%	0.483	S	S	.	.	H	α-helix	trans	-60.3	-42.8	172.3	-72.9	0	0	0	0	110.8	Y532 E533 F539 Q540	Y532-C536 WeakPolarHBondContact O-CB 3.48Å; Y532-C536 PolarHBondContact O-N 3.32Å; Y532-C536 PolarHBondContact O-SG 3.08Å; E533-C536 PolarHBondContact O-N 3.36Å; C536-F539 PolarHBondContact O-N 3.42Å; C536-Q540 WeakPolarHBondContact O-CB 3.49Å; C536-Q540 PolarHBondContact O-N 2.96Å
537	I	56.4	Low	52.1	Low	95 Å²	95	98.5 Å²	98.5	49%	0.487	48%	0.482	S	S	.	.	H	α-helix	trans	-63.8	-43.3	174.9	-68.1	164.1	0	0	0	111	E533 S534 I535 Q540 L541	E533-I537 VanDerWaalsContact O-CG1 3.26Å; E533-I537 WeakPolarHBondContact O-CG1 3.19Å; E533-I537 PolarHBondContact O-N 3.32Å; S534-I537 PolarHBondContact O-N 3.3Å; I535-I537 VanDerWaalsContact C-N 3.3Å; I535-I537 PolarHBondContact O-N 2.8Å; I537-Q540 PolarHBondContact O-N 3.45Å; I537-L541 HydrophobicContact CG2-CD1 3.82Å; I537-L541 HydrophobicContact CG2-CG 4.39Å; I537-L541 WeakPolarHBondContact O-CB 3.33Å; I537-L541 VanDerWaalsContact O-CG 3.3Å; I537-L541 WeakPolarHBondContact O-CG 3.33Å; I537-L541 PolarHBondContact O-N 3.22Å
538	L	51.4	Low	51.8	Low	57 Å²	57	104.5 Å²	104.5	30%	0.298	51%	0.508	S	S	.	.	H	α-helix	trans	-66.1	-36.4	176.6	-74.6	167.1	0	0	0	112.6	L376 S534 I535 L541 A542	L376-L538 HydrophobicContact CD1-CD1 4Å; S534-L538 WeakPolarHBondContact O-CB 3.43Å; S534-L538 WeakPolarHBondContact O-CG 3.28Å; S534-L538 PolarHBondContact O-N 3.31Å; I535-L538 PolarHBondContact O-N 3.05Å; L538-L541 PolarHBondContact O-N 3.44Å; L538-A542 VanDerWaalsContact O-CB 3.26Å; L538-A542 WeakPolarHBondContact O-CB 3.47Å; L538-A542 PolarHBondContact O-N 3.16Å
539	F	56	Low	51.6	Low	135 Å²	135	102.7 Å²	102.7	59%	0.592	50%	0.503	S	S	*	.	H	α-helix	trans	-69.1	-37.8	173	-116.4	-86.9	0	0	0	112.1	I535 C536 K543	I535-F539 HydrophobicContact CG2-CD2 4.35Å; I535-F539 WeakPolarHBondContact O-CB 3.45Å; I535-F539 PolarHBondContact O-N 2.87Å; C536-F539 PolarHBondContact O-N 3.42Å; F539-K543 WeakPolarHBondContact O-CB 3.21Å; F539-K543 PolarHBondContact O-N 2.96Å
540	Q	59	Low	51.7	Low	126 Å²	126	102.1 Å²	102.1	59%	0.589	51%	0.506	S	S	*	.	H	α-helix	trans	-65.3	-42.5	173.6	-127.5	78.5	-19.3	0	0	110.8	C536 I537 K543 C544	C536-Q540 WeakPolarHBondContact O-CB 3.49Å; C536-Q540 PolarHBondContact O-N 2.96Å; I537-Q540 PolarHBondContact O-N 3.45Å; Q540-K543 PolarHBondContact O-N 2.92Å; Q540-C544 WeakPolarHBondContact O-CB 2.99Å; Q540-C544 PolarHBondContact O-N 3.34Å; Q540-C544 PolarHBondContact O-SG 3.24Å; Q540-C544 VanDerWaalsContact O-SG 3.34Å
541	L	54.1	Low	51.9	Low	91 Å²	91	103 Å²	103	48%	0.476	52%	0.515	S	S	.	.	H	α-helix	trans	-67.7	-41.1	176.7	-76	168.3	0	0	0	111.8	I537 L538 C544 W545	I537-L541 HydrophobicContact CG2-CD1 3.82Å; I537-L541 HydrophobicContact CG2-CG 4.39Å; I537-L541 WeakPolarHBondContact O-CB 3.33Å; I537-L541 VanDerWaalsContact O-CG 3.3Å; I537-L541 WeakPolarHBondContact O-CG 3.33Å; I537-L541 PolarHBondContact O-N 3.22Å; L538-L541 PolarHBondContact O-N 3.44Å; L541-C544 CarbonylContact O-C 3.55Å; L541-C544 PolarHBondContact O-N 3.13Å; L541-W545 VanDerWaalsContact O-CB 3.31Å; L541-W545 WeakPolarHBondContact O-CB 3.44Å; L541-W545 PolarHBondContact O-N 2.95Å
542	A	55.2	Low	52	Low	53 Å²	53	104.6 Å²	104.6	44%	0.438	53%	0.532	S	S	.	.	H	α-helix	trans	-63.1	-41	174.7	0	0	0	0	0	111.9	L538 W545 E546	L538-A542 VanDerWaalsContact O-CB 3.26Å; L538-A542 WeakPolarHBondContact O-CB 3.47Å; L538-A542 PolarHBondContact O-N 3.16Å; A542-W545 PolarHBondContact O-N 3.46Å; A542-E546 PolarHBondContact O-N 3.05Å
543	K	59	Low	52.1	Low	130 Å²	130	107.7 Å²	107.7	57%	0.565	54%	0.542	S	S	*	.	H	α-helix	trans	-66.6	-38.1	173	-81.6	-177.4	174.5	177.1	0	113.1	F539 Q540 W545 T547	F539-K543 WeakPolarHBondContact O-CB 3.21Å; F539-K543 PolarHBondContact O-N 2.96Å; Q540-K543 PolarHBondContact O-N 2.92Å; K543-W545 VanDerWaalsContact C-N 3.3Å; K543-T547 PolarHBondContact O-N 3.22Å; K543-T547 PolarHBondContact O-OG1 3.4Å
544	C	57.7	Low	52.1	Low	75 Å²	75	105.8 Å²	105.8	51%	0.507	55%	0.548	S	S	.	.	H	α-helix	trans	-66.3	-33.4	172.2	-76.4	0	0	0	0	111.6	Q540 L541 T547 F548	Q540-C544 WeakPolarHBondContact O-CB 2.99Å; Q540-C544 PolarHBondContact O-N 3.34Å; Q540-C544 PolarHBondContact O-SG 3.24Å; Q540-C544 VanDerWaalsContact O-SG 3.34Å; L541-C544 CarbonylContact O-C 3.55Å; L541-C544 PolarHBondContact O-N 3.13Å; C544-T547 VanDerWaalsContact CA-OG1 3.3Å; C544-T547 WeakPolarHBondContact CA-OG1 3.45Å; C544-T547 PolarHBondContact O-N 3.15Å; C544-T547 PolarHBondContact O-OG1 3.43Å; C544-F548 WeakPolarHBondContact O-CB 3.3Å; C544-F548 PolarHBondContact O-N 3Å; C544-F548 VanDerWaalsContact O-N 3.14Å
545	W	44.3	Very low	52.2	Low	188 Å²	188	112 Å²	112	71%	0.712	58%	0.578	S	S	*	*	H	α-helix	trans	-73.7	-39.8	177.6	-158	-87.4	0	0	0	112.2	L541 A542 K543 T547 F548 I549	L541-W545 VanDerWaalsContact O-CB 3.31Å; L541-W545 WeakPolarHBondContact O-CB 3.44Å; L541-W545 PolarHBondContact O-N 2.95Å; A542-W545 PolarHBondContact O-N 3.46Å; K543-W545 VanDerWaalsContact C-N 3.3Å; W545-T547 PolarHBondContact O-N 3.31Å; W545-F548 PolarHBondContact O-N 3.01Å; W545-F548 VanDerWaalsContact O-N 3.16Å; W545-I549 PolarHBondContact O-N 3.48Å
546	E	55.1	Low	51.7	Low	145 Å²	145	118.2 Å²	118.2	68%	0.678	61%	0.612	S	S	*	*	H	α-helix	trans	-65.3	-25.3	172.7	-77.2	-169.8	156.1	0	0	113.1	A542	A542-E546 PolarHBondContact O-N 3.05Å
547	T	57.9	Low	51.6	Low	108 Å²	108	121.6 Å²	121.6	66%	0.663	63%	0.625	S	S	*	*	H	α-helix	trans	-85	-20.3	173.5	36.1	0	0	0	0	113.4	K543 C544 W545	K543-T547 PolarHBondContact O-N 3.22Å; K543-T547 PolarHBondContact O-OG1 3.4Å; C544-T547 VanDerWaalsContact CA-OG1 3.3Å; C544-T547 WeakPolarHBondContact CA-OG1 3.45Å; C544-T547 PolarHBondContact O-N 3.15Å; C544-T547 PolarHBondContact O-OG1 3.43Å; W545-T547 PolarHBondContact O-N 3.31Å
548	F	46.3	Very low	51.3	Low	181 Å²	181	123 Å²	123	79%	0.794	63%	0.632	S	S	*	*	H	α-helix	trans	-87.5	-14.7	-177.8	-145.9	-98.5	0	0	0	114.1	C544 W545	C544-F548 WeakPolarHBondContact O-CB 3.3Å; C544-F548 PolarHBondContact O-N 3Å; C544-F548 VanDerWaalsContact O-N 3.14Å; W545-F548 PolarHBondContact O-N 3.01Å; W545-F548 VanDerWaalsContact O-N 3.16Å
549	I	46.5	Very low	51.3	Low	86 Å²	86	126.7 Å²	126.7	44%	0.441	65%	0.651	S	S	.	*			trans	-131.4	81.8	177	-49.8	179.7	0	0	0	110.8	W545 D551 A552	W545-I549 PolarHBondContact O-N 3.48Å; I549-D551 PolarHBondContact O-N 3.01Å; I549-A552 HydrophobicContact CG2-CB 3.58Å
550	P	49.8	Very low	51	Low	102 Å²	102	126.2 Å²	126.2	66%	0.662	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	-21.4	173.7	-17.5	31.6	0	0	0	113.6
551	D	49.1	Very low	50.5	Low	126 Å²	126	126.2 Å²	126.2	67%	0.674	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.4	-4.9	-167.3	-71.9	-24.6	0	0	0	115.3	I549 R553 A554	I549-D551 PolarHBondContact O-N 3.01Å; D551-R553 VanDerWaalsContact C-N 3.29Å; D551-R553 PolarHBondContact O-N 3.19Å; D551-A554 PolarHBondContact O-N 3.36Å
552	A	46.7	Very low	50.3	Low	54 Å²	54	128.5 Å²	128.5	45%	0.446	67%	0.671	S	S	.	*	G	3₁₀ helix	trans	-73.4	-17.6	-177.7	0	0	0	0	0	114	I549 A554	I549-A552 HydrophobicContact CG2-CB 3.58Å; A552-A554 PolarHBondContact O-N 3.43Å
553	R	49.1	Very low	50	Low	227 Å²	227	133.9 Å²	133.9	86%	0.857	69%	0.687	S	S	*	*	G	3₁₀ helix	trans	-77.5	-3	175.8	-81.3	-174.1	175.2	167.3	2.8	114.3	D551	D551-R553 VanDerWaalsContact C-N 3.29Å; D551-R553 PolarHBondContact O-N 3.19Å
554	A	49.2	Very low	49.3	Very low	88 Å²	88	134.2 Å²	134.2	73%	0.727	70%	0.697	S	S	*	*	G	3₁₀ helix	trans	-104.1	-0.8	179.1	0	0	0	0	0	114	D551 A552	D551-A554 PolarHBondContact O-N 3.36Å; A552-A554 PolarHBondContact O-N 3.43Å
555	I	48.4	Very low	48.6	Very low	148 Å²	148	139.2 Å²	139.2	76%	0.759	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119	-9.7	-172.3	-61.2	177.4	0	0	0	112.9
556	L	40.1	Very low	48.9	Very low	217 Å²	217	134.7 Å²	134.7	100%	1.136	71%	0.712	S	S	*	*			trans	-117.9	0	170.9	-74.1	165.6	0	0	0	109.2

Retrieved 556 of 556 residues in 301.4 ms (Link to these results)

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