A0A077Z6H7_TRITR Loading...

MICOS complex subunit MIC60

Component of the MICOS complex, a large protein complex of the mitochondrial inner membrane that plays crucial roles in the maintenance of crista junctions, inner membrane architecture, and formation of contact sites to the outer membrane.

AlphaFold DB , UniProt , Accession A0A077Z6H7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 710 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.9	Very low	36.5	Very low	236 Å²	236	164.1 Å²	164.1	100%	1.163	81%	0.81	S	S	*	*				0	61	0	-167.9	-169.5	-71.8	0	0	110.1
2	F	37.6	Very low	36.3	Very low	193 Å²	193	157 Å²	157	85%	0.846	79%	0.788	S	S	*	*			trans	-157.9	83.5	169.5	-110	-81.4	0	0	0	106.6	I5	F2-I5 HydrophobicContact CE1-CD1 4.43Å
3	R	39.1	Very low	36.3	Very low	226 Å²	226	159.8 Å²	159.8	85%	0.853	79%	0.792	S	S	*	*			trans	-72.7	179.9	160.9	-76.5	177.6	170.9	165.7	-4	108
4	L	36	Very low	36.6	Very low	152 Å²	152	156.1 Å²	156.1	80%	0.796	79%	0.789	S	S	*	*			trans	86.1	3.9	148.3	-76	143.4	0	0	0	121.7
5	I	40.1	Very low	36.6	Very low	130 Å²	130	153.3 Å²	153.3	67%	0.667	79%	0.788	S	S	*	*			trans	-123.2	119.1	177.9	-54.6	178.9	0	0	0	110.7	F2	F2-I5 HydrophobicContact CE1-CD1 4.43Å
6	L	43.8	Very low	36.7	Very low	160 Å²	160	152.1 Å²	152.1	84%	0.838	78%	0.783	S	S	*	*			trans	75.2	93	-176.3	-55.7	151.7	0	0	0	115.4
7	R	32.5	Very low	36.8	Very low	213 Å²	213	152.2 Å²	152.2	80%	0.804	78%	0.784	S	S	*	*			cis	55	121.1	1.6	-107.3	-169.7	-174.2	-172.5	2.6	119.1
8	C	30.5	Very low	36.9	Very low	109 Å²	109	148.8 Å²	148.8	74%	0.736	78%	0.783	S	S	*	*			trans	81.6	61.4	152	-52.5	0	0	0	0	119.6
9	S	36.4	Very low	36.8	Very low	94 Å²	94	149 Å²	149	66%	0.657	78%	0.784	S	S	*	*			trans	173.7	119.3	148.7	47.3	0	0	0	0	106.4
10	D	38.7	Very low	36.6	Very low	150 Å²	150	153.8 Å²	153.8	80%	0.802	79%	0.791	S	S	*	*			cis	-128.1	133.1	14.7	-58.3	-54.3	0	0	0	109.8
11	L	32.1	Very low	36.4	Very low	142 Å²	142	152.7 Å²	152.7	74%	0.743	79%	0.791	S	S	*	*				56.3	70.5	52.6	-80.5	157	0	0	0	114.5
12	S	34.1	Very low	36.7	Very low	79 Å²	79	147.1 Å²	147.1	55%	0.552	77%	0.773	S	S	*	*				63.2	128.4	113.5	70.8	0	0	0	0	119.8
13	K	36.7	Very low	36.6	Very low	194 Å²	194	142.9 Å²	142.9	84%	0.843	77%	0.774	S	S	*	*				178.5	161.5	114.2	-92.7	150.1	-170.6	175.4	0	111.3
14	S	40	Very low	36.2	Very low	107 Å²	107	138.4 Å²	138.4	75%	0.748	78%	0.777	S	S	*	*			trans	76.6	89.7	166.7	-49.7	0	0	0	0	116
15	C	36.3	Very low	36.1	Very low	115 Å²	115	135 Å²	135	78%	0.777	78%	0.778	S	S	*	*				83.5	142.6	68.3	-69	0	0	0	0	113.7
16	L	38.1	Very low	35.7	Very low	134 Å²	134	138.1 Å²	138.1	70%	0.702	79%	0.79	S	S	*	*			cis	-169.8	144.8	-11.3	-108.4	168.9	0	0	0	108.5
17	L	39.3	Very low	35.3	Very low	153 Å²	153	138.5 Å²	138.5	80%	0.801	79%	0.791	S	S	*	*			trans	66.8	154.4	155	-57.6	163.4	0	0	0	118
18	A	38.1	Very low	35.3	Very low	92 Å²	92	132.4 Å²	132.4	76%	0.76	79%	0.786	S	S	*	*			cis	-143.3	163.8	7.8	0	0	0	0	0	113.8
19	N	34.2	Very low	35.3	Very low	152 Å²	152	133.7 Å²	133.7	81%	0.813	79%	0.79	S	S	*	*			trans	-80.7	151.2	-179.4	-56.6	-70.9	0	0	0	114.5
20	R	33.9	Very low	35.2	Very low	245 Å²	245	136 Å²	136	93%	0.925	80%	0.8	S	S	*	*				163.4	160.9	102.7	-106.9	175.8	178.8	171.2	-0.9	113.4
21	V	32.6	Very low	34.8	Very low	131 Å²	131	131.6 Å²	131.6	79%	0.794	79%	0.79	S	S	*	*			trans	-137.7	172.8	-171.7	-175.7	0	0	0	0	106.8
22	P	40.8	Very low	35	Very low	119 Å²	119	136 Å²	136	77%	0.773	80%	0.799	S	S	*	*				-115.2	-176.7	-53.8	38.5	-24.4	0	0	0	112.5
23	A	35.5	Very low	34.8	Very low	104 Å²	104	137.8 Å²	137.8	86%	0.86	81%	0.811	S	S	*	*			trans	-174.4	155.4	142.4	0	0	0	0	0	113.4
24	S	30.1	Very low	34.4	Very low	132 Å²	132	132.6 Å²	132.6	92%	0.923	81%	0.812	S	S	*	*			trans	-81.9	158.8	-177.5	-48.6	0	0	0	0	114.7
25	G	34	Very low	33.9	Very low	80 Å²	80	131.2 Å²	131.2	83%	0.825	82%	0.815	S	S	*	*			trans	-160.7	126.7	166.3	0	0	0	0	0	113.4
26	Q	31.4	Very low	33.5	Very low	196 Å²	196	130.8 Å²	130.8	92%	0.916	81%	0.814	S	S	*	*			trans	-99.2	133.9	174.9	-68.1	177.6	-21.6	0	0	111.3
27	I	36.5	Very low	33	Very low	168 Å²	168	131.3 Å²	131.3	86%	0.862	82%	0.822	S	S	*	*			trans	-152.4	114.3	156.6	-54.7	-176.6	0	0	0	104.6
28	A	31.9	Very low	32.5	Very low	85 Å²	85	127.5 Å²	127.5	70%	0.702	82%	0.819	S	S	*	*			cis	102.4	110.1	43.7	0	0	0	0	0	113.3
29	V	31.2	Very low	32.2	Very low	135 Å²	135	128.2 Å²	128.2	82%	0.818	82%	0.819	S	S	*	*			trans	50.9	116.5	143	-170.2	0	0	0	0	120.6
30	V	34	Very low	32.1	Very low	142 Å²	142	127 Å²	127	86%	0.861	82%	0.82	S	S	*	*				-137.8	130.5	127.3	-179.7	0	0	0	0	107.7
31	G	30.3	Very low	32.1	Very low	58 Å²	58	117.5 Å²	117.5	60%	0.598	80%	0.798	S	S	*	*			trans	-114	165	177.6	0	0	0	0	0	112.6
32	Y	35.1	Very low	32.4	Very low	236 Å²	236	119.6 Å²	119.6	93%	0.925	80%	0.796	S	S	*	*			trans	-142.6	137.4	158.3	-104.9	-83.6	0	0	0	109.4
33	S	29.8	Very low	32.3	Very low	116 Å²	116	124.7 Å²	124.7	81%	0.811	80%	0.8	S	S	*	*			trans	-110	153.8	-172.7	55.4	0	0	0	0	112.5
34	G	30	Very low	32.8	Very low	84 Å²	84	122.8 Å²	122.8	87%	0.866	78%	0.781	S	S	*	*			trans	86	153.8	162.2	0	0	0	0	0	115.8
35	G	28.7	Very low	33.5	Very low	79 Å²	79	119.6 Å²	119.6	81%	0.814	76%	0.762	S	S	*	*			trans	126.9	76.5	170.3	0	0	0	0	0	115.1
36	S	27.8	Very low	34	Very low	106 Å²	106	119.9 Å²	119.9	74%	0.741	74%	0.744	S	S	*	*			trans	-42.7	145.9	161.6	-173	0	0	0	0	114.7
37	V	28.5	Very low	34.5	Very low	145 Å²	145	117.7 Å²	117.7	88%	0.879	73%	0.727	S	S	*	*			trans	52	111	150.1	174.7	0	0	0	0	118.1
38	G	28.9	Very low	35.2	Very low	72 Å²	72	116.6 Å²	116.6	74%	0.742	72%	0.717	S	S	*	*			trans	169.1	98.8	163.3	0	0	0	0	0	114.1
39	S	31.4	Very low	35.8	Very low	108 Å²	108	118.7 Å²	118.7	76%	0.755	71%	0.71	S	S	*	*			trans	-72.5	127.2	162.9	-169.8	0	0	0	0	107.9
40	P	31.4	Very low	36.5	Very low	127 Å²	127	114 Å²	114	83%	0.825	68%	0.682	S	S	*	*				-145	143	95.1	36	-20.5	0	0	0	113.8
41	G	34.9	Very low	37.2	Very low	45 Å²	45	114.3 Å²	114.3	46%	0.464	67%	0.668	S	S	.	*			trans	167.9	-11.7	173.1	0	0	0	0	0	117.8	R43 S44	G41-R43 PolarHBondContact O-N 3.43Å; G41-S44 WeakPolarHBondContact O-CB 3.45Å; G41-S44 PolarHBondContact O-N 3.29Å
42	K	38.9	Very low	37.9	Very low	174 Å²	174	117.6 Å²	117.6	76%	0.757	67%	0.666	S	S	*	*	H	α-helix	trans	-52.9	-30.3	-174.3	-72.7	-174.4	175.5	-178.8	0	114.5	S44 L46	K42-S44 PolarHBondContact O-N 3.08Å; K42-L46 WeakPolarHBondContact O-CB 3.44Å; K42-L46 PolarHBondContact O-N 3.47Å; K42-L46 VanDerWaalsContact O-N 3.09Å
43	R	38.9	Very low	38.4	Very low	226 Å²	226	111.1 Å²	111.1	85%	0.853	65%	0.647	S	S	*	*	H	α-helix	trans	-66.5	-29.6	174.7	-70.6	-175.2	175.7	-178.9	-2.2	114.1	G41 R47	G41-R43 PolarHBondContact O-N 3.43Å; R43-R47 WeakPolarHBondContact O-CB 3.41Å; R43-R47 PolarHBondContact O-N 3.08Å
44	S	46	Very low	39.1	Very low	65 Å²	65	110.1 Å²	110.1	46%	0.455	64%	0.636	S	S	.	*	H	α-helix	trans	-73.7	-46.4	177	178.5	0	0	0	0	111.5	G41 K42 L46 R47 K48	G41-S44 WeakPolarHBondContact O-CB 3.45Å; G41-S44 PolarHBondContact O-N 3.29Å; K42-S44 PolarHBondContact O-N 3.08Å; S44-L46 VanDerWaalsContact C-N 3.34Å; S44-L46 PolarHBondContact O-N 3.12Å; S44-R47 PolarHBondContact O-N 2.86Å; S44-K48 WeakPolarHBondContact O-CB 3.4Å; S44-K48 VanDerWaalsContact O-CG 3.32Å; S44-K48 WeakPolarHBondContact O-CG 3.32Å; S44-K48 PolarHBondContact O-N 3.48Å
45	A	44.4	Very low	39.4	Very low	65 Å²	65	109.1 Å²	109.1	54%	0.537	63%	0.625	S	S	.	*	H	α-helix	trans	-61.7	-42.2	175.9	0	0	0	0	0	111.7	K48 F49	A45-K48 PolarHBondContact O-N 3.22Å; A45-F49 WeakPolarHBondContact O-CB 3.43Å; A45-F49 PolarHBondContact O-N 3.18Å
46	L	44.2	Very low	39.8	Very low	85 Å²	85	109 Å²	109	45%	0.445	61%	0.609	S	S	.	*	H	α-helix	trans	-72.6	-36.6	-179.4	-137.9	133.9	0	0	0	112.4	K42 S44 F49 V50 I94	K42-L46 WeakPolarHBondContact O-CB 3.44Å; K42-L46 PolarHBondContact O-N 3.47Å; K42-L46 VanDerWaalsContact O-N 3.09Å; S44-L46 VanDerWaalsContact C-N 3.34Å; S44-L46 PolarHBondContact O-N 3.12Å; L46-F49 PolarHBondContact O-N 3.07Å; L46-V50 HydrophobicContact CD2-CG2 4.48Å; L46-V50 WeakPolarHBondContact O-CG2 3.49Å; L46-V50 PolarHBondContact O-N 2.95Å; L46-I94 HydrophobicContact CD2-CD1 3.74Å; L46-I94 HydrophobicContact CD2-CG2 4.03Å
47	R	42.7	Very low	40	Very low	150 Å²	150	107.1 Å²	107.1	57%	0.566	61%	0.606	S	S	*	*	H	α-helix	trans	-58.9	-47.9	166.9	-89.1	-173.3	169	-174.2	-3.2	111.6	R43 S44 F49 V50 Y51	R43-R47 WeakPolarHBondContact O-CB 3.41Å; R43-R47 PolarHBondContact O-N 3.08Å; S44-R47 PolarHBondContact O-N 2.86Å; R47-F49 VanDerWaalsContact C-N 3.29Å; R47-F49 PolarHBondContact O-N 3.11Å; R47-V50 PolarHBondContact O-N 3.39Å; R47-Y51 HydrophobicContact CB-CD2 4.44Å; R47-Y51 HydrophobicContact CB-CE2 4.48Å; R47-Y51 WeakPolarHBondContact O-CD2 3.42Å; R47-Y51 PolarHBondContact O-N 3.35Å
48	K	50.9	Low	40.3	Very low	146 Å²	146	108.8 Å²	108.8	64%	0.635	60%	0.602	S	S	*	*	H	α-helix	trans	-60.3	-37.8	177.3	-73.1	175.1	-179.7	-173.3	0	112.2	S44 A45 F52	S44-K48 WeakPolarHBondContact O-CB 3.4Å; S44-K48 VanDerWaalsContact O-CG 3.32Å; S44-K48 WeakPolarHBondContact O-CG 3.32Å; S44-K48 PolarHBondContact O-N 3.48Å; A45-K48 PolarHBondContact O-N 3.22Å; K48-F52 WeakPolarHBondContact O-CB 3.48Å; K48-F52 PolarHBondContact O-N 3.13Å
49	F	43.5	Very low	40.6	Very low	128 Å²	128	112.6 Å²	112.6	56%	0.561	60%	0.603	S	S	*	*	H	α-helix	trans	-70.6	-37.9	177	-164.6	-107.9	0	0	0	112.6	A45 L46 R47 F52 I53	A45-F49 WeakPolarHBondContact O-CB 3.43Å; A45-F49 PolarHBondContact O-N 3.18Å; L46-F49 PolarHBondContact O-N 3.07Å; R47-F49 VanDerWaalsContact C-N 3.29Å; R47-F49 PolarHBondContact O-N 3.11Å; F49-F52 WeakPolarHBondContact O-CB 3.42Å; F49-F52 PolarHBondContact O-N 3.06Å; F49-I53 HydrophobicContact CD1-CD1 3.69Å; F49-I53 HydrophobicContact CE1-CD1 3.54Å; F49-I53 HydrophobicContact CE1-CG1 4.49Å; F49-I53 HydrophobicContact CZ-CD1 4.25Å; F49-I53 WeakPolarHBondContact O-CG1 3.27Å; F49-I53 PolarHBondContact O-N 3.33Å
50	V	47.5	Very low	40.6	Very low	37 Å²	37	113.5 Å²	113.5	22%	0.224	61%	0.61	C	S	.	*	H	α-helix	trans	-67.9	-43.2	172.1	171.5	0	0	0	0	111.2	L46 R47 F52 I53 V54 I94	L46-V50 HydrophobicContact CD2-CG2 4.48Å; L46-V50 WeakPolarHBondContact O-CG2 3.49Å; L46-V50 PolarHBondContact O-N 2.95Å; R47-V50 PolarHBondContact O-N 3.39Å; V50-F52 VanDerWaalsContact C-N 3.25Å; V50-F52 PolarHBondContact O-N 3.19Å; V50-I53 PolarHBondContact O-N 3.01Å; V50-V54 HydrophobicContact CG1-CG2 4.4Å; V50-V54 WeakPolarHBondContact O-CB 3.37Å; V50-V54 WeakPolarHBondContact O-CG2 3.41Å; V50-V54 PolarHBondContact O-N 3.38Å; V50-I94 HydrophobicContact CG2-CG2 4.03Å
51	Y	48.6	Very low	40.8	Very low	149 Å²	149	109.8 Å²	109.8	58%	0.584	59%	0.594	S	S	*	*	H	α-helix	trans	-61.6	-32.3	171.7	-80.5	-63.4	0	0	0	112.7	R47 G55	R47-Y51 HydrophobicContact CB-CD2 4.44Å; R47-Y51 HydrophobicContact CB-CE2 4.48Å; R47-Y51 WeakPolarHBondContact O-CD2 3.42Å; R47-Y51 PolarHBondContact O-N 3.35Å; Y51-G55 WeakPolarHBondContact O-CA 3.45Å; Y51-G55 PolarHBondContact O-N 3.05Å
52	F	45	Very low	41.3	Very low	126 Å²	126	112 Å²	112	55%	0.553	60%	0.603	S	S	*	*	H	α-helix	trans	-67.5	-50.9	172.9	-173.2	-101.1	0	0	0	110.9	K48 F49 V50 V54 G55 T56	K48-F52 WeakPolarHBondContact O-CB 3.48Å; K48-F52 PolarHBondContact O-N 3.13Å; F49-F52 WeakPolarHBondContact O-CB 3.42Å; F49-F52 PolarHBondContact O-N 3.06Å; V50-F52 VanDerWaalsContact C-N 3.25Å; V50-F52 PolarHBondContact O-N 3.19Å; F52-V54 VanDerWaalsContact C-N 3.28Å; F52-V54 PolarHBondContact O-N 3.12Å; F52-G55 PolarHBondContact O-N 3.29Å; F52-G55 VanDerWaalsContact O-N 3.16Å; F52-T56 HydrophobicContact CD2-CG2 4.41Å; F52-T56 HydrophobicContact CE2-CG2 4.14Å; F52-T56 PolarHBondContact O-N 2.81Å; F52-T56 PolarHBondContact O-OG1 3.32Å
53	I	44.2	Very low	42.1	Very low	100 Å²	100	107.7 Å²	107.7	51%	0.513	59%	0.591	S	S	.	*	H	α-helix	trans	-59.6	-36.1	177.7	-70	166	0	0	0	112.5	F49 V50	F49-I53 HydrophobicContact CD1-CD1 3.69Å; F49-I53 HydrophobicContact CE1-CD1 3.54Å; F49-I53 HydrophobicContact CE1-CG1 4.49Å; F49-I53 HydrophobicContact CZ-CD1 4.25Å; F49-I53 WeakPolarHBondContact O-CG1 3.27Å; F49-I53 PolarHBondContact O-N 3.33Å; V50-I53 PolarHBondContact O-N 3.01Å
54	V	44	Very low	43.1	Very low	96 Å²	96	100.5 Å²	100.5	58%	0.582	57%	0.572	S	S	*	*	H	α-helix	trans	-81.1	-30.3	177.5	174.6	0	0	0	0	112.4	V50 F52	V50-V54 HydrophobicContact CG1-CG2 4.4Å; V50-V54 WeakPolarHBondContact O-CB 3.37Å; V50-V54 WeakPolarHBondContact O-CG2 3.41Å; V50-V54 PolarHBondContact O-N 3.38Å; F52-V54 VanDerWaalsContact C-N 3.28Å; F52-V54 PolarHBondContact O-N 3.12Å
55	G	36.6	Very low	43.8	Very low	62 Å²	62	99.4 Å²	99.4	64%	0.639	57%	0.571	S	S	*	*	H	α-helix	trans	-88.4	-33.5	-175.9	0	0	0	0	0	115	Y51 F52	Y51-G55 WeakPolarHBondContact O-CA 3.45Å; Y51-G55 PolarHBondContact O-N 3.05Å; F52-G55 PolarHBondContact O-N 3.29Å; F52-G55 VanDerWaalsContact O-N 3.16Å
56	T	37.2	Very low	44.7	Very low	78 Å²	78	102.1 Å²	102.1	48%	0.479	57%	0.568	S	S	.	*	S	Bend	trans	-106.3	76.6	174.2	57.6	0	0	0	0	109.7	F52 F58	F52-T56 HydrophobicContact CD2-CG2 4.41Å; F52-T56 HydrophobicContact CE2-CG2 4.14Å; F52-T56 PolarHBondContact O-N 2.81Å; F52-T56 PolarHBondContact O-OG1 3.32Å; T56-F58 PolarHBondContact O-N 3.46Å
57	G	33	Very low	45.7	Very low	65 Å²	65	98.2 Å²	98.2	67%	0.67	55%	0.548	S	S	*	.			trans	-61	109.5	168.3	0	0	0	0	0	109.7
58	F	33.4	Very low	46.8	Very low	181 Å²	181	94 Å²	94	79%	0.794	54%	0.537	S	S	*	.			trans	-167.6	115.4	152.3	-120	-130.3	0	0	0	111.5	T56 S60	T56-F58 PolarHBondContact O-N 3.46Å; F58-S60 PolarHBondContact O-N 3.12Å; F58-S60 VanDerWaalsContact O-N 3.14Å
59	I	35.1	Very low	47.4	Very low	152 Å²	152	92.6 Å²	92.6	78%	0.779	53%	0.528	S	S	*	.	S	Bend	trans	79	-34.8	143.4	-59.3	-177.8	0	0	0	121.3
60	S	32.3	Very low	48.7	Very low	127 Å²	127	88.8 Å²	88.8	89%	0.888	51%	0.514	S	S	*	.	S	Bend	trans	-96.5	1	-168.6	63.9	0	0	0	0	118.6	F58	F58-S60 PolarHBondContact O-N 3.12Å; F58-S60 VanDerWaalsContact O-N 3.14Å
61	G	35.2	Very low	49.9	Very low	49 Å²	49	91.5 Å²	91.5	51%	0.505	53%	0.532	S	S	.	.			trans	-121.6	17.4	-166.9	0	0	0	0	0	118.1	V63 V64 G65	G61-V63 PolarHBondContact O-N 2.57Å; G61-V64 PolarHBondContact O-N 2.91Å; G61-G65 PolarHBondContact O-N 3.24Å
62	S	45.1	Very low	51.2	Low	92 Å²	92	90.6 Å²	90.6	64%	0.643	53%	0.533	S	S	*	.	H	α-helix	trans	-56.8	-43.7	-162.7	57	0	0	0	0	115.8	V64 G65 Y66	S62-V64 PolarHBondContact O-N 3.06Å; S62-G65 PolarHBondContact O-N 3.2Å; S62-Y66 VanDerWaalsContact O-CB 3.27Å; S62-Y66 WeakPolarHBondContact O-CB 3.36Å; S62-Y66 PolarHBondContact O-N 3.39Å
63	V	56.8	Low	52.4	Low	83 Å²	83	87.8 Å²	87.8	50%	0.503	52%	0.52	S	S	.	.	H	α-helix	trans	-65.2	-42.1	-174	-177.1	0	0	0	0	112.4	G61 A67 F73 L77	G61-V63 PolarHBondContact O-N 2.57Å; V63-A67 WeakPolarHBondContact O-CB 3.3Å; V63-A67 PolarHBondContact O-N 3.35Å; V63-A67 VanDerWaalsContact O-N 3.1Å; V63-F73 HydrophobicContact CG1-CE1 4.34Å; V63-F73 HydrophobicContact CG1-CZ 4.46Å; V63-L77 HydrophobicContact CG1-CD1 4.28Å
64	V	58.4	Low	53.7	Low	74 Å²	74	86.1 Å²	86.1	45%	0.448	51%	0.508	S	S	.	.	H	α-helix	trans	-74.6	-38.1	-179	-177.9	0	0	0	0	111	G61 S62 L68 I91	G61-V64 PolarHBondContact O-N 2.91Å; S62-V64 PolarHBondContact O-N 3.06Å; V64-L68 HydrophobicContact CG1-CD1 4.47Å; V64-L68 WeakPolarHBondContact O-CG 3.39Å; V64-L68 PolarHBondContact O-N 3.09Å; V64-I91 HydrophobicContact CG1-CD1 3.9Å
65	G	61.1	Low	55.1	Low	43 Å²	43	87.2 Å²	87.2	44%	0.443	51%	0.507	S	S	.	.	H	α-helix	trans	-65.1	-40.2	174.5	0	0	0	0	0	112.8	G61 S62 L68 Y69	G61-G65 PolarHBondContact O-N 3.24Å; S62-G65 PolarHBondContact O-N 3.2Å; G65-L68 PolarHBondContact O-N 3.08Å; G65-Y69 PolarHBondContact O-N 2.91Å
66	Y	63	Low	56.9	Low	122 Å²	122	87 Å²	87	48%	0.478	50%	0.495	S	S	.	.	H	α-helix	trans	-71.1	-35.4	179.1	-157	-99.6	0	0	0	112.3	S62 L68 Y69 D70 F73	S62-Y66 VanDerWaalsContact O-CB 3.27Å; S62-Y66 WeakPolarHBondContact O-CB 3.36Å; S62-Y66 PolarHBondContact O-N 3.39Å; Y66-L68 PolarHBondContact O-N 3.14Å; Y66-Y69 PolarHBondContact O-N 3.32Å; Y66-D70 HydrophobicContact CE1-CB 4.44Å; Y66-D70 PolarHBondContact O-N 2.88Å; Y66-F73 HydrophobicContact CD1-CB 4.3Å; Y66-F73 AromaticContact CD1-CD1 3.67Å; Y66-F73 HydrophobicContact CD1-CD1 3.67Å; Y66-F73 HydrophobicContact CD1-CE1 4.05Å; Y66-F73 AromaticContact CD1-CG 3.92Å; Y66-F73 HydrophobicContact CD1-CG 3.92Å; Y66-F73 HydrophobicContact CE1-CB 4.41Å; Y66-F73 HydrophobicContact CE1-CD1 4.49Å; Y66-F73 HydrophobicContact CE1-CG 4.3Å
67	A	66.6	Low	58.3	Low	3 Å²	3	84.9 Å²	84.9	3%	0.025	48%	0.481	C	S	.	.	H	α-helix	trans	-71.3	-14.6	174.1	0	0	0	0	0	114.8	V63 F73 L77 F88	V63-A67 WeakPolarHBondContact O-CB 3.3Å; V63-A67 PolarHBondContact O-N 3.35Å; V63-A67 VanDerWaalsContact O-N 3.1Å; A67-F73 HydrophobicContact CB-CD1 3.91Å; A67-F73 HydrophobicContact CB-CE1 4.15Å; A67-L77 HydrophobicContact CB-CD1 3.72Å; A67-F88 HydrophobicContact CB-CE1 3.63Å; A67-F88 HydrophobicContact CB-CZ 3.57Å
68	L	64.6	Low	60.1	Low	61 Å²	61	84.7 Å²	84.7	32%	0.319	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-9.3	168.1	-72.4	165.7	0	0	0	112.9	V64 G65 Y66 I91	V64-L68 HydrophobicContact CG1-CD1 4.47Å; V64-L68 WeakPolarHBondContact O-CG 3.39Å; V64-L68 PolarHBondContact O-N 3.09Å; G65-L68 PolarHBondContact O-N 3.08Å; Y66-L68 PolarHBondContact O-N 3.14Å; L68-I91 HydrophobicContact CD1-CG2 4.22Å
69	Y	64.5	Low	62.1	Low	117 Å²	117	82.9 Å²	82.9	46%	0.459	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-42.8	-179	177.1	-98.7	0	0	0	112.6	G65 Y66 F105	G65-Y69 PolarHBondContact O-N 2.91Å; Y66-Y69 PolarHBondContact O-N 3.32Å; Y69-F105 HydrophobicContact CE2-CD1 4.32Å; Y69-F105 HydrophobicContact CE2-CE1 4.5Å
70	D	70.4	Confident	63.5	Low	48 Å²	48	82.5 Å²	82.5	26%	0.257	46%	0.46	S	S	.	.			trans	-111.4	113.6	-176.9	-178.1	-0.4	0	0	0	112.2	Y66 H72 F73 R74	Y66-D70 HydrophobicContact CE1-CB 4.44Å; Y66-D70 PolarHBondContact O-N 2.88Å; D70-H72 PolarHBondContact O-N 3.28Å; D70-H72 WeakPolarHBondContact OD1-CB 3.46Å; D70-H72 PolarHBondContact OD1-N 3.38Å; D70-F73 HydrophobicContact CB-CB 4Å; D70-F73 PolarHBondContact O-N 3.09Å; D70-R74 PolarHBondContact O-N 2.8Å
71	P	73.3	Confident	64.4	Low	94 Å²	94	81.4 Å²	81.4	61%	0.61	44%	0.44	S	S	*	.	H	α-helix	trans	-64.7	-24.4	178	27.4	-34.5	0	0	0	113.6	Q75	P71-Q75 WeakPolarHBondContact O-CG 3.44Å; P71-Q75 PolarHBondContact O-N 3.06Å; P71-Q75 VanDerWaalsContact O-N 3.15Å
72	H	75.1	Confident	65.5	Low	130 Å²	130	83.9 Å²	83.9	60%	0.602	45%	0.448	S	S	*	.	H	α-helix	trans	-75.6	-35.9	177	-168.4	-76.6	0	0	0	111.7	D70 S76	D70-H72 PolarHBondContact O-N 3.28Å; D70-H72 WeakPolarHBondContact OD1-CB 3.46Å; D70-H72 PolarHBondContact OD1-N 3.38Å; H72-S76 PolarHBondContact O-N 3.1Å; H72-S76 VanDerWaalsContact O-N 3.11Å; H72-S76 PolarHBondContact O-OG 3.12Å
73	F	70.6	Confident	66	Low	66 Å²	66	85.3 Å²	85.3	29%	0.289	44%	0.444	S	S	.	.	H	α-helix	trans	-70.4	-36.7	172.6	-172.4	-112.7	0	0	0	111.7	V63 Y66 A67 D70 S76 L77	V63-F73 HydrophobicContact CG1-CE1 4.34Å; V63-F73 HydrophobicContact CG1-CZ 4.46Å; Y66-F73 HydrophobicContact CD1-CB 4.3Å; Y66-F73 AromaticContact CD1-CD1 3.67Å; Y66-F73 HydrophobicContact CD1-CD1 3.67Å; Y66-F73 HydrophobicContact CD1-CE1 4.05Å; Y66-F73 AromaticContact CD1-CG 3.92Å; Y66-F73 HydrophobicContact CD1-CG 3.92Å; Y66-F73 HydrophobicContact CE1-CB 4.41Å; Y66-F73 HydrophobicContact CE1-CD1 4.49Å; Y66-F73 HydrophobicContact CE1-CG 4.3Å; A67-F73 HydrophobicContact CB-CD1 3.91Å; A67-F73 HydrophobicContact CB-CE1 4.15Å; D70-F73 HydrophobicContact CB-CB 4Å; D70-F73 PolarHBondContact O-N 3.09Å; F73-S76 WeakPolarHBondContact O-CB 3.38Å; F73-S76 PolarHBondContact O-N 3.22Å; F73-L77 HydrophobicContact CD1-CD1 3.83Å; F73-L77 HydrophobicContact CE1-CD1 3.35Å; F73-L77 HydrophobicContact CE1-CG 4.33Å; F73-L77 HydrophobicContact CZ-CD1 3.79Å; F73-L77 HydrophobicContact CZ-CG 4.36Å; F73-L77 PolarHBondContact O-N 3.23Å
74	R	72.5	Confident	66.2	Low	66 Å²	66	82.3 Å²	82.3	25%	0.249	43%	0.426	C	S	.	.	H	α-helix	trans	-56	-51.5	171	-180	-178.7	178.3	152.5	6.4	112	D70 S76 L77 E78 F88 E92	D70-R74 PolarHBondContact O-N 2.8Å; R74-S76 VanDerWaalsContact C-N 3.31Å; R74-S76 PolarHBondContact O-N 3.21Å; R74-L77 WeakPolarHBondContact O-CB 3.42Å; R74-L77 PolarHBondContact O-N 3.49Å; R74-L77 VanDerWaalsContact O-N 3.09Å; R74-E78 HydrophobicContact CG-CG 4.36Å; R74-E78 WeakPolarHBondContact CG-OE1 3.26Å; R74-E78 IonicContact CZ-OE1 3.87Å; R74-E78 IonicContact NE-OE1 2.75Å; R74-E78 PolarHBondContact NE-OE1 3.34Å; R74-E78 IonicContact NH2-OE1 2.84Å; R74-E78 WeakPolarHBondContact O-CG 3.4Å; R74-E78 PolarHBondContact O-N 2.82Å; R74-F88 HydrophobicContact CG-CD2 4.43Å; R74-F88 HydrophobicContact CG-CE2 4.25Å; R74-E92 IonicContact CZ-OE1 2.86Å; R74-E92 VanDerWaalsContact CZ-OE1 3.29Å; R74-E92 IonicContact NH1-OE1 3.19Å; R74-E92 PolarHBondContact NH1-OE1 2.87Å; R74-E92 IonicContact NH2-OE1 3.11Å; R74-E92 PolarHBondContact NH2-OE1 2.96Å; R74-E92 IonicContact NH2-OE2 3.52Å; R74-E92 PolarHBondContact NH2-OE2 3.28Å
75	Q	73.2	Confident	66.4	Low	119 Å²	119	81.4 Å²	81.4	56%	0.556	42%	0.422	S	S	*	.	H	α-helix	trans	-61.3	-39.1	177.6	-72.4	178.1	-3.1	0	0	112.1	P71 L77 E78 N79	P71-Q75 WeakPolarHBondContact O-CG 3.44Å; P71-Q75 PolarHBondContact O-N 3.06Å; P71-Q75 VanDerWaalsContact O-N 3.15Å; Q75-L77 VanDerWaalsContact C-N 3.3Å; Q75-L77 PolarHBondContact O-N 3.31Å; Q75-E78 PolarHBondContact O-N 3.32Å; Q75-N79 WeakPolarHBondContact O-CB 3.42Å; Q75-N79 VanDerWaalsContact O-CG 3.24Å; Q75-N79 PolarHBondContact O-N 2.97Å; Q75-N79 PolarHBondContact O-ND2 3.08Å; Q75-N79 VanDerWaalsContact O-ND2 3.14Å
76	S	72.9	Confident	66.5	Low	57 Å²	57	84 Å²	84	40%	0.399	43%	0.425	S	S	.	.	H	α-helix	trans	-61	-36.5	173.8	-57.7	0	0	0	0	113.1	H72 F73 R74	H72-S76 PolarHBondContact O-N 3.1Å; H72-S76 VanDerWaalsContact O-N 3.11Å; H72-S76 PolarHBondContact O-OG 3.12Å; F73-S76 WeakPolarHBondContact O-CB 3.38Å; F73-S76 PolarHBondContact O-N 3.22Å; R74-S76 VanDerWaalsContact C-N 3.31Å; R74-S76 PolarHBondContact O-N 3.21Å
77	L	67.8	Low	66.2	Low	34 Å²	34	83.3 Å²	83.3	18%	0.178	43%	0.429	C	S	.	.	H	α-helix	trans	-76.2	-41.4	176.7	-97	165	0	0	0	112.8	V63 A67 F73 R74 Q75 N79 L80 V84 F88	V63-L77 HydrophobicContact CG1-CD1 4.28Å; A67-L77 HydrophobicContact CB-CD1 3.72Å; F73-L77 HydrophobicContact CD1-CD1 3.83Å; F73-L77 HydrophobicContact CE1-CD1 3.35Å; F73-L77 HydrophobicContact CE1-CG 4.33Å; F73-L77 HydrophobicContact CZ-CD1 3.79Å; F73-L77 HydrophobicContact CZ-CG 4.36Å; F73-L77 PolarHBondContact O-N 3.23Å; R74-L77 WeakPolarHBondContact O-CB 3.42Å; R74-L77 PolarHBondContact O-N 3.49Å; R74-L77 VanDerWaalsContact O-N 3.09Å; Q75-L77 VanDerWaalsContact C-N 3.3Å; Q75-L77 PolarHBondContact O-N 3.31Å; L77-N79 PolarHBondContact O-N 2.82Å; L77-L80 WeakPolarHBondContact O-CB 3.47Å; L77-L80 PolarHBondContact O-N 3.27Å; L77-V84 HydrophobicContact CB-CG1 4.16Å; L77-V84 WeakPolarHBondContact O-CG1 3.45Å; L77-F88 HydrophobicContact CB-CE2 4.2Å; L77-F88 HydrophobicContact CB-CZ 4.33Å; L77-F88 HydrophobicContact CD1-CZ 4.19Å
78	E	70.4	Confident	66	Low	61 Å²	61	83.9 Å²	83.9	29%	0.285	43%	0.431	S	S	.	.	H	α-helix	trans	-61.2	-33.7	176.1	-73.8	172.1	174.4	0	0	111.8	R74 Q75 L80 V84 F88	R74-E78 HydrophobicContact CG-CG 4.36Å; R74-E78 WeakPolarHBondContact CG-OE1 3.26Å; R74-E78 IonicContact CZ-OE1 3.87Å; R74-E78 IonicContact NE-OE1 2.75Å; R74-E78 PolarHBondContact NE-OE1 3.34Å; R74-E78 IonicContact NH2-OE1 2.84Å; R74-E78 WeakPolarHBondContact O-CG 3.4Å; R74-E78 PolarHBondContact O-N 2.82Å; Q75-E78 PolarHBondContact O-N 3.32Å; E78-L80 VanDerWaalsContact C-N 3.33Å; E78-L80 PolarHBondContact O-N 3.28Å; E78-V84 HydrophobicContact CG-CG1 4.4Å; E78-F88 HydrophobicContact CG-CD2 3.97Å; E78-F88 HydrophobicContact CG-CE2 4.1Å
79	N	74.5	Confident	66.1	Low	143 Å²	143	87.3 Å²	87.3	77%	0.765	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-15.8	174.2	-72.3	-27.8	0	0	0	114.6	Q75 L77	Q75-N79 WeakPolarHBondContact O-CB 3.42Å; Q75-N79 VanDerWaalsContact O-CG 3.24Å; Q75-N79 PolarHBondContact O-N 2.97Å; Q75-N79 PolarHBondContact O-ND2 3.08Å; Q75-N79 VanDerWaalsContact O-ND2 3.14Å; L77-N79 PolarHBondContact O-N 2.82Å
80	L	64.6	Low	65.5	Low	144 Å²	144	90 Å²	90	75%	0.754	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-30.1	-171.1	-152	78.3	0	0	0	113.6	L77 E78	L77-L80 WeakPolarHBondContact O-CB 3.47Å; L77-L80 PolarHBondContact O-N 3.27Å; E78-L80 VanDerWaalsContact C-N 3.33Å; E78-L80 PolarHBondContact O-N 3.28Å
81	H	52.8	Low	65	Low	103 Å²	103	90 Å²	90	48%	0.477	45%	0.454	S	S	.	.			trans	-160.3	132.5	-179.9	-172	-94.3	0	0	0	112.9	H83 V84	H81-H83 AromaticContact CE1-CD2 3.79Å; H81-H83 AromaticContact CE1-CG 3.96Å; H81-H83 PolarHBondContact ND1-N 2.83Å; H81-H83 PolarHBondContact O-N 3.41Å; H81-V84 HydrophobicContact CB-CG2 4.01Å; H81-V84 VanDerWaalsContact O-CB 3.32Å; H81-V84 WeakPolarHBondContact O-CB 3.21Å; H81-V84 WeakPolarHBondContact O-CG2 3.37Å; H81-V84 PolarHBondContact O-N 3.25Å
82	P	57.2	Low	64.5	Low	102 Å²	102	89.7 Å²	89.7	66%	0.662	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-9.6	-170.6	25.2	-35.6	0	0	0	116.1
83	H	55.7	Low	63.8	Low	121 Å²	121	88 Å²	88	56%	0.56	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-7.1	171.7	-67.9	-24.9	0	0	0	114.7	H81 L86 L87	H81-H83 AromaticContact CE1-CD2 3.79Å; H81-H83 AromaticContact CE1-CG 3.96Å; H81-H83 PolarHBondContact ND1-N 2.83Å; H81-H83 PolarHBondContact O-N 3.41Å; H83-L86 PolarHBondContact O-N 2.9Å; H83-L87 PolarHBondContact O-N 3.37Å
84	V	60.9	Low	62.6	Low	20 Å²	20	87.3 Å²	87.3	12%	0.121	45%	0.446	C	S	.	.	H	α-helix	trans	-63.3	-45.5	176.4	174	0	0	0	0	113.4	L77 E78 H81 L86 L87 F88	L77-V84 HydrophobicContact CB-CG1 4.16Å; L77-V84 WeakPolarHBondContact O-CG1 3.45Å; E78-V84 HydrophobicContact CG-CG1 4.4Å; H81-V84 HydrophobicContact CB-CG2 4.01Å; H81-V84 VanDerWaalsContact O-CB 3.32Å; H81-V84 WeakPolarHBondContact O-CB 3.21Å; H81-V84 WeakPolarHBondContact O-CG2 3.37Å; H81-V84 PolarHBondContact O-N 3.25Å; V84-L86 PolarHBondContact O-N 2.82Å; V84-L87 WeakPolarHBondContact O-CB 3.46Å; V84-L87 PolarHBondContact O-N 3.04Å; V84-F88 HydrophobicContact CG1-CD2 3.7Å; V84-F88 HydrophobicContact CG1-CE2 3.26Å; V84-F88 HydrophobicContact CG1-CZ 4.16Å; V84-F88 PolarHBondContact O-N 3.45Å
85	P	62.3	Low	61.4	Low	56 Å²	56	86.8 Å²	86.8	36%	0.364	45%	0.447	S	S	.	.	H	α-helix	trans	-60.6	-32.2	177.2	21.1	-33.6	0	0	0	113.4	L87 F88 Q89	P85-L87 VanDerWaalsContact C-N 3.28Å; P85-L87 PolarHBondContact O-N 2.78Å; P85-F88 PolarHBondContact O-N 2.78Å; P85-Q89 WeakPolarHBondContact O-CB 3.49Å; P85-Q89 PolarHBondContact O-N 3.07Å
86	L	62.8	Low	60.2	Low	98 Å²	98	83.7 Å²	83.7	51%	0.513	44%	0.438	S	S	.	.	H	α-helix	trans	-66.4	-27.8	174.7	-78.6	161.8	0	0	0	113.2	H83 V84 R90	H83-L86 PolarHBondContact O-N 2.9Å; V84-L86 PolarHBondContact O-N 2.82Å; L86-R90 VanDerWaalsContact O-CB 3.28Å; L86-R90 WeakPolarHBondContact O-CB 3.29Å; L86-R90 PolarHBondContact O-N 3.33Å
87	L	57	Low	59.2	Low	107 Å²	107	90.5 Å²	90.5	56%	0.56	46%	0.463	S	S	*	.	H	α-helix	trans	-75.7	-46.5	174	-67.1	172.5	0	0	0	110.7	H83 V84 P85 R90 I91	H83-L87 PolarHBondContact O-N 3.37Å; V84-L87 WeakPolarHBondContact O-CB 3.46Å; V84-L87 PolarHBondContact O-N 3.04Å; P85-L87 VanDerWaalsContact C-N 3.28Å; P85-L87 PolarHBondContact O-N 2.78Å; L87-R90 PolarHBondContact O-N 3.5Å; L87-I91 WeakPolarHBondContact O-CD1 3.04Å; L87-I91 VanDerWaalsContact O-CG1 3.26Å; L87-I91 WeakPolarHBondContact O-CG1 3.49Å; L87-I91 PolarHBondContact O-N 3.34Å
88	F	63.1	Low	58.2	Low	14 Å²	14	96.5 Å²	96.5	6%	0.061	50%	0.496	C	S	.	.	H	α-helix	trans	-62.3	-49.8	177.5	-70	-53.4	0	0	0	112.4	A67 R74 L77 E78 V84 P85 R90 I91 E92	A67-F88 HydrophobicContact CB-CE1 3.63Å; A67-F88 HydrophobicContact CB-CZ 3.57Å; R74-F88 HydrophobicContact CG-CD2 4.43Å; R74-F88 HydrophobicContact CG-CE2 4.25Å; L77-F88 HydrophobicContact CB-CE2 4.2Å; L77-F88 HydrophobicContact CB-CZ 4.33Å; L77-F88 HydrophobicContact CD1-CZ 4.19Å; E78-F88 HydrophobicContact CG-CD2 3.97Å; E78-F88 HydrophobicContact CG-CE2 4.1Å; V84-F88 HydrophobicContact CG1-CD2 3.7Å; V84-F88 HydrophobicContact CG1-CE2 3.26Å; V84-F88 HydrophobicContact CG1-CZ 4.16Å; V84-F88 PolarHBondContact O-N 3.45Å; P85-F88 PolarHBondContact O-N 2.78Å; F88-R90 PolarHBondContact O-N 3.06Å; F88-I91 PolarHBondContact O-N 3.19Å; F88-E92 WeakPolarHBondContact O-CG 3.46Å; F88-E92 PolarHBondContact O-N 2.78Å
89	Q	65.5	Low	57.2	Low	133 Å²	133	96.7 Å²	96.7	62%	0.621	50%	0.501	S	S	*	.	H	α-helix	trans	-58.2	-35.4	178	-169.1	-176.8	29.1	0	0	112.2	P85 S93	P85-Q89 WeakPolarHBondContact O-CB 3.49Å; P85-Q89 PolarHBondContact O-N 3.07Å; Q89-S93 PolarHBondContact O-N 3.15Å
90	R	53.9	Low	56.2	Low	175 Å²	175	96 Å²	96	66%	0.66	50%	0.497	S	S	*	.	H	α-helix	trans	-70.3	-42.3	175.4	-175.3	165.6	-71.6	176.8	0.1	111.7	L86 L87 F88 S93 I94	L86-R90 VanDerWaalsContact O-CB 3.28Å; L86-R90 WeakPolarHBondContact O-CB 3.29Å; L86-R90 PolarHBondContact O-N 3.33Å; L87-R90 PolarHBondContact O-N 3.5Å; F88-R90 PolarHBondContact O-N 3.06Å; R90-S93 PolarHBondContact O-N 2.96Å; R90-S93 PolarHBondContact O-OG 3.23Å; R90-I94 HydrophobicContact CG-CD1 4.19Å; R90-I94 WeakPolarHBondContact O-CD1 3.49Å; R90-I94 VanDerWaalsContact O-CG1 3.29Å; R90-I94 WeakPolarHBondContact O-CG1 3.33Å
91	I	59.1	Low	55.4	Low	48 Å²	48	92.6 Å²	92.6	25%	0.246	48%	0.479	C	S	.	.	H	α-helix	trans	-64.9	-46.6	177.5	-68.8	162	0	0	0	110.8	V64 L68 L87 F88 S93 I94 L95	V64-I91 HydrophobicContact CG1-CD1 3.9Å; L68-I91 HydrophobicContact CD1-CG2 4.22Å; L87-I91 WeakPolarHBondContact O-CD1 3.04Å; L87-I91 VanDerWaalsContact O-CG1 3.26Å; L87-I91 WeakPolarHBondContact O-CG1 3.49Å; L87-I91 PolarHBondContact O-N 3.34Å; F88-I91 PolarHBondContact O-N 3.19Å; I91-S93 VanDerWaalsContact C-N 3.29Å; I91-S93 PolarHBondContact O-N 3.09Å; I91-I94 PolarHBondContact O-N 3.1Å; I91-L95 HydrophobicContact CG2-CD1 3.81Å; I91-L95 VanDerWaalsContact O-CD1 3.26Å; I91-L95 WeakPolarHBondContact O-CD1 3.06Å; I91-L95 PolarHBondContact O-N 3.14Å
92	E	62.3	Low	55.2	Low	87 Å²	87	93.6 Å²	93.6	41%	0.407	48%	0.484	S	S	.	.	H	α-helix	trans	-58	-39	177.5	-71.6	175.4	139.2	0	0	112	R74 F88 I94	R74-E92 IonicContact CZ-OE1 2.86Å; R74-E92 VanDerWaalsContact CZ-OE1 3.29Å; R74-E92 IonicContact NH1-OE1 3.19Å; R74-E92 PolarHBondContact NH1-OE1 2.87Å; R74-E92 IonicContact NH2-OE1 3.11Å; R74-E92 PolarHBondContact NH2-OE1 2.96Å; R74-E92 IonicContact NH2-OE2 3.52Å; R74-E92 PolarHBondContact NH2-OE2 3.28Å; F88-E92 WeakPolarHBondContact O-CG 3.46Å; F88-E92 PolarHBondContact O-N 2.78Å; E92-I94 PolarHBondContact O-N 2.8Å
93	S	60.4	Low	55.1	Low	94 Å²	94	90.2 Å²	90.2	66%	0.657	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-5.2	176.6	76.1	0	0	0	0	115.7	Q89 R90 I91	Q89-S93 PolarHBondContact O-N 3.15Å; R90-S93 PolarHBondContact O-N 2.96Å; R90-S93 PolarHBondContact O-OG 3.23Å; I91-S93 VanDerWaalsContact C-N 3.29Å; I91-S93 PolarHBondContact O-N 3.09Å
94	I	46.6	Very low	54.9	Low	51 Å²	51	88.7 Å²	88.7	26%	0.262	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.3	-23.9	-173.5	-62.7	161	0	0	0	112.1	L46 V50 R90 I91 E92	L46-I94 HydrophobicContact CD2-CD1 3.74Å; L46-I94 HydrophobicContact CD2-CG2 4.03Å; V50-I94 HydrophobicContact CG2-CG2 4.03Å; R90-I94 HydrophobicContact CG-CD1 4.19Å; R90-I94 WeakPolarHBondContact O-CD1 3.49Å; R90-I94 VanDerWaalsContact O-CG1 3.29Å; R90-I94 WeakPolarHBondContact O-CG1 3.33Å; I91-I94 PolarHBondContact O-N 3.1Å; E92-I94 PolarHBondContact O-N 2.8Å
95	L	46.2	Very low	54	Low	55 Å²	55	93.2 Å²	93.2	29%	0.288	49%	0.485	S	S	.	.	S	Bend	trans	-75.6	138.4	175.7	-85.1	81.4	0	0	0	111.2	I91 I101	I91-L95 HydrophobicContact CG2-CD1 3.81Å; I91-L95 VanDerWaalsContact O-CD1 3.26Å; I91-L95 WeakPolarHBondContact O-CD1 3.06Å; I91-L95 PolarHBondContact O-N 3.14Å; L95-I101 HydrophobicContact CD2-CD1 4.4Å
96	P	48.6	Very low	53.6	Low	54 Å²	54	95 Å²	95	35%	0.351	49%	0.488	S	S	.	.			trans	-74	142.6	170	31.1	-32.5	0	0	0	111.1	N98 T99	P96-N98 PolarHBondContact O-N 3.13Å; P96-T99 HydrophobicContact CG-CG2 4.12Å; P96-T99 PolarHBondContact O-OG1 3.27Å
97	E	52.1	Low	53	Low	200 Å²	200	97.8 Å²	97.8	94%	0.935	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	14.2	-169.2	-156.9	170.5	-170	0	0	116.3
98	N	45.4	Very low	52.2	Low	161 Å²	161	95.9 Å²	95.9	86%	0.861	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-148.6	24.2	-171	-114	-32.5	0	0	0	114.3	P96	P96-N98 PolarHBondContact O-N 3.13Å
99	T	50.3	Low	51.4	Low	65 Å²	65	102.3 Å²	102.3	40%	0.399	52%	0.524	S	S	.	.			trans	-85.8	109.2	170.9	38.6	0	0	0	0	111.7	P96 I101	P96-T99 HydrophobicContact CG-CG2 4.12Å; P96-T99 PolarHBondContact O-OG1 3.27Å; T99-I101 VanDerWaalsContact C-N 3.28Å; T99-I101 PolarHBondContact O-N 3.04Å
100	D	53.3	Low	50.4	Low	127 Å²	127	100.7 Å²	100.7	68%	0.679	53%	0.527	S	S	*	.			trans	-66.7	82.8	168	-89.6	-30.2	0	0	0	111.6	H102 G103 T104	D100-H102 PolarHBondContact O-N 2.8Å; D100-G103 PolarHBondContact O-N 3.22Å; D100-T104 PolarHBondContact O-N 2.77Å; D100-T104 VanDerWaalsContact O-N 3.13Å; D100-T104 PolarHBondContact O-OG1 3.04Å
101	I	47.4	Very low	49.8	Very low	73 Å²	73	96.7 Å²	96.7	37%	0.374	53%	0.526	S	S	.	.	H	α-helix	trans	-58.3	-37.2	170.2	-58.2	170.7	0	0	0	109.3	L95 T99 T104 F105	L95-I101 HydrophobicContact CD2-CD1 4.4Å; T99-I101 VanDerWaalsContact C-N 3.28Å; T99-I101 PolarHBondContact O-N 3.04Å; I101-T104 WeakPolarHBondContact CA-OG1 3.4Å; I101-T104 PolarHBondContact O-OG1 2.71Å; I101-T104 VanDerWaalsContact O-OG1 3.05Å; I101-F105 VanDerWaalsContact O-CB 3.31Å; I101-F105 WeakPolarHBondContact O-CB 3.26Å; I101-F105 PolarHBondContact O-N 3.21Å
102	H	48.8	Very low	48.4	Very low	125 Å²	125	98 Å²	98	58%	0.579	55%	0.551	S	S	*	*	H	α-helix	trans	-64.5	-46.1	179.1	-155.6	-68.8	0	0	0	112.6	D100 E106	D100-H102 PolarHBondContact O-N 2.8Å; H102-E106 WeakPolarHBondContact O-CB 3.41Å; H102-E106 WeakPolarHBondContact O-CG 3.26Å; H102-E106 PolarHBondContact O-N 3.03Å
103	G	55.8	Low	47	Very low	30 Å²	30	105.2 Å²	105.2	31%	0.309	58%	0.575	S	S	.	*	H	α-helix	trans	-72.8	-30	-178.9	0	0	0	0	0	114.1	D100 K107	D100-G103 PolarHBondContact O-N 3.22Å; G103-K107 WeakPolarHBondContact O-CB 3.37Å; G103-K107 VanDerWaalsContact O-CG 3.3Å; G103-K107 WeakPolarHBondContact O-CG 3.29Å; G103-K107 PolarHBondContact O-N 3.43Å; G103-K107 VanDerWaalsContact O-N 3.14Å
104	T	51.5	Low	45.4	Very low	90 Å²	90	105.6 Å²	105.6	55%	0.552	58%	0.584	S	S	*	*	H	α-helix	trans	-73.8	-39.2	174	45.5	0	0	0	0	111.9	D100 I101 A108	D100-T104 PolarHBondContact O-N 2.77Å; D100-T104 VanDerWaalsContact O-N 3.13Å; D100-T104 PolarHBondContact O-OG1 3.04Å; I101-T104 WeakPolarHBondContact CA-OG1 3.4Å; I101-T104 PolarHBondContact O-OG1 2.71Å; I101-T104 VanDerWaalsContact O-OG1 3.05Å; T104-A108 PolarHBondContact O-N 2.75Å; T104-A108 VanDerWaalsContact O-N 3.07Å
105	F	42	Very low	44.7	Very low	115 Å²	115	109.7 Å²	109.7	50%	0.504	61%	0.605	S	S	.	*	H	α-helix	trans	-69.6	-41.4	175.5	-159.4	-102.6	0	0	0	112.7	Y69 I101 A108 K109	Y69-F105 HydrophobicContact CE2-CD1 4.32Å; Y69-F105 HydrophobicContact CE2-CE1 4.5Å; I101-F105 VanDerWaalsContact O-CB 3.31Å; I101-F105 WeakPolarHBondContact O-CB 3.26Å; I101-F105 PolarHBondContact O-N 3.21Å; F105-A108 PolarHBondContact O-N 2.84Å; F105-K109 WeakPolarHBondContact O-CB 3.22Å; F105-K109 PolarHBondContact O-N 3.46Å
106	E	53	Low	44	Very low	92 Å²	92	112.9 Å²	112.9	43%	0.43	62%	0.622	S	S	.	*	H	α-helix	trans	-62.5	-43	173	-82.9	-87.8	113.3	0	0	112.4	H102 A108 K109 S110	H102-E106 WeakPolarHBondContact O-CB 3.41Å; H102-E106 WeakPolarHBondContact O-CG 3.26Å; H102-E106 PolarHBondContact O-N 3.03Å; E106-A108 PolarHBondContact O-N 3.45Å; E106-K109 WeakPolarHBondContact O-CB 3.21Å; E106-K109 PolarHBondContact O-N 2.72Å; E106-K109 VanDerWaalsContact O-N 3.16Å; E106-K109 IonicContact OE1-NZ 3.97Å; E106-K109 PolarHBondContact OE1-NZ 3.41Å; E106-S110 PolarHBondContact O-N 3.16Å
107	K	50	Low	43.1	Very low	158 Å²	158	121.4 Å²	121.4	69%	0.687	65%	0.647	S	S	*	*	H	α-helix	trans	-62	-42.1	174.8	-78.4	174.9	179.9	174.9	0	112	G103 K109 S110 S111	G103-K107 WeakPolarHBondContact O-CB 3.37Å; G103-K107 VanDerWaalsContact O-CG 3.3Å; G103-K107 WeakPolarHBondContact O-CG 3.29Å; G103-K107 PolarHBondContact O-N 3.43Å; G103-K107 VanDerWaalsContact O-N 3.14Å; K107-K109 VanDerWaalsContact C-N 3.31Å; K107-K109 PolarHBondContact O-N 3.43Å; K107-S110 PolarHBondContact O-N 3.07Å; K107-S110 PolarHBondContact O-OG 2.93Å; K107-S111 PolarHBondContact O-N 3.5Å
108	A	41.8	Very low	42	Very low	67 Å²	67	123.8 Å²	123.8	55%	0.554	65%	0.648	S	S	*	*	H	α-helix	trans	-62.7	-36	174.1	0	0	0	0	0	112.8	T104 F105 E106 S111	T104-A108 PolarHBondContact O-N 2.75Å; T104-A108 VanDerWaalsContact O-N 3.07Å; F105-A108 PolarHBondContact O-N 2.84Å; E106-A108 PolarHBondContact O-N 3.45Å; A108-S111 PolarHBondContact O-N 2.79Å
109	K	44.7	Very low	41.4	Very low	149 Å²	149	120.3 Å²	120.3	65%	0.648	64%	0.642	S	S	*	*	H	α-helix	trans	-71.1	-31	177.2	-173.2	-179	171.4	-163.5	0	113.3	F105 E106 K107	F105-K109 WeakPolarHBondContact O-CB 3.22Å; F105-K109 PolarHBondContact O-N 3.46Å; E106-K109 WeakPolarHBondContact O-CB 3.21Å; E106-K109 PolarHBondContact O-N 2.72Å; E106-K109 VanDerWaalsContact O-N 3.16Å; E106-K109 IonicContact OE1-NZ 3.97Å; E106-K109 PolarHBondContact OE1-NZ 3.41Å; K107-K109 VanDerWaalsContact C-N 3.31Å; K107-K109 PolarHBondContact O-N 3.43Å
110	S	44.9	Very low	40.3	Very low	98 Å²	98	125.7 Å²	125.7	69%	0.685	66%	0.66	S	S	*	*	H	α-helix	trans	-78.5	-19.3	174.6	70.3	0	0	0	0	114.4	E106 K107	E106-S110 PolarHBondContact O-N 3.16Å; K107-S110 PolarHBondContact O-N 3.07Å; K107-S110 PolarHBondContact O-OG 2.93Å
111	S	41.4	Very low	39.4	Very low	92 Å²	92	127.4 Å²	127.4	64%	0.643	67%	0.668	S	S	*	*	S	Bend	trans	-88.7	108.3	179.2	-166.6	0	0	0	0	110.2	K107 A108 R113	K107-S111 PolarHBondContact O-N 3.5Å; A108-S111 PolarHBondContact O-N 2.79Å; S111-R113 PolarHBondContact O-N 3.09Å
112	G	30.3	Very low	38.4	Very low	75 Å²	75	131.7 Å²	131.7	77%	0.773	69%	0.687	S	S	*	*	S	Bend	trans	-63.8	113.8	-158.8	0	0	0	0	0	116.7
113	R	32	Very low	37.7	Very low	239 Å²	239	135.3 Å²	135.3	90%	0.902	70%	0.701	S	S	*	*				-164	102.9	125.3	-112.4	172.6	171	169	-3.6	111.3	S111 L115	S111-R113 PolarHBondContact O-N 3.09Å; R113-L115 PolarHBondContact O-N 2.82Å
114	A	27.8	Very low	36.4	Very low	102 Å²	102	138.2 Å²	138.2	84%	0.843	72%	0.717	S	S	*	*			trans	-74.4	114	172.1	0	0	0	0	0	110
115	L	32.1	Very low	35.6	Very low	136 Å²	136	140.8 Å²	140.8	71%	0.712	73%	0.727	S	S	*	*			trans	-168.8	88.9	167.4	-110.4	165.7	0	0	0	110.9	R113	R113-L115 PolarHBondContact O-N 2.82Å
116	L	30.3	Very low	35.1	Very low	123 Å²	123	140.1 Å²	140.1	64%	0.644	74%	0.743	S	S	*	*	S	Bend		168.4	158.3	126.6	-110.8	75.8	0	0	0	110.6
117	W	30.2	Very low	34.1	Very low	233 Å²	233	138.9 Å²	138.9	88%	0.883	75%	0.754	S	S	*	*			trans	70.1	77.7	174.6	-40.5	116.7	0	0	0	116.6
118	R	28.6	Very low	33.2	Very low	249 Å²	249	136.9 Å²	136.9	94%	0.94	76%	0.761	S	S	*	*			trans	-124.5	104.9	133	-157.5	167.5	-157.7	156.6	7.5	109.4
119	A	32.5	Very low	32.8	Very low	89 Å²	89	139.4 Å²	139.4	74%	0.736	77%	0.769	S	S	*	*			trans	-70.9	161.3	174.2	0	0	0	0	0	110.9
120	K	27	Very low	32.2	Very low	178 Å²	178	136.4 Å²	136.4	77%	0.774	77%	0.766	S	S	*	*			trans	-88.5	123	-177.9	172.8	-172.7	178.2	-174	0	109.3
121	D	35.8	Very low	31.5	Very low	162 Å²	162	139 Å²	139	87%	0.866	77%	0.771	S	S	*	*			trans	-124.1	138.6	161.6	-81.1	-48.4	0	0	0	109.4
122	E	26.8	Very low	31	Very low	164 Å²	164	138.6 Å²	138.6	77%	0.766	77%	0.768	S	S	*	*			trans	-87.5	143.2	-179	-60.9	172.5	131.7	0	0	111.3
123	K	32.8	Very low	31	Very low	200 Å²	200	144 Å²	144	87%	0.87	77%	0.771	S	S	*	*				-172.3	157.7	121.4	-103.5	160	-174.2	174.2	0	114
124	S	29.4	Very low	31	Very low	91 Å²	91	138 Å²	138	64%	0.636	77%	0.765	S	S	*	*			trans	-65.9	170.1	168.9	57.1	0	0	0	0	111.1
125	D	33.7	Very low	31.3	Very low	145 Å²	145	137.4 Å²	137.4	78%	0.775	76%	0.76	S	S	*	*			cis	-160.2	160.9	38.7	-103.7	-59.9	0	0	0	114.6
126	A	31.7	Very low	31.6	Very low	101 Å²	101	137.1 Å²	137.1	84%	0.835	77%	0.766	S	S	*	*			trans	56.4	135.7	143.6	0	0	0	0	0	124.5
127	G	33	Very low	31.6	Very low	65 Å²	65	135.1 Å²	135.1	67%	0.67	78%	0.775	S	S	*	*			trans	109.8	81.9	149.8	0	0	0	0	0	115.8
128	S	31.1	Very low	31.7	Very low	117 Å²	117	127.8 Å²	127.8	82%	0.818	77%	0.772	S	S	*	*				61.9	133.2	84	81.7	0	0	0	0	113.1
129	V	32.9	Very low	32.2	Very low	120 Å²	120	122.5 Å²	122.5	73%	0.727	76%	0.756	S	S	*	*			cis	-151.9	121.2	29.2	168.2	0	0	0	0	107.3
130	S	32.3	Very low	32.5	Very low	85 Å²	85	123.1 Å²	123.1	59%	0.594	75%	0.752	S	S	*	*				78.7	121.9	81.4	118.8	0	0	0	0	117.5
131	I	30.1	Very low	33	Very low	153 Å²	153	118.4 Å²	118.4	79%	0.785	75%	0.746	S	S	*	*				72.5	140.1	128.6	-63.1	170.1	0	0	0	118.7
132	S	30.8	Very low	33.2	Very low	83 Å²	83	113.5 Å²	113.5	58%	0.58	72%	0.723	S	S	*	*			cis	-175.2	166.4	-21.8	69	0	0	0	0	111.6
133	K	30	Very low	33.5	Very low	190 Å²	190	107.2 Å²	107.2	83%	0.826	70%	0.7	S	S	*	*			trans	76.3	153.2	142.7	-81.7	174.5	177.1	175.1	0	123.3
134	S	33.1	Very low	33.7	Very low	113 Å²	113	98.5 Å²	98.5	79%	0.79	66%	0.662	S	S	*	*			trans	75.9	92.9	153.1	37.8	0	0	0	0	120.6
135	A	32.9	Very low	33.8	Very low	88 Å²	88	100 Å²	100	73%	0.727	65%	0.653	S	S	*	*			trans	-71	-164.3	140.4	0	0	0	0	0	110.8
136	P	38.8	Very low	33.7	Very low	131 Å²	131	94.4 Å²	94.4	85%	0.851	63%	0.625	S	S	*	*			cis	-134.6	-173.8	-31.9	33.6	-15	0	0	0	112.9
137	G	31	Very low	33.7	Very low	80 Å²	80	98.3 Å²	98.3	83%	0.825	62%	0.624	S	S	*	*			trans	134.1	154.6	137.8	0	0	0	0	0	117.6
138	G	31.3	Very low	33.6	Very low	79 Å²	79	99.7 Å²	99.7	81%	0.814	63%	0.629	S	S	*	*			trans	117.2	40.1	154	0	0	0	0	0	120.4
139	K	39.1	Very low	34	Very low	139 Å²	139	99.5 Å²	99.5	60%	0.604	63%	0.625	S	S	*	*			trans	-20.1	168.4	136.6	-91.5	-166.4	163.4	-159.1	0	116.4
140	P	38.6	Very low	34	Very low	102 Å²	102	103.8 Å²	103.8	66%	0.662	63%	0.629	S	S	*	*			cis	-147.4	-176.4	-41.9	42	-22.6	0	0	0	113.7
141	A	37.7	Very low	34.1	Very low	78 Å²	78	106.8 Å²	106.8	65%	0.645	64%	0.636	S	S	*	*			trans	46.5	160.3	131.2	0	0	0	0	0	123.2
142	P	38.9	Very low	34.2	Very low	60 Å²	60	103.3 Å²	103.3	39%	0.39	63%	0.63	S	S	.	*			cis	-135.7	-147.9	-16.8	30	-4.9	0	0	0	111.5	N324 V325	P142-N324 HydrophobicContact CB-CB 4.02Å; P142-N324 WeakPolarHBondContact CB-O 3.11Å; P142-N324 HydrophobicContact CG-CB 3.61Å; P142-N324 VanDerWaalsContact CG-O 3.25Å; P142-N324 WeakPolarHBondContact CG-O 3.2Å; P142-V325 HydrophobicContact CB-CG2 3.81Å
143	A	33.7	Very low	34.4	Very low	32 Å²	32	106.6 Å²	106.6	26%	0.264	64%	0.639	S	S	.	*			trans	103.6	135.5	137.8	0	0	0	0	0	121.1	N324 E328	A143-N324 WeakPolarHBondContact CA-O 3.34Å; A143-N324 PolarHBondContact N-O 3.25Å; A143-E328 HydrophobicContact CB-CG 3.98Å; A143-E328 WeakPolarHBondContact CB-OE1 3.25Å; A143-E328 WeakPolarHBondContact CB-OE2 3.34Å
144	K	36.6	Very low	34.7	Very low	17 Å²	17	103.7 Å²	103.7	7%	0.074	64%	0.638	C	S	.	*			cis	-172.4	96	-13.5	-108.1	-128	-151.3	-144.7	0	117.2	T323 N324 V325 L326 K327 E328 Y329 K330	K144-T323 PolarHBondContact NZ-O 2.89Å; K144-N324 WeakPolarHBondContact CD-O 3.4Å; K144-N324 VanDerWaalsContact CE-C 3.5Å; K144-N324 WeakPolarHBondContact CE-O 3.43Å; K144-N324 WeakPolarHBondContact CE-OD1 3.3Å; K144-N324 VanDerWaalsContact CG-C 3.49Å; K144-N324 WeakPolarHBondContact CG-O 3.4Å; K144-N324 PolarHBondContact NZ-OD1 2.72Å; K144-V325 CarbonylContact C-O 2.77Å; K144-V325 VanDerWaalsContact CA-O 3.23Å; K144-V325 WeakPolarHBondContact CA-O 3.29Å; K144-L326 VanDerWaalsContact CD-N 3.34Å; K144-K327 VanDerWaalsContact C-N 3.34Å; K144-K327 HydrophobicContact CB-CB 4.49Å; K144-K327 HydrophobicContact CD-CB 3.45Å; K144-K327 VanDerWaalsContact CD-CB 3.45Å; K144-K327 HydrophobicContact CD-CD 4.13Å; K144-K327 HydrophobicContact CD-CG 3.51Å; K144-K327 HydrophobicContact CG-CB 4.44Å; K144-K327 VanDerWaalsContact CG-N 3.33Å; K144-K327 CarbonylContact O-C 3.51Å; K144-K327 WeakPolarHBondContact O-CA 3.44Å; K144-K327 PolarHBondContact O-N 2.67Å; K144-K327 VanDerWaalsContact O-O 3.09Å; K144-E328 HydrophobicContact CB-CB 3.69Å; K144-E328 HydrophobicContact CB-CG 3.9Å; K144-E328 HydrophobicContact CG-CG 4.48Å; K144-E328 CarbonylContact O-C 3.56Å; K144-E328 PolarHBondContact O-N 2.96Å; K144-Y329 WeakPolarHBondContact O-CA 3.31Å; K144-Y329 WeakPolarHBondContact O-CB 3.41Å; K144-Y329 PolarHBondContact O-N 2.99Å; K144-K330 PolarHBondContact O-N 2.76Å
145	R	31.3	Very low	34.8	Very low	121 Å²	121	103.6 Å²	103.6	46%	0.457	64%	0.636	S	S	.	*			trans	80.5	148.8	162.5	-131.2	-178.5	-147.4	158	-1	125.2	V325 L326 Y329 K330	R145-V325 PolarHBondContact N-O 2.94Å; R145-L326 HydrophobicContact CB-CB 4.3Å; R145-L326 HydrophobicContact CB-CD2 4.4Å; R145-L326 VanDerWaalsContact CD-O 3.3Å; R145-L326 WeakPolarHBondContact CD-O 3.48Å; R145-L326 HydrophobicContact CG-CB 3.94Å; R145-L326 HydrophobicContact CG-CD2 3.96Å; R145-L326 PolarHBondContact NE-O 3.47Å; R145-L326 PolarHBondContact NH1-O 2.96Å; R145-Y329 VanDerWaalsContact C-CD1 3.48Å; R145-Y329 CarbonylContact O-C 3.57Å; R145-Y329 VanDerWaalsContact O-CA 3.23Å; R145-Y329 WeakPolarHBondContact O-CA 3.2Å; R145-Y329 WeakPolarHBondContact O-CB 3.25Å; R145-Y329 WeakPolarHBondContact O-CD1 3.36Å; R145-K330 HydrophobicContact CB-CB 4.26Å; R145-K330 PolarHBondContact O-N 3.49Å
146	S	32.7	Very low	34.8	Very low	28 Å²	28	107.6 Å²	107.6	20%	0.196	64%	0.644	C	S	.	*			trans	92	107.4	134.5	163.2	0	0	0	0	124.1	K330	S146-K330 WeakPolarHBondContact OG-CG 3.5Å
147	K	32.3	Very low	34.6	Very low	184 Å²	184	106.5 Å²	106.5	80%	0.8	64%	0.639	S	S	*	*				84.5	104.7	123.1	-68	-169.9	173.7	-155.9	0	122.6
148	A	31	Very low	34.7	Very low	94 Å²	94	106 Å²	106	78%	0.777	62%	0.623	S	S	*	*				109.2	148.8	107.7	0	0	0	0	0	118.3
149	P	38.2	Very low	35.1	Very low	113 Å²	113	112.2 Å²	112.2	73%	0.734	63%	0.628	S	S	*	*			trans	-116.9	177.9	-155	43.4	-31.9	0	0	0	114.2
150	Y	34	Very low	35.1	Very low	209 Å²	209	109.6 Å²	109.6	82%	0.82	63%	0.627	S	S	*	*			trans	-168.3	160.4	161.1	-100.9	-60.3	0	0	0	107.3
151	M	33.3	Very low	35.1	Very low	148 Å²	148	108.5 Å²	108.5	73%	0.729	62%	0.616	S	S	*	*			cis	-149.6	150.5	13.7	-115.4	-57.5	175.9	0	0	112.3
152	A	32.5	Very low	35.3	Very low	80 Å²	80	109.6 Å²	109.6	66%	0.661	61%	0.614	S	S	*	*			trans	62.5	158.4	138.7	0	0	0	0	0	119.9
153	I	34.2	Very low	35.7	Very low	152 Å²	152	111 Å²	111	78%	0.779	62%	0.622	S	S	*	*			cis	-160	144.8	47.1	-82.2	178.9	0	0	0	107.5
154	T	38.1	Very low	36.4	Very low	130 Å²	130	112 Å²	112	80%	0.798	63%	0.63	S	S	*	*			cis	-157.7	-178.4	-5	24.6	0	0	0	0	111.3
155	C	34.1	Very low	36.6	Very low	111 Å²	111	116 Å²	116	75%	0.75	65%	0.651	S	S	*	*			trans	-74.4	172.6	-177.5	-50.6	0	0	0	0	118.7
156	L	34	Very low	37.2	Very low	172 Å²	172	116 Å²	116	90%	0.901	66%	0.656	S	S	*	*			trans	139.5	148.2	134.5	-74.6	150.8	0	0	0	111.9
157	S	34.8	Very low	38.1	Very low	107 Å²	107	118.4 Å²	118.4	75%	0.748	67%	0.667	S	S	*	*			cis	-178.1	114.4	-30.8	169.5	0	0	0	0	109.3
158	S	33.1	Very low	38.9	Very low	69 Å²	69	112.1 Å²	112.1	48%	0.483	65%	0.649	S	S	.	*			trans	-157.8	145.3	161.5	69.7	0	0	0	0	113.1	S160	S158-S160 VanDerWaalsContact C-N 3.27Å; S158-S160 PolarHBondContact O-N 2.74Å; S158-S160 PolarHBondContact OG-OG 2.97Å
159	K	38.8	Very low	39.6	Very low	210 Å²	210	112.5 Å²	112.5	91%	0.913	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	8.7	-169.3	-68.1	176.9	176.4	176.2	0	115.1	N161	K159-N161 VanDerWaalsContact C-N 3.32Å
160	S	39.5	Very low	40.4	Very low	84 Å²	84	113 Å²	113	59%	0.587	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	-18.8	172	45.1	0	0	0	0	113.3	S158 V162	S158-S160 VanDerWaalsContact C-N 3.27Å; S158-S160 PolarHBondContact O-N 2.74Å; S158-S160 PolarHBondContact OG-OG 2.97Å; S160-V162 PolarHBondContact O-N 3.35Å; S160-V162 VanDerWaalsContact O-N 3.09Å
161	N	38.6	Very low	41.5	Very low	79 Å²	79	108.8 Å²	108.8	42%	0.422	62%	0.619	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.3	13.1	-162.2	-63.7	3.4	0	0	0	114	K159 V163 A164 I165	K159-N161 VanDerWaalsContact C-N 3.32Å; N161-V163 VanDerWaalsContact C-N 3.33Å; N161-A164 HydrophobicContact CB-CB 4.04Å; N161-A164 CarbonylContact O-C 3.46Å; N161-A164 WeakPolarHBondContact O-CB 3.3Å; N161-A164 PolarHBondContact O-N 3.32Å; N161-I165 WeakPolarHBondContact O-CD1 3.28Å; N161-I165 WeakPolarHBondContact O-CG1 3.22Å; N161-I165 PolarHBondContact O-N 2.9Å
162	V	40.7	Very low	42.1	Very low	102 Å²	102	107.4 Å²	107.4	62%	0.618	61%	0.611	S	S	*	*	H	α-helix	trans	-66.9	-36.8	174	-176	0	0	0	0	111	S160 I165 E166	S160-V162 PolarHBondContact O-N 3.35Å; S160-V162 VanDerWaalsContact O-N 3.09Å; V162-I165 WeakPolarHBondContact O-CB 3.29Å; V162-I165 PolarHBondContact O-N 3.49Å; V162-E166 PolarHBondContact O-N 3.38Å; V162-E166 VanDerWaalsContact O-N 3.12Å
163	V	48.1	Very low	42.8	Very low	90 Å²	90	107 Å²	107	55%	0.545	60%	0.602	S	S	.	*	H	α-helix	trans	-69.5	-38	170.3	-178.7	0	0	0	0	110.9	N161 I165 E166 D167	N161-V163 VanDerWaalsContact C-N 3.33Å; V163-I165 PolarHBondContact O-N 3.11Å; V163-E166 PolarHBondContact O-N 2.76Å; V163-E166 VanDerWaalsContact O-N 3.12Å; V163-D167 PolarHBondContact O-N 3.3Å
164	A	48.6	Very low	43.9	Very low	52 Å²	52	106.4 Å²	106.4	43%	0.43	60%	0.596	S	S	.	*	H	α-helix	trans	-65.9	-21.1	172.7	0	0	0	0	0	113.1	N161 A168	N161-A164 HydrophobicContact CB-CB 4.04Å; N161-A164 CarbonylContact O-C 3.46Å; N161-A164 WeakPolarHBondContact O-CB 3.3Å; N161-A164 PolarHBondContact O-N 3.32Å; A164-A168 WeakPolarHBondContact O-CB 3.16Å; A164-A168 PolarHBondContact O-N 2.88Å
165	I	41.1	Very low	44.9	Very low	102 Å²	102	106.3 Å²	106.3	52%	0.523	59%	0.586	S	S	.	*	H	α-helix	trans	-78.9	-36.7	171.4	-72.7	159.8	0	0	0	110.7	N161 V162 V163 L169	N161-I165 WeakPolarHBondContact O-CD1 3.28Å; N161-I165 WeakPolarHBondContact O-CG1 3.22Å; N161-I165 PolarHBondContact O-N 2.9Å; V162-I165 WeakPolarHBondContact O-CB 3.29Å; V162-I165 PolarHBondContact O-N 3.49Å; V163-I165 PolarHBondContact O-N 3.11Å; I165-L169 HydrophobicContact CG2-CD1 4.33Å; I165-L169 WeakPolarHBondContact O-CB 3.41Å; I165-L169 WeakPolarHBondContact O-CG 2.92Å; I165-L169 PolarHBondContact O-N 2.77Å
166	E	44	Very low	45.6	Very low	120 Å²	120	105.7 Å²	105.7	56%	0.561	58%	0.575	S	S	*	*	H	α-helix	trans	-67.5	-40.1	170.9	-78	-169.5	130.7	0	0	112.7	V162 V163 L169 K170	V162-E166 PolarHBondContact O-N 3.38Å; V162-E166 VanDerWaalsContact O-N 3.12Å; V163-E166 PolarHBondContact O-N 2.76Å; V163-E166 VanDerWaalsContact O-N 3.12Å; E166-L169 WeakPolarHBondContact O-CB 2.91Å; E166-L169 PolarHBondContact O-N 3.27Å; E166-K170 PolarHBondContact O-N 3.18Å
167	D	52.1	Low	46.5	Very low	79 Å²	79	103.1 Å²	103.1	42%	0.422	56%	0.562	S	S	.	*	H	α-helix	trans	-73.8	-32.7	176.1	-69.5	-26.8	0	0	0	111.8	V163 L169 K170 L171	V163-D167 PolarHBondContact O-N 3.3Å; D167-L169 VanDerWaalsContact C-N 3.3Å; D167-L169 PolarHBondContact O-N 2.83Å; D167-K170 PolarHBondContact O-N 3.21Å; D167-K170 IonicContact OD1-NZ 2.8Å; D167-K170 PolarHBondContact OD1-NZ 3.02Å; D167-L171 WeakPolarHBondContact O-CB 3.44Å; D167-L171 PolarHBondContact O-N 3.43Å
168	A	48.9	Very low	47.8	Very low	51 Å²	51	100.7 Å²	100.7	42%	0.421	55%	0.549	S	S	.	.	H	α-helix	trans	-63.5	-34.4	166.1	0	0	0	0	0	112.3	A164 L171 E172	A164-A168 WeakPolarHBondContact O-CB 3.16Å; A164-A168 PolarHBondContact O-N 2.88Å; A168-L171 PolarHBondContact O-N 2.95Å; A168-E172 WeakPolarHBondContact O-CB 3.23Å; A168-E172 VanDerWaalsContact O-CG 3.3Å; A168-E172 WeakPolarHBondContact O-CG 3.46Å; A168-E172 PolarHBondContact O-N 3.27Å
169	L	44.7	Very low	48.9	Very low	103 Å²	103	100.3 Å²	100.3	54%	0.539	55%	0.546	S	S	.	.	H	α-helix	trans	-69.1	-37.3	174.3	-92.3	159.8	0	0	0	112.9	I165 E166 D167 C173	I165-L169 HydrophobicContact CG2-CD1 4.33Å; I165-L169 WeakPolarHBondContact O-CB 3.41Å; I165-L169 WeakPolarHBondContact O-CG 2.92Å; I165-L169 PolarHBondContact O-N 2.77Å; E166-L169 WeakPolarHBondContact O-CB 2.91Å; E166-L169 PolarHBondContact O-N 3.27Å; D167-L169 VanDerWaalsContact C-N 3.3Å; D167-L169 PolarHBondContact O-N 2.83Å; L169-C173 PolarHBondContact O-N 3.22Å; L169-C173 PolarHBondContact O-SG 3.09Å; L169-C173 VanDerWaalsContact O-SG 3.37Å
170	K	55.9	Low	49.6	Very low	123 Å²	123	93.9 Å²	93.9	54%	0.535	52%	0.524	S	S	.	.	H	α-helix	trans	-66.2	-40.6	171.1	-68.1	172.2	-160.2	146.5	0	111.3	E166 D167 C173 E174	E166-K170 PolarHBondContact O-N 3.18Å; D167-K170 PolarHBondContact O-N 3.21Å; D167-K170 IonicContact OD1-NZ 2.8Å; D167-K170 PolarHBondContact OD1-NZ 3.02Å; K170-C173 WeakPolarHBondContact O-CB 3.42Å; K170-C173 PolarHBondContact O-N 2.78Å; K170-C173 VanDerWaalsContact O-N 3.15Å; K170-E174 PolarHBondContact O-N 2.73Å
171	L	57.6	Low	50.6	Low	121 Å²	121	92.6 Å²	92.6	63%	0.634	52%	0.519	S	S	*	.	H	α-helix	trans	-68.2	-34.4	177.7	-161	146.9	0	0	0	111.9	D167 A168 H175	D167-L171 WeakPolarHBondContact O-CB 3.44Å; D167-L171 PolarHBondContact O-N 3.43Å; A168-L171 PolarHBondContact O-N 2.95Å; L171-H175 VanDerWaalsContact O-CB 3.23Å; L171-H175 WeakPolarHBondContact O-CB 2.86Å; L171-H175 PolarHBondContact O-N 3.48Å
172	E	45.5	Very low	52	Low	118 Å²	118	95.3 Å²	95.3	55%	0.551	53%	0.529	S	S	*	.	H	α-helix	trans	-64.6	-40.6	167.1	-78.4	-91.9	151.8	0	0	112	A168 H175 L176	A168-E172 WeakPolarHBondContact O-CB 3.23Å; A168-E172 VanDerWaalsContact O-CG 3.3Å; A168-E172 WeakPolarHBondContact O-CG 3.46Å; A168-E172 PolarHBondContact O-N 3.27Å; E172-H175 PolarHBondContact O-N 3.1Å; E172-L176 WeakPolarHBondContact O-CB 3.15Å; E172-L176 WeakPolarHBondContact O-CG 3.08Å; E172-L176 PolarHBondContact O-N 2.97Å
173	C	45.7	Very low	52.6	Low	71 Å²	71	92.6 Å²	92.6	48%	0.48	51%	0.514	S	S	.	.	H	α-helix	trans	-64.8	-42.9	174.4	-76.2	0	0	0	0	112.6	L169 K170 H175 L176 D177	L169-C173 PolarHBondContact O-N 3.22Å; L169-C173 PolarHBondContact O-SG 3.09Å; L169-C173 VanDerWaalsContact O-SG 3.37Å; K170-C173 WeakPolarHBondContact O-CB 3.42Å; K170-C173 PolarHBondContact O-N 2.78Å; K170-C173 VanDerWaalsContact O-N 3.15Å; C173-H175 VanDerWaalsContact C-N 3.34Å; C173-L176 WeakPolarHBondContact O-CB 3.31Å; C173-L176 PolarHBondContact O-N 2.84Å; C173-D177 PolarHBondContact O-N 3.09Å
174	E	58.4	Low	52.9	Low	141 Å²	141	91.8 Å²	91.8	66%	0.659	51%	0.507	S	S	*	.	H	α-helix	trans	-67.8	-34.6	174.6	-70.5	-179.7	174	0	0	111.6	K170 D177 A178	K170-E174 PolarHBondContact O-N 2.73Å; E174-D177 PolarHBondContact O-N 2.87Å; E174-A178 WeakPolarHBondContact O-CB 3.34Å; E174-A178 PolarHBondContact O-N 3.28Å
175	H	58.4	Low	53.6	Low	128 Å²	128	92.4 Å²	92.4	59%	0.593	51%	0.508	S	S	*	.	H	α-helix	trans	-66.8	-35.1	171.5	-170.4	64.5	0	0	0	112.3	L171 E172 C173 S179	L171-H175 VanDerWaalsContact O-CB 3.23Å; L171-H175 WeakPolarHBondContact O-CB 2.86Å; L171-H175 PolarHBondContact O-N 3.48Å; E172-H175 PolarHBondContact O-N 3.1Å; C173-H175 VanDerWaalsContact C-N 3.34Å; H175-S179 VanDerWaalsContact O-CB 3.3Å; H175-S179 WeakPolarHBondContact O-CB 3.27Å; H175-S179 PolarHBondContact O-N 3.44Å
176	L	49.5	Very low	54.5	Low	98 Å²	98	89.7 Å²	89.7	51%	0.513	50%	0.501	S	S	.	.	H	α-helix	trans	-66.4	-46	172.3	-84.3	159.7	0	0	0	111.8	E172 C173 A178 S179 V180	E172-L176 WeakPolarHBondContact O-CB 3.15Å; E172-L176 WeakPolarHBondContact O-CG 3.08Å; E172-L176 PolarHBondContact O-N 2.97Å; C173-L176 WeakPolarHBondContact O-CB 3.31Å; C173-L176 PolarHBondContact O-N 2.84Å; L176-A178 VanDerWaalsContact C-N 3.34Å; L176-A178 PolarHBondContact O-N 3.08Å; L176-S179 PolarHBondContact O-N 2.93Å; L176-V180 WeakPolarHBondContact O-CB 3.36Å; L176-V180 VanDerWaalsContact O-CG2 3.31Å; L176-V180 WeakPolarHBondContact O-CG2 3.2Å; L176-V180 PolarHBondContact O-N 2.9Å
177	D	51.9	Low	54.9	Low	117 Å²	117	89.6 Å²	89.6	63%	0.626	50%	0.498	S	S	*	.	H	α-helix	trans	-64.7	-37.7	176.3	-81.6	-24.2	0	0	0	111.9	C173 E174 V180 A181	C173-D177 PolarHBondContact O-N 3.09Å; E174-D177 PolarHBondContact O-N 2.87Å; D177-V180 PolarHBondContact O-N 2.94Å; D177-A181 WeakPolarHBondContact O-CB 3.13Å; D177-A181 PolarHBondContact O-N 3.27Å
178	A	63.4	Low	55.3	Low	57 Å²	57	94.2 Å²	94.2	47%	0.471	51%	0.51	S	S	.	.	H	α-helix	trans	-63.1	-44.7	171.2	0	0	0	0	0	112.1	E174 L176 V180 A181 E182	E174-A178 WeakPolarHBondContact O-CB 3.34Å; E174-A178 PolarHBondContact O-N 3.28Å; L176-A178 VanDerWaalsContact C-N 3.34Å; L176-A178 PolarHBondContact O-N 3.08Å; A178-V180 VanDerWaalsContact C-N 3.32Å; A178-V180 PolarHBondContact O-N 3.36Å; A178-A181 PolarHBondContact O-N 3.24Å; A178-E182 WeakPolarHBondContact O-CB 3.19Å; A178-E182 PolarHBondContact O-N 3.12Å
179	S	55.7	Low	56.1	Low	61 Å²	61	98.6 Å²	98.6	43%	0.427	52%	0.521	S	S	.	.	H	α-helix	trans	-64.2	-35.4	175.5	-170.9	0	0	0	0	112.3	H175 L176 E182 S183	H175-S179 VanDerWaalsContact O-CB 3.3Å; H175-S179 WeakPolarHBondContact O-CB 3.27Å; H175-S179 PolarHBondContact O-N 3.44Å; L176-S179 PolarHBondContact O-N 2.93Å; S179-E182 PolarHBondContact O-N 3.39Å; S179-S183 WeakPolarHBondContact O-CB 3.46Å; S179-S183 PolarHBondContact O-N 3.46Å
180	V	52.5	Low	56.8	Low	74 Å²	74	97.7 Å²	97.7	45%	0.448	52%	0.52	S	S	.	.	H	α-helix	trans	-67.5	-43.7	173.2	168.8	0	0	0	0	110.8	L176 D177 A178 E182 S183 I184	L176-V180 WeakPolarHBondContact O-CB 3.36Å; L176-V180 VanDerWaalsContact O-CG2 3.31Å; L176-V180 WeakPolarHBondContact O-CG2 3.2Å; L176-V180 PolarHBondContact O-N 2.9Å; D177-V180 PolarHBondContact O-N 2.94Å; A178-V180 VanDerWaalsContact C-N 3.32Å; A178-V180 PolarHBondContact O-N 3.36Å; V180-E182 VanDerWaalsContact C-N 3.35Å; V180-E182 PolarHBondContact O-N 3.48Å; V180-S183 WeakPolarHBondContact O-CB 3.31Å; V180-S183 PolarHBondContact O-N 3.22Å; V180-S183 PolarHBondContact O-OG 2.9Å; V180-I184 HydrophobicContact CG1-CD1 3.99Å; V180-I184 WeakPolarHBondContact O-CG1 3.15Å; V180-I184 PolarHBondContact O-N 3.4Å
181	A	62	Low	56.8	Low	58 Å²	58	94.2 Å²	94.2	48%	0.479	51%	0.509	S	S	.	.	H	α-helix	trans	-61.3	-41.4	174.8	0	0	0	0	0	112.1	D177 A178 I184 S185	D177-A181 WeakPolarHBondContact O-CB 3.13Å; D177-A181 PolarHBondContact O-N 3.27Å; A178-A181 PolarHBondContact O-N 3.24Å; A181-I184 PolarHBondContact O-N 2.95Å; A181-I184 VanDerWaalsContact O-N 3.15Å; A181-S185 PolarHBondContact O-N 2.9Å
182	E	66.5	Low	57.2	Low	135 Å²	135	93.6 Å²	93.6	63%	0.631	50%	0.503	S	S	*	.	H	α-helix	trans	-65.2	-36.9	173.4	-167.9	173.2	-148.3	0	0	111.9	A178 S179 V180 I184 S185 A186	A178-E182 WeakPolarHBondContact O-CB 3.19Å; A178-E182 PolarHBondContact O-N 3.12Å; S179-E182 PolarHBondContact O-N 3.39Å; V180-E182 VanDerWaalsContact C-N 3.35Å; V180-E182 PolarHBondContact O-N 3.48Å; E182-I184 VanDerWaalsContact C-N 3.27Å; E182-I184 PolarHBondContact O-N 2.82Å; E182-S185 WeakPolarHBondContact CA-OG 2.86Å; E182-S185 PolarHBondContact O-N 3.12Å; E182-S185 PolarHBondContact O-OG 3.37Å; E182-A186 VanDerWaalsContact O-CB 3.31Å; E182-A186 WeakPolarHBondContact O-CB 3.39Å; E182-A186 PolarHBondContact O-N 2.82Å
183	S	53.5	Low	58	Low	45 Å²	45	91.2 Å²	91.2	32%	0.315	50%	0.499	S	S	.	.	H	α-helix	trans	-65.1	-30.9	172	90.4	0	0	0	0	112.8	S179 V180 K187	S179-S183 WeakPolarHBondContact O-CB 3.46Å; S179-S183 PolarHBondContact O-N 3.46Å; V180-S183 WeakPolarHBondContact O-CB 3.31Å; V180-S183 PolarHBondContact O-N 3.22Å; V180-S183 PolarHBondContact O-OG 2.9Å; S183-K187 WeakPolarHBondContact O-CB 3.41Å; S183-K187 WeakPolarHBondContact O-CD 3.13Å; S183-K187 VanDerWaalsContact O-CG 3.22Å; S183-K187 WeakPolarHBondContact O-CG 3.23Å; S183-K187 PolarHBondContact O-N 2.68Å; S183-K187 VanDerWaalsContact O-N 3.11Å
184	I	54.6	Low	58.5	Low	74 Å²	74	90 Å²	90	38%	0.379	49%	0.491	S	S	.	.	H	α-helix	trans	-78.1	-39.3	177.7	-69.1	165.3	0	0	0	110.7	V180 A181 E182 K187 R188	V180-I184 HydrophobicContact CG1-CD1 3.99Å; V180-I184 WeakPolarHBondContact O-CG1 3.15Å; V180-I184 PolarHBondContact O-N 3.4Å; A181-I184 PolarHBondContact O-N 2.95Å; A181-I184 VanDerWaalsContact O-N 3.15Å; E182-I184 VanDerWaalsContact C-N 3.27Å; E182-I184 PolarHBondContact O-N 2.82Å; I184-K187 PolarHBondContact O-N 2.8Å; I184-R188 WeakPolarHBondContact O-CG 3.25Å; I184-R188 PolarHBondContact O-N 2.97Å
185	S	64.2	Low	58.9	Low	65 Å²	65	88.7 Å²	88.7	46%	0.455	48%	0.483	S	S	.	.	H	α-helix	trans	-66	-42.4	174.1	67.5	0	0	0	0	111.3	A181 E182 K187 R188 Q189	A181-S185 PolarHBondContact O-N 2.9Å; E182-S185 WeakPolarHBondContact CA-OG 2.86Å; E182-S185 PolarHBondContact O-N 3.12Å; E182-S185 PolarHBondContact O-OG 3.37Å; S185-K187 PolarHBondContact O-N 2.9Å; S185-R188 WeakPolarHBondContact O-CB 3.43Å; S185-R188 PolarHBondContact O-N 2.96Å; S185-R188 VanDerWaalsContact O-N 3.14Å; S185-Q189 PolarHBondContact O-N 2.86Å
186	A	59.8	Low	59.5	Low	45 Å²	45	88.5 Å²	88.5	37%	0.372	48%	0.481	S	S	.	.	H	α-helix	trans	-59.2	-42.3	172.4	0	0	0	0	0	112.3	E182 R188 Q189 V190	E182-A186 VanDerWaalsContact O-CB 3.31Å; E182-A186 WeakPolarHBondContact O-CB 3.39Å; E182-A186 PolarHBondContact O-N 2.82Å; A186-R188 PolarHBondContact O-N 3.12Å; A186-Q189 PolarHBondContact O-N 3.23Å; A186-V190 WeakPolarHBondContact O-CG2 3.3Å; A186-V190 PolarHBondContact O-N 3.26Å
187	K	52.8	Low	60.1	Low	117 Å²	117	87.1 Å²	87.1	51%	0.509	48%	0.476	S	S	.	.	H	α-helix	trans	-61	-42.8	173	-77.7	165.4	-174.9	164.7	0	112.3	S183 I184 S185 V190 V191	S183-K187 WeakPolarHBondContact O-CB 3.41Å; S183-K187 WeakPolarHBondContact O-CD 3.13Å; S183-K187 VanDerWaalsContact O-CG 3.22Å; S183-K187 WeakPolarHBondContact O-CG 3.23Å; S183-K187 PolarHBondContact O-N 2.68Å; S183-K187 VanDerWaalsContact O-N 3.11Å; I184-K187 PolarHBondContact O-N 2.8Å; S185-K187 PolarHBondContact O-N 2.9Å; K187-V190 PolarHBondContact O-N 3.19Å; K187-V191 WeakPolarHBondContact O-CG2 3.08Å; K187-V191 PolarHBondContact O-N 3.43Å
188	R	58.8	Low	60.7	Low	176 Å²	176	82.9 Å²	82.9	66%	0.664	46%	0.455	S	S	*	.	H	α-helix	trans	-62.4	-43.7	176	-72.4	175.4	-178.5	179.9	1.8	111.3	I184 S185 A186 V190 V191 E192	I184-R188 WeakPolarHBondContact O-CG 3.25Å; I184-R188 PolarHBondContact O-N 2.97Å; S185-R188 WeakPolarHBondContact O-CB 3.43Å; S185-R188 PolarHBondContact O-N 2.96Å; S185-R188 VanDerWaalsContact O-N 3.14Å; A186-R188 PolarHBondContact O-N 3.12Å; R188-V190 PolarHBondContact O-N 2.98Å; R188-V191 PolarHBondContact O-N 3.18Å; R188-E192 PolarHBondContact O-N 3.42Å
189	Q	66.1	Low	61	Low	143 Å²	143	83.2 Å²	83.2	67%	0.668	45%	0.451	S	S	*	.	H	α-helix	trans	-60.7	-42	176.6	-169.7	-177.2	10.2	0	0	112.4	S185 A186 E192 S193	S185-Q189 PolarHBondContact O-N 2.86Å; A186-Q189 PolarHBondContact O-N 3.23Å; Q189-E192 PolarHBondContact O-N 3.34Å; Q189-S193 WeakPolarHBondContact O-CB 3.49Å; Q189-S193 PolarHBondContact O-N 2.94Å
190	V	60.2	Low	61.5	Low	85 Å²	85	85 Å²	85	52%	0.515	46%	0.455	S	S	.	.	H	α-helix	trans	-64	-44.3	174.5	171.6	0	0	0	0	111.4	A186 K187 R188 E192 S193 C194	A186-V190 WeakPolarHBondContact O-CG2 3.3Å; A186-V190 PolarHBondContact O-N 3.26Å; K187-V190 PolarHBondContact O-N 3.19Å; R188-V190 PolarHBondContact O-N 2.98Å; V190-E192 PolarHBondContact O-N 2.79Å; V190-S193 PolarHBondContact O-N 2.91Å; V190-C194 PolarHBondContact O-N 2.98Å; V190-C194 PolarHBondContact O-SG 3.1Å
191	V	56.6	Low	62.1	Low	50 Å²	50	83.4 Å²	83.4	30%	0.303	44%	0.444	S	S	.	.	H	α-helix	trans	-64.1	-39.7	177.1	169.8	0	0	0	0	111.7	K187 R188 C194 K195 L269	K187-V191 WeakPolarHBondContact O-CG2 3.08Å; K187-V191 PolarHBondContact O-N 3.43Å; R188-V191 PolarHBondContact O-N 3.18Å; V191-C194 PolarHBondContact O-N 2.76Å; V191-K195 HydrophobicContact CG1-CD 4.37Å; V191-K195 WeakPolarHBondContact O-CG 3.44Å; V191-K195 PolarHBondContact O-N 3.44Å; V191-L269 HydrophobicContact CG1-CD1 3.83Å
192	E	65.8	Low	62.3	Low	107 Å²	107	85.5 Å²	85.5	50%	0.5	44%	0.444	S	S	.	.	H	α-helix	trans	-66.6	-39.5	173.6	-76.3	-172.2	-177.8	0	0	112.7	R188 Q189 V190 C194 K195 K196	R188-E192 PolarHBondContact O-N 3.42Å; Q189-E192 PolarHBondContact O-N 3.34Å; V190-E192 PolarHBondContact O-N 2.79Å; E192-C194 VanDerWaalsContact C-N 3.33Å; E192-C194 PolarHBondContact O-N 2.75Å; E192-K195 PolarHBondContact O-N 3.36Å; E192-K196 WeakPolarHBondContact O-CB 3.24Å; E192-K196 VanDerWaalsContact O-CG 3.29Å; E192-K196 WeakPolarHBondContact O-CG 3.41Å; E192-K196 PolarHBondContact O-N 3.43Å
193	S	61	Low	62.4	Low	68 Å²	68	83.8 Å²	83.8	48%	0.476	44%	0.436	S	S	.	.	H	α-helix	trans	-61.4	-42.5	173.2	-165.7	0	0	0	0	111.3	Q189 V190 K196 T197	Q189-S193 WeakPolarHBondContact O-CB 3.49Å; Q189-S193 PolarHBondContact O-N 2.94Å; V190-S193 PolarHBondContact O-N 2.91Å; S193-K196 PolarHBondContact O-N 3.37Å; S193-T197 WeakPolarHBondContact O-CG2 3.45Å; S193-T197 PolarHBondContact O-N 3.35Å; S193-T197 PolarHBondContact O-OG1 3.32Å
194	C	57.4	Low	62.8	Low	47 Å²	47	82.4 Å²	82.4	32%	0.318	43%	0.427	S	S	.	.	H	α-helix	trans	-65	-40.1	173.7	-74.1	0	0	0	0	112.5	V190 V191 E192 T197 T198 L265	V190-C194 PolarHBondContact O-N 2.98Å; V190-C194 PolarHBondContact O-SG 3.1Å; V191-C194 PolarHBondContact O-N 2.76Å; E192-C194 VanDerWaalsContact C-N 3.33Å; E192-C194 PolarHBondContact O-N 2.75Å; C194-T197 WeakPolarHBondContact CA-OG1 3.48Å; C194-T197 PolarHBondContact O-N 3.38Å; C194-T197 PolarHBondContact O-OG1 3.31Å; C194-T198 WeakPolarHBondContact O-CG2 3.22Å; C194-T198 PolarHBondContact O-N 3.19Å; C194-T198 PolarHBondContact O-OG1 2.84Å; C194-L265 HydrophobicContact CB-CD2 4.46Å
195	K	65.3	Low	63.4	Low	112 Å²	112	80.5 Å²	80.5	49%	0.487	42%	0.418	S	S	.	.	H	α-helix	trans	-59.8	-48.2	173.9	-76.4	174.7	179.4	-179.4	0	110.7	V191 E192 T197 T198 T199	V191-K195 HydrophobicContact CG1-CD 4.37Å; V191-K195 WeakPolarHBondContact O-CG 3.44Å; V191-K195 PolarHBondContact O-N 3.44Å; E192-K195 PolarHBondContact O-N 3.36Å; K195-T197 PolarHBondContact O-N 3.4Å; K195-T198 PolarHBondContact O-N 3.1Å; K195-T198 VanDerWaalsContact O-N 3.09Å; K195-T198 PolarHBondContact O-OG1 2.67Å; K195-T199 PolarHBondContact O-N 3.39Å
196	K	71.4	Confident	63.5	Low	125 Å²	125	80 Å²	80	54%	0.543	42%	0.417	S	S	.	.	H	α-helix	trans	-57.9	-44	175.6	-70.6	166.6	-176.5	172.3	0	112.1	E192 S193 T198 T199 L200	E192-K196 WeakPolarHBondContact O-CB 3.24Å; E192-K196 VanDerWaalsContact O-CG 3.29Å; E192-K196 WeakPolarHBondContact O-CG 3.41Å; E192-K196 PolarHBondContact O-N 3.43Å; S193-K196 PolarHBondContact O-N 3.37Å; K196-T198 VanDerWaalsContact C-N 3.33Å; K196-T198 PolarHBondContact O-N 3.19Å; K196-T199 PolarHBondContact O-N 3.37Å; K196-T199 PolarHBondContact O-OG1 3.19Å; K196-L200 WeakPolarHBondContact O-CB 3.46Å; K196-L200 VanDerWaalsContact O-CG 3.25Å; K196-L200 WeakPolarHBondContact O-CG 3.31Å; K196-L200 PolarHBondContact O-N 3.47Å
197	T	62.4	Low	63.7	Low	68 Å²	68	83.6 Å²	83.6	42%	0.417	43%	0.426	S	S	.	.	H	α-helix	trans	-66.4	-33.4	175.3	57.9	0	0	0	0	112.6	S193 C194 K195 L201	S193-T197 WeakPolarHBondContact O-CG2 3.45Å; S193-T197 PolarHBondContact O-N 3.35Å; S193-T197 PolarHBondContact O-OG1 3.32Å; C194-T197 WeakPolarHBondContact CA-OG1 3.48Å; C194-T197 PolarHBondContact O-N 3.38Å; C194-T197 PolarHBondContact O-OG1 3.31Å; K195-T197 PolarHBondContact O-N 3.4Å; T197-L201 WeakPolarHBondContact O-CB 3.48Å; T197-L201 VanDerWaalsContact O-CG 3.24Å; T197-L201 WeakPolarHBondContact O-CG 3.45Å; T197-L201 PolarHBondContact O-N 3.44Å
198	T	64.2	Low	64.3	Low	29 Å²	29	81.6 Å²	81.6	18%	0.178	42%	0.421	C	S	.	.	H	α-helix	trans	-73.7	-25.4	174.8	62.1	0	0	0	0	114.7	C194 K195 K196 Q202 L265	C194-T198 WeakPolarHBondContact O-CG2 3.22Å; C194-T198 PolarHBondContact O-N 3.19Å; C194-T198 PolarHBondContact O-OG1 2.84Å; K195-T198 PolarHBondContact O-N 3.1Å; K195-T198 VanDerWaalsContact O-N 3.09Å; K195-T198 PolarHBondContact O-OG1 2.67Å; K196-T198 VanDerWaalsContact C-N 3.33Å; K196-T198 PolarHBondContact O-N 3.19Å; T198-Q202 PolarHBondContact O-N 3.2Å; T198-L265 HydrophobicContact CG2-CD1 3.69Å
199	T	70.2	Confident	64.6	Low	64 Å²	64	78.5 Å²	78.5	39%	0.393	41%	0.41	S	S	.	.	H	α-helix	trans	-76.4	-45.5	171.1	54.9	0	0	0	0	110.6	K195 K196 L201 Q202 E203	K195-T199 PolarHBondContact O-N 3.39Å; K196-T199 PolarHBondContact O-N 3.37Å; K196-T199 PolarHBondContact O-OG1 3.19Å; T199-L201 VanDerWaalsContact C-N 3.29Å; T199-L201 PolarHBondContact O-N 3.1Å; T199-Q202 CarbonylContact O-C 3.51Å; T199-Q202 WeakPolarHBondContact O-CA 3.37Å; T199-Q202 WeakPolarHBondContact O-CB 3.19Å; T199-Q202 PolarHBondContact O-N 2.87Å; T199-E203 WeakPolarHBondContact O-CG 3.45Å; T199-E203 PolarHBondContact O-N 3.41Å
200	L	66.5	Low	64.8	Low	98 Å²	98	76.6 Å²	76.6	51%	0.513	41%	0.407	S	S	.	.	H	α-helix	trans	-56.8	-40.3	173.3	-69.7	168	0	0	0	112.2	K196 Q202 E203 A204	K196-L200 WeakPolarHBondContact O-CB 3.46Å; K196-L200 VanDerWaalsContact O-CG 3.25Å; K196-L200 WeakPolarHBondContact O-CG 3.31Å; K196-L200 PolarHBondContact O-N 3.47Å; L200-Q202 VanDerWaalsContact C-N 3.34Å; L200-Q202 PolarHBondContact O-N 2.88Å; L200-E203 PolarHBondContact O-N 3.37Å; L200-A204 WeakPolarHBondContact O-CB 3.28Å; L200-A204 PolarHBondContact O-N 2.9Å
201	L	64.4	Low	65	Low	40 Å²	40	76.5 Å²	76.5	21%	0.209	41%	0.409	C	S	.	.	H	α-helix	trans	-65.5	-33.9	172.9	-77.3	168.2	0	0	0	112.9	T197 T199 I205 F285	T197-L201 WeakPolarHBondContact O-CB 3.48Å; T197-L201 VanDerWaalsContact O-CG 3.24Å; T197-L201 WeakPolarHBondContact O-CG 3.45Å; T197-L201 PolarHBondContact O-N 3.44Å; T199-L201 VanDerWaalsContact C-N 3.29Å; T199-L201 PolarHBondContact O-N 3.1Å; L201-I205 WeakPolarHBondContact O-CD1 3.44Å; L201-I205 WeakPolarHBondContact O-CG1 3.33Å; L201-I205 PolarHBondContact O-N 3.17Å; L201-I205 VanDerWaalsContact O-N 3.11Å; L201-F285 HydrophobicContact CD1-CE2 4.4Å
202	Q	66.8	Low	65.5	Low	102 Å²	102	75.5 Å²	75.5	48%	0.477	40%	0.401	S	S	.	.	H	α-helix	trans	-73.4	-38.6	176.3	-174.3	179.8	-54.7	0	0	111.6	T198 T199 L200 I205 A206	T198-Q202 PolarHBondContact O-N 3.2Å; T199-Q202 CarbonylContact O-C 3.51Å; T199-Q202 WeakPolarHBondContact O-CA 3.37Å; T199-Q202 WeakPolarHBondContact O-CB 3.19Å; T199-Q202 PolarHBondContact O-N 2.87Å; L200-Q202 VanDerWaalsContact C-N 3.34Å; L200-Q202 PolarHBondContact O-N 2.88Å; Q202-I205 PolarHBondContact O-N 3.32Å; Q202-A206 PolarHBondContact O-N 2.62Å
203	E	68.1	Low	65.7	Low	100 Å²	100	75.5 Å²	75.5	47%	0.467	40%	0.404	S	S	.	.	H	α-helix	trans	-62	-49.5	173.6	-73.2	152.5	-159.9	0	0	110.2	T199 L200 I205 A206 E207	T199-E203 WeakPolarHBondContact O-CG 3.45Å; T199-E203 PolarHBondContact O-N 3.41Å; L200-E203 PolarHBondContact O-N 3.37Å; E203-I205 VanDerWaalsContact C-N 3.27Å; E203-I205 PolarHBondContact O-N 3Å; E203-A206 WeakPolarHBondContact O-CA 3.12Å; E203-A206 WeakPolarHBondContact O-CB 3.3Å; E203-A206 PolarHBondContact O-N 2.93Å; E203-E207 WeakPolarHBondContact O-CG 3.4Å; E203-E207 PolarHBondContact O-N 2.81Å
204	A	62.3	Low	66.2	Low	16 Å²	16	75.1 Å²	75.1	13%	0.132	41%	0.405	C	S	.	.	H	α-helix	trans	-59.4	-32.6	174	0	0	0	0	0	113.5	L200 N208 I312	L200-A204 WeakPolarHBondContact O-CB 3.28Å; L200-A204 PolarHBondContact O-N 2.9Å; A204-N208 WeakPolarHBondContact O-CB 3.3Å; A204-N208 VanDerWaalsContact O-CG 3.24Å; A204-N208 PolarHBondContact O-N 3.36Å; A204-N208 PolarHBondContact O-ND2 3.17Å; A204-I312 HydrophobicContact CB-CD1 4.41Å
205	I	66.8	Low	67	Low	34 Å²	34	75.9 Å²	75.9	17%	0.174	40%	0.401	C	S	.	.	H	α-helix	trans	-70.8	-35.2	173.1	-72.6	164.6	0	0	0	111.6	L201 Q202 E203 R209 V254 V258	L201-I205 WeakPolarHBondContact O-CD1 3.44Å; L201-I205 WeakPolarHBondContact O-CG1 3.33Å; L201-I205 PolarHBondContact O-N 3.17Å; L201-I205 VanDerWaalsContact O-N 3.11Å; Q202-I205 PolarHBondContact O-N 3.32Å; E203-I205 VanDerWaalsContact C-N 3.27Å; E203-I205 PolarHBondContact O-N 3Å; I205-R209 PolarHBondContact O-N 3.39Å; I205-V254 HydrophobicContact CD1-CG1 4.04Å; I205-V254 HydrophobicContact CG1-CG1 4.47Å; I205-V258 HydrophobicContact CD1-CG2 3.89Å
206	A	66.8	Low	67	Low	54 Å²	54	71.5 Å²	71.5	45%	0.446	38%	0.384	S	S	.	.	H	α-helix	trans	-68.9	-42	174.2	0	0	0	0	0	111.6	Q202 E203 R209 V210	Q202-A206 PolarHBondContact O-N 2.62Å; E203-A206 WeakPolarHBondContact O-CA 3.12Å; E203-A206 WeakPolarHBondContact O-CB 3.3Å; E203-A206 PolarHBondContact O-N 2.93Å; A206-R209 WeakPolarHBondContact O-CB 3.4Å; A206-R209 PolarHBondContact O-N 2.96Å; A206-V210 WeakPolarHBondContact O-CG2 3.32Å; A206-V210 PolarHBondContact O-N 3.37Å; A206-V210 VanDerWaalsContact O-N 3.1Å
207	E	63.8	Low	67.1	Low	121 Å²	121	70.3 Å²	70.3	57%	0.565	39%	0.387	S	S	*	.	H	α-helix	trans	-60.6	-44.7	174.1	-70.1	173.8	171.7	0	0	111.9	E203 R209 V210 C211	E203-E207 WeakPolarHBondContact O-CG 3.4Å; E203-E207 PolarHBondContact O-N 2.81Å; E207-R209 VanDerWaalsContact C-N 3.29Å; E207-R209 PolarHBondContact O-N 2.88Å; E207-V210 PolarHBondContact O-N 2.82Å; E207-C211 PolarHBondContact O-N 3.24Å; E207-C211 PolarHBondContact O-SG 3.45Å
208	N	65	Low	67.6	Low	75 Å²	75	75.5 Å²	75.5	40%	0.401	40%	0.399	S	S	.	.	H	α-helix	trans	-57.5	-40.8	174.8	-78.9	-43.8	0	0	0	112.1	A204 C211 F212	A204-N208 WeakPolarHBondContact O-CB 3.3Å; A204-N208 VanDerWaalsContact O-CG 3.24Å; A204-N208 PolarHBondContact O-N 3.36Å; A204-N208 PolarHBondContact O-ND2 3.17Å; N208-C211 PolarHBondContact O-N 2.9Å; N208-F212 WeakPolarHBondContact O-CB 3.48Å; N208-F212 PolarHBondContact O-N 3.37Å
209	R	65.3	Low	68	Low	111 Å²	111	76.1 Å²	76.1	42%	0.419	40%	0.401	S	S	.	.	H	α-helix	trans	-64.4	-41.2	176	-81.7	179.1	159.4	-143.3	-17.4	113.2	I205 A206 E207 C211 F212 L213 E251 Q255	I205-R209 PolarHBondContact O-N 3.39Å; A206-R209 WeakPolarHBondContact O-CB 3.4Å; A206-R209 PolarHBondContact O-N 2.96Å; E207-R209 VanDerWaalsContact C-N 3.29Å; E207-R209 PolarHBondContact O-N 2.88Å; R209-C211 VanDerWaalsContact C-N 3.34Å; R209-F212 PolarHBondContact O-N 2.81Å; R209-L213 WeakPolarHBondContact O-CB 3.36Å; R209-L213 WeakPolarHBondContact O-CG 3.37Å; R209-L213 PolarHBondContact O-N 2.93Å; R209-E251 VanDerWaalsContact CG-OE1 3.24Å; R209-E251 WeakPolarHBondContact CG-OE1 3.46Å; R209-E251 IonicContact CZ-OE2 3.17Å; R209-E251 IonicContact NE-OE1 2.85Å; R209-E251 IonicContact NE-OE2 3.68Å; R209-E251 PolarHBondContact NE-OE2 2.83Å; R209-E251 IonicContact NH2-OE2 2.72Å; R209-E251 PolarHBondContact NH2-OE2 3.17Å; R209-Q255 VanDerWaalsContact NH2-NE2 3.2Å
210	V	70.3	Confident	67.9	Low	102 Å²	102	78.5 Å²	78.5	62%	0.618	41%	0.406	S	S	*	.	H	α-helix	trans	-64.2	-42.4	175.2	175.2	0	0	0	0	110.1	A206 E207 L213 A214	A206-V210 WeakPolarHBondContact O-CG2 3.32Å; A206-V210 PolarHBondContact O-N 3.37Å; A206-V210 VanDerWaalsContact O-N 3.1Å; E207-V210 PolarHBondContact O-N 2.82Å; V210-L213 PolarHBondContact O-N 3.45Å; V210-A214 WeakPolarHBondContact O-CB 3.29Å; V210-A214 PolarHBondContact O-N 3.49Å
211	C	64.3	Low	68.2	Low	83 Å²	83	78.7 Å²	78.7	56%	0.561	40%	0.403	S	S	*	.	H	α-helix	trans	-62.1	-43.3	175.1	-64.6	0	0	0	0	112.4	E207 N208 R209 A214 W215	E207-C211 PolarHBondContact O-N 3.24Å; E207-C211 PolarHBondContact O-SG 3.45Å; N208-C211 PolarHBondContact O-N 2.9Å; R209-C211 VanDerWaalsContact C-N 3.34Å; C211-A214 PolarHBondContact O-N 2.88Å; C211-W215 WeakPolarHBondContact O-CB 3.26Å; C211-W215 PolarHBondContact O-N 3.15Å
212	F	66.7	Low	68.4	Low	29 Å²	29	80.1 Å²	80.1	13%	0.127	41%	0.411	C	S	.	.	H	α-helix	trans	-67.8	-40.2	178.8	179.5	-111.6	0	0	0	113.1	N208 R209 W215 S216 M244 E247	N208-F212 WeakPolarHBondContact O-CB 3.48Å; N208-F212 PolarHBondContact O-N 3.37Å; R209-F212 PolarHBondContact O-N 2.81Å; F212-W215 AromaticContact CD2-CE3 3.92Å; F212-W215 HydrophobicContact CD2-CE3 3.92Å; F212-W215 HydrophobicContact CD2-CZ3 4.31Å; F212-W215 AromaticContact CE2-CE3 3.74Å; F212-W215 HydrophobicContact CE2-CE3 3.74Å; F212-W215 AromaticContact CE2-CZ3 3.69Å; F212-W215 HydrophobicContact CE2-CZ3 3.69Å; F212-W215 PolarHBondContact O-N 3.23Å; F212-S216 PolarHBondContact O-N 2.92Å; F212-S216 PolarHBondContact O-OG 2.87Å; F212-M244 HydrophobicContact CZ-CG 4.27Å; F212-E247 HydrophobicContact CE2-CB 3.89Å; F212-E247 HydrophobicContact CE2-CG 4.39Å; F212-E247 WeakPolarHBondContact CE2-OE2 3.37Å; F212-E247 HydrophobicContact CZ-CB 4.08Å
213	L	70.5	Confident	68.4	Low	108 Å²	108	75.5 Å²	75.5	57%	0.565	39%	0.389	S	S	*	.	H	α-helix	trans	-65.8	-39.9	172.8	-71	173.5	0	0	0	111.7	R209 V210 S216 V217	R209-L213 WeakPolarHBondContact O-CB 3.36Å; R209-L213 WeakPolarHBondContact O-CG 3.37Å; R209-L213 PolarHBondContact O-N 2.93Å; V210-L213 PolarHBondContact O-N 3.45Å; L213-S216 WeakPolarHBondContact CA-OG 3.42Å; L213-S216 PolarHBondContact O-OG 2.82Å; L213-S216 VanDerWaalsContact O-OG 3.12Å; L213-V217 WeakPolarHBondContact O-CB 3.32Å; L213-V217 VanDerWaalsContact O-CG2 3.24Å; L213-V217 WeakPolarHBondContact O-CG2 3.21Å; L213-V217 PolarHBondContact O-N 3.17Å
214	A	72.8	Confident	68.4	Low	59 Å²	59	75 Å²	75	49%	0.488	39%	0.389	S	S	.	.	H	α-helix	trans	-64	-40.5	174.1	0	0	0	0	0	112.1	V210 C211 R218	V210-A214 WeakPolarHBondContact O-CB 3.29Å; V210-A214 PolarHBondContact O-N 3.49Å; C211-A214 PolarHBondContact O-N 2.88Å; A214-R218 VanDerWaalsContact O-CB 3.32Å; A214-R218 WeakPolarHBondContact O-CB 3.13Å; A214-R218 PolarHBondContact O-N 2.87Å
215	W	73.6	Confident	68.5	Low	63 Å²	63	79.3 Å²	79.3	24%	0.239	41%	0.407	C	S	.	.	H	α-helix	trans	-64.4	-49.3	176.7	177	85.1	0	0	0	112.5	C211 F212 V217 R218 I219 M244 E247	C211-W215 WeakPolarHBondContact O-CB 3.26Å; C211-W215 PolarHBondContact O-N 3.15Å; F212-W215 AromaticContact CD2-CE3 3.92Å; F212-W215 HydrophobicContact CD2-CE3 3.92Å; F212-W215 HydrophobicContact CD2-CZ3 4.31Å; F212-W215 AromaticContact CE2-CE3 3.74Å; F212-W215 HydrophobicContact CE2-CE3 3.74Å; F212-W215 AromaticContact CE2-CZ3 3.69Å; F212-W215 HydrophobicContact CE2-CZ3 3.69Å; F212-W215 PolarHBondContact O-N 3.23Å; W215-V217 PolarHBondContact O-N 3.39Å; W215-R218 WeakPolarHBondContact O-CB 3.27Å; W215-R218 PolarHBondContact O-N 3.17Å; W215-R218 VanDerWaalsContact O-N 3.12Å; W215-I219 HydrophobicContact CD2-CD1 3.81Å; W215-I219 HydrophobicContact CE3-CD1 4.31Å; W215-I219 HydrophobicContact CG-CD1 4.42Å; W215-I219 HydrophobicContact CH2-CD1 3.88Å; W215-I219 HydrophobicContact CZ2-CD1 3.3Å; W215-I219 HydrophobicContact CZ3-CD1 4.33Å; W215-I219 PolarHBondContact O-N 2.87Å; W215-M244 HydrophobicContact CZ3-CG 4.46Å; W215-E247 WeakPolarHBondContact CZ3-OE2 3.28Å
216	S	64.9	Low	68.3	Low	20 Å²	20	81.5 Å²	81.5	14%	0.14	42%	0.419	C	S	.	.	H	α-helix	trans	-64.5	-37.8	178.2	51.4	0	0	0	0	112.6	F212 L213 F220	F212-S216 PolarHBondContact O-N 2.92Å; F212-S216 PolarHBondContact O-OG 2.87Å; L213-S216 WeakPolarHBondContact CA-OG 3.42Å; L213-S216 PolarHBondContact O-OG 2.82Å; L213-S216 VanDerWaalsContact O-OG 3.12Å; S216-F220 VanDerWaalsContact O-CB 3.28Å; S216-F220 WeakPolarHBondContact O-CB 3.47Å; S216-F220 PolarHBondContact O-N 3.48Å
217	V	73.7	Confident	68	Low	100 Å²	100	81.1 Å²	81.1	61%	0.606	42%	0.416	S	S	*	.	H	α-helix	trans	-64.2	-39.3	171	169.2	0	0	0	0	111.8	L213 W215 K221	L213-V217 WeakPolarHBondContact O-CB 3.32Å; L213-V217 VanDerWaalsContact O-CG2 3.24Å; L213-V217 WeakPolarHBondContact O-CG2 3.21Å; L213-V217 PolarHBondContact O-N 3.17Å; W215-V217 PolarHBondContact O-N 3.39Å; V217-K221 WeakPolarHBondContact O-CB 3.35Å; V217-K221 PolarHBondContact O-N 2.91Å
218	R	73.4	Confident	67.8	Low	177 Å²	177	83.5 Å²	83.5	67%	0.668	43%	0.427	S	S	*	.	H	α-helix	trans	-64	-50.3	177.7	-167	171.3	-169.2	148.9	0.9	111.2	A214 W215 F220 K221 D222	A214-R218 VanDerWaalsContact O-CB 3.32Å; A214-R218 WeakPolarHBondContact O-CB 3.13Å; A214-R218 PolarHBondContact O-N 2.87Å; W215-R218 WeakPolarHBondContact O-CB 3.27Å; W215-R218 PolarHBondContact O-N 3.17Å; W215-R218 VanDerWaalsContact O-N 3.12Å; R218-F220 PolarHBondContact O-N 2.72Å; R218-K221 WeakPolarHBondContact O-CB 3.42Å; R218-K221 PolarHBondContact O-N 3.43Å; R218-K221 VanDerWaalsContact O-N 3.16Å; R218-D222 PolarHBondContact O-N 2.98Å
219	I	71.5	Confident	67.7	Low	42 Å²	42	87 Å²	87	22%	0.215	44%	0.441	C	S	.	.	H	α-helix	trans	-67.6	-35.9	178.5	-56.7	173	0	0	0	111.6	W215 K221 D222 L223 L240	W215-I219 HydrophobicContact CD2-CD1 3.81Å; W215-I219 HydrophobicContact CE3-CD1 4.31Å; W215-I219 HydrophobicContact CG-CD1 4.42Å; W215-I219 HydrophobicContact CH2-CD1 3.88Å; W215-I219 HydrophobicContact CZ2-CD1 3.3Å; W215-I219 HydrophobicContact CZ3-CD1 4.33Å; W215-I219 PolarHBondContact O-N 2.87Å; I219-K221 VanDerWaalsContact C-N 3.27Å; I219-K221 PolarHBondContact O-N 3.34Å; I219-D222 PolarHBondContact O-N 3.49Å; I219-L223 HydrophobicContact CG2-CD1 3.81Å; I219-L223 HydrophobicContact CG2-CG 4.02Å; I219-L223 VanDerWaalsContact O-CB 3.3Å; I219-L223 WeakPolarHBondContact O-CB 3.26Å; I219-L223 VanDerWaalsContact O-CG 3.26Å; I219-L223 WeakPolarHBondContact O-CG 3.28Å; I219-L223 PolarHBondContact O-N 3.43Å; I219-L240 HydrophobicContact CB-CD1 3.98Å; I219-L240 HydrophobicContact CD1-CD1 4.1Å; I219-L240 HydrophobicContact CG2-CD1 3.45Å; I219-L240 VanDerWaalsContact CG2-CD1 3.45Å
220	F	68.4	Low	67.4	Low	115 Å²	115	86.2 Å²	86.2	50%	0.504	45%	0.445	S	S	.	.	H	α-helix	trans	-62.1	-36.7	174.1	-172.7	-104	0	0	0	112.1	S216 R218 L224	S216-F220 VanDerWaalsContact O-CB 3.28Å; S216-F220 WeakPolarHBondContact O-CB 3.47Å; S216-F220 PolarHBondContact O-N 3.48Å; R218-F220 PolarHBondContact O-N 2.72Å; F220-L224 HydrophobicContact CD1-CD1 3.83Å; F220-L224 HydrophobicContact CD1-CG 4.42Å; F220-L224 HydrophobicContact CE1-CD1 3.48Å; F220-L224 VanDerWaalsContact CE1-CD1 3.48Å; F220-L224 HydrophobicContact CE1-CG 4.14Å; F220-L224 HydrophobicContact CZ-CD1 4.12Å; F220-L224 HydrophobicContact CZ-CG 4.37Å; F220-L224 WeakPolarHBondContact O-CB 3.3Å; F220-L224 WeakPolarHBondContact O-CG 3.36Å; F220-L224 PolarHBondContact O-N 3.29Å
221	K	72.7	Confident	66.9	Low	101 Å²	101	87.4 Å²	87.4	44%	0.439	46%	0.455	S	S	.	.	H	α-helix	trans	-66.3	-46.7	172.5	-174.6	-170.3	174.6	-167.8	0	111.8	V217 R218 I219 L223 L224 Q225	V217-K221 WeakPolarHBondContact O-CB 3.35Å; V217-K221 PolarHBondContact O-N 2.91Å; R218-K221 WeakPolarHBondContact O-CB 3.42Å; R218-K221 PolarHBondContact O-N 3.43Å; R218-K221 VanDerWaalsContact O-N 3.16Å; I219-K221 VanDerWaalsContact C-N 3.27Å; I219-K221 PolarHBondContact O-N 3.34Å; K221-L223 VanDerWaalsContact C-N 3.31Å; K221-L223 PolarHBondContact O-N 3.36Å; K221-L224 PolarHBondContact O-N 3.47Å; K221-Q225 PolarHBondContact O-N 3.35Å
222	D	67.9	Low	66.7	Low	70 Å²	70	89.8 Å²	89.8	37%	0.374	46%	0.462	S	S	.	.	H	α-helix	trans	-64.1	-38.2	-179.9	-60.6	-24.9	0	0	0	110.8	R218 I219 Q225 L226	R218-D222 PolarHBondContact O-N 2.98Å; I219-D222 PolarHBondContact O-N 3.49Å; D222-Q225 PolarHBondContact O-N 3.2Å; D222-L226 VanDerWaalsContact O-CG 3.31Å; D222-L226 WeakPolarHBondContact O-CG 3.42Å; D222-L226 PolarHBondContact O-N 2.78Å
223	L	66.7	Low	66.3	Low	5 Å²	5	89.5 Å²	89.5	3%	0.026	46%	0.461	C	S	.	.	H	α-helix	trans	-66.1	-41.2	172.1	-73.9	168.7	0	0	0	112.8	I219 K221 Q225 L226 A227 L233 S236 Y237 L240	I219-L223 HydrophobicContact CG2-CD1 3.81Å; I219-L223 HydrophobicContact CG2-CG 4.02Å; I219-L223 VanDerWaalsContact O-CB 3.3Å; I219-L223 WeakPolarHBondContact O-CB 3.26Å; I219-L223 VanDerWaalsContact O-CG 3.26Å; I219-L223 WeakPolarHBondContact O-CG 3.28Å; I219-L223 PolarHBondContact O-N 3.43Å; K221-L223 VanDerWaalsContact C-N 3.31Å; K221-L223 PolarHBondContact O-N 3.36Å; L223-Q225 VanDerWaalsContact C-N 3.27Å; L223-Q225 PolarHBondContact O-N 2.82Å; L223-L226 PolarHBondContact O-N 2.78Å; L223-A227 VanDerWaalsContact O-CB 3.31Å; L223-A227 WeakPolarHBondContact O-CB 3.36Å; L223-A227 PolarHBondContact O-N 2.86Å; L223-L233 HydrophobicContact CD2-CD1 4.07Å; L223-L233 HydrophobicContact CD2-CD2 4.43Å; L223-L233 HydrophobicContact CD2-CG 4.35Å; L223-L233 WeakPolarHBondContact O-CD2 3.46Å; L223-S236 WeakPolarHBondContact CD2-OG 3.49Å; L223-Y237 HydrophobicContact CB-CE1 3.76Å; L223-Y237 HydrophobicContact CD1-CD1 3.86Å; L223-Y237 HydrophobicContact CD1-CE1 3.83Å; L223-Y237 HydrophobicContact CD2-CE1 4.37Å; L223-Y237 HydrophobicContact CG-CE1 4.21Å; L223-L240 HydrophobicContact CD1-CB 4.48Å; L223-L240 HydrophobicContact CD1-CD1 4.37Å; L223-L240 HydrophobicContact CD1-CD2 3.76Å; L223-L240 HydrophobicContact CD1-CG 4.43Å
224	L	68.2	Low	65.9	Low	89 Å²	89	88 Å²	88	47%	0.466	47%	0.465	S	S	.	.	H	α-helix	trans	-63	-33.4	173.8	-80.1	173.5	0	0	0	112.5	F220 K221	F220-L224 HydrophobicContact CD1-CD1 3.83Å; F220-L224 HydrophobicContact CD1-CG 4.42Å; F220-L224 HydrophobicContact CE1-CD1 3.48Å; F220-L224 VanDerWaalsContact CE1-CD1 3.48Å; F220-L224 HydrophobicContact CE1-CG 4.14Å; F220-L224 HydrophobicContact CZ-CD1 4.12Å; F220-L224 HydrophobicContact CZ-CG 4.37Å; F220-L224 WeakPolarHBondContact O-CB 3.3Å; F220-L224 WeakPolarHBondContact O-CG 3.36Å; F220-L224 PolarHBondContact O-N 3.29Å; K221-L224 PolarHBondContact O-N 3.47Å
225	Q	65.3	Low	65.6	Low	107 Å²	107	89.3 Å²	89.3	50%	0.5	47%	0.47	S	S	.	.	H	α-helix	trans	-71.7	-39.9	173.6	-71.8	-174.1	-113	0	0	112	K221 D222 L223 A227 Q228	K221-Q225 PolarHBondContact O-N 3.35Å; D222-Q225 PolarHBondContact O-N 3.2Å; L223-Q225 VanDerWaalsContact C-N 3.27Å; L223-Q225 PolarHBondContact O-N 2.82Å; Q225-A227 VanDerWaalsContact C-N 3.34Å; Q225-Q228 PolarHBondContact O-N 2.89Å
226	L	63.6	Low	65.2	Low	81 Å²	81	88.6 Å²	88.6	42%	0.424	48%	0.475	S	S	.	.	H	α-helix	trans	-70.6	-28.3	176	-69.3	167.2	0	0	0	112.9	D222 L223 Q228 Q229 N230 L233	D222-L226 VanDerWaalsContact O-CG 3.31Å; D222-L226 WeakPolarHBondContact O-CG 3.42Å; D222-L226 PolarHBondContact O-N 2.78Å; L223-L226 PolarHBondContact O-N 2.78Å; L226-Q228 PolarHBondContact O-N 3.04Å; L226-Q229 PolarHBondContact O-N 3.32Å; L226-N230 PolarHBondContact O-N 3.14Å; L226-L233 HydrophobicContact CB-CD1 4.25Å; L226-L233 HydrophobicContact CB-CD2 4.38Å
227	A	60	Low	65.2	Low	46 Å²	46	91.2 Å²	91.2	38%	0.38	48%	0.482	S	S	.	.	H	α-helix	trans	-64.5	-24.3	177.1	0	0	0	0	0	113.6	L223 Q225 Q229 L233	L223-A227 VanDerWaalsContact O-CB 3.31Å; L223-A227 WeakPolarHBondContact O-CB 3.36Å; L223-A227 PolarHBondContact O-N 2.86Å; Q225-A227 VanDerWaalsContact C-N 3.34Å; A227-Q229 PolarHBondContact O-N 3.17Å; A227-L233 VanDerWaalsContact CA-CD2 3.48Å; A227-L233 HydrophobicContact CB-CD2 3.59Å
228	Q	60.1	Low	65.1	Low	171 Å²	171	88.2 Å²	88.2	80%	0.799	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-9.8	175	-66.3	-171.4	-57.2	0	0	113.2	Q225 L226	Q225-Q228 PolarHBondContact O-N 2.89Å; L226-Q228 PolarHBondContact O-N 3.04Å
229	Q	61.6	Low	64.9	Low	149 Å²	149	85 Å²	85	70%	0.696	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119	-27	-170.4	-66.2	-174.6	-15.7	0	0	114.4	L226 A227	L226-Q229 PolarHBondContact O-N 3.32Å; A227-Q229 PolarHBondContact O-N 3.17Å
230	N	58.4	Low	64.7	Low	94 Å²	94	83.9 Å²	83.9	50%	0.503	46%	0.455	S	S	.	.			trans	-140.3	127.9	-178.7	-67	-70.4	0	0	0	112.8	L226 D232	L226-N230 PolarHBondContact O-N 3.14Å; N230-D232 VanDerWaalsContact C-N 3.28Å; N230-D232 PolarHBondContact O-N 2.86Å
231	P	59.9	Low	64.8	Low	127 Å²	127	83.4 Å²	83.4	83%	0.825	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-9.6	178.1	29	-34	0	0	0	115	L233	P231-L233 VanDerWaalsContact C-N 3.25Å; P231-L233 PolarHBondContact O-N 3.15Å
232	D	61.1	Low	64.9	Low	133 Å²	133	85.8 Å²	85.8	71%	0.711	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	14.8	-176.1	-64.6	-38.2	0	0	0	115	N230 A234 S235	N230-D232 VanDerWaalsContact C-N 3.28Å; N230-D232 PolarHBondContact O-N 2.86Å; D232-A234 PolarHBondContact O-N 3.09Å; D232-A234 VanDerWaalsContact O-N 3.08Å; D232-S235 PolarHBondContact O-OG 3.47Å
233	L	57.5	Low	64.9	Low	23 Å²	23	83.9 Å²	83.9	12%	0.12	45%	0.45	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-6.4	-167.2	-159	61.9	0	0	0	115.2	L223 L226 A227 P231 S235 S236 Y237	L223-L233 HydrophobicContact CD2-CD1 4.07Å; L223-L233 HydrophobicContact CD2-CD2 4.43Å; L223-L233 HydrophobicContact CD2-CG 4.35Å; L223-L233 WeakPolarHBondContact O-CD2 3.46Å; L226-L233 HydrophobicContact CB-CD1 4.25Å; L226-L233 HydrophobicContact CB-CD2 4.38Å; A227-L233 VanDerWaalsContact CA-CD2 3.48Å; A227-L233 HydrophobicContact CB-CD2 3.59Å; P231-L233 VanDerWaalsContact C-N 3.25Å; P231-L233 PolarHBondContact O-N 3.15Å; L233-S235 PolarHBondContact O-N 2.96Å; L233-S236 PolarHBondContact O-N 3.46Å; L233-S236 VanDerWaalsContact O-N 3.1Å; L233-Y237 HydrophobicContact CB-CD2 4.31Å; L233-Y237 HydrophobicContact CB-CE2 3.94Å; L233-Y237 HydrophobicContact CD2-CD2 4.39Å; L233-Y237 HydrophobicContact CD2-CE2 3.47Å; L233-Y237 VanDerWaalsContact CD2-CE2 3.47Å; L233-Y237 WeakPolarHBondContact CD2-OH 3.49Å; L233-Y237 HydrophobicContact CG-CD2 3.99Å; L233-Y237 HydrophobicContact CG-CE2 3.54Å; L233-Y237 WeakPolarHBondContact O-CD2 3.29Å; L233-Y237 PolarHBondContact O-N 2.68Å
234	A	61.8	Low	64.9	Low	77 Å²	77	86.3 Å²	86.3	64%	0.636	46%	0.462	S	S	*	.	H	α-helix	trans	-57.2	-34	179.8	0	0	0	0	0	113.7	D232 A238	D232-A234 PolarHBondContact O-N 3.09Å; D232-A234 VanDerWaalsContact O-N 3.08Å; A234-A238 WeakPolarHBondContact O-CB 3.41Å; A234-A238 PolarHBondContact O-N 2.96Å; A234-A238 VanDerWaalsContact O-N 3.17Å
235	S	67.8	Low	65.3	Low	86 Å²	86	87.8 Å²	87.8	60%	0.601	46%	0.464	S	S	*	.	H	α-helix	trans	-64.6	-41.1	176.7	57.5	0	0	0	0	112.4	D232 L233 Q239	D232-S235 PolarHBondContact O-OG 3.47Å; L233-S235 PolarHBondContact O-N 2.96Å; S235-Q239 PolarHBondContact O-N 3.07Å; S235-Q239 VanDerWaalsContact O-N 3.15Å
236	S	64.7	Low	65.7	Low	48 Å²	48	86 Å²	86	34%	0.336	46%	0.458	S	S	.	.	H	α-helix	trans	-71	-43.4	-178.2	-160.7	0	0	0	0	112	L223 L233 A238 Q239 L240	L223-S236 WeakPolarHBondContact CD2-OG 3.49Å; L233-S236 PolarHBondContact O-N 3.46Å; L233-S236 VanDerWaalsContact O-N 3.1Å; S236-A238 PolarHBondContact O-N 2.89Å; S236-Q239 PolarHBondContact O-N 3.45Å; S236-L240 PolarHBondContact O-N 2.95Å
237	Y	64.8	Low	65.9	Low	75 Å²	75	84.1 Å²	84.1	29%	0.294	45%	0.447	S	S	.	.	H	α-helix	trans	-60.7	-44	173.4	-70.2	-63.2	0	0	0	112.4	L223 L233 Q239 L240 E241	L223-Y237 HydrophobicContact CB-CE1 3.76Å; L223-Y237 HydrophobicContact CD1-CD1 3.86Å; L223-Y237 HydrophobicContact CD1-CE1 3.83Å; L223-Y237 HydrophobicContact CD2-CE1 4.37Å; L223-Y237 HydrophobicContact CG-CE1 4.21Å; L233-Y237 HydrophobicContact CB-CD2 4.31Å; L233-Y237 HydrophobicContact CB-CE2 3.94Å; L233-Y237 HydrophobicContact CD2-CD2 4.39Å; L233-Y237 HydrophobicContact CD2-CE2 3.47Å; L233-Y237 VanDerWaalsContact CD2-CE2 3.47Å; L233-Y237 WeakPolarHBondContact CD2-OH 3.49Å; L233-Y237 HydrophobicContact CG-CD2 3.99Å; L233-Y237 HydrophobicContact CG-CE2 3.54Å; L233-Y237 WeakPolarHBondContact O-CD2 3.29Å; L233-Y237 PolarHBondContact O-N 2.68Å; Y237-Q239 VanDerWaalsContact C-N 3.26Å; Y237-Q239 PolarHBondContact O-N 3.37Å; Y237-L240 WeakPolarHBondContact O-CB 3.34Å; Y237-L240 PolarHBondContact O-N 2.98Å; Y237-E241 PolarHBondContact O-N 2.75Å
238	A	71.9	Confident	66.4	Low	36 Å²	36	86.1 Å²	86.1	30%	0.298	45%	0.452	S	S	.	.	H	α-helix	trans	-64.7	-29.4	178.1	0	0	0	0	0	113.1	A234 S236 R242	A234-A238 WeakPolarHBondContact O-CB 3.41Å; A234-A238 PolarHBondContact O-N 2.96Å; A234-A238 VanDerWaalsContact O-N 3.17Å; S236-A238 PolarHBondContact O-N 2.89Å; A238-R242 WeakPolarHBondContact O-CG 3.34Å
239	Q	68.9	Low	67.2	Low	109 Å²	109	84 Å²	84	51%	0.509	44%	0.442	S	S	.	.	H	α-helix	trans	-76	-39.6	174.8	-169.4	157.9	-26.5	0	0	111.8	S235 S236 Y237 E241 R242 N243	S235-Q239 PolarHBondContact O-N 3.07Å; S235-Q239 VanDerWaalsContact O-N 3.15Å; S236-Q239 PolarHBondContact O-N 3.45Å; Y237-Q239 VanDerWaalsContact C-N 3.26Å; Y237-Q239 PolarHBondContact O-N 3.37Å; Q239-E241 PolarHBondContact O-N 3.06Å; Q239-R242 PolarHBondContact O-N 3.1Å; Q239-N243 PolarHBondContact O-N 3.25Å
240	L	67.3	Low	67.5	Low	20 Å²	20	80 Å²	80	11%	0.105	42%	0.42	C	S	.	.	H	α-helix	trans	-58.5	-47.2	173.2	-168.7	83.4	0	0	0	112.2	I219 L223 S236 Y237 R242 N243 M244	I219-L240 HydrophobicContact CB-CD1 3.98Å; I219-L240 HydrophobicContact CD1-CD1 4.1Å; I219-L240 HydrophobicContact CG2-CD1 3.45Å; I219-L240 VanDerWaalsContact CG2-CD1 3.45Å; L223-L240 HydrophobicContact CD1-CB 4.48Å; L223-L240 HydrophobicContact CD1-CD1 4.37Å; L223-L240 HydrophobicContact CD1-CD2 3.76Å; L223-L240 HydrophobicContact CD1-CG 4.43Å; S236-L240 PolarHBondContact O-N 2.95Å; Y237-L240 WeakPolarHBondContact O-CB 3.34Å; Y237-L240 PolarHBondContact O-N 2.98Å; L240-R242 VanDerWaalsContact C-N 3.3Å; L240-R242 PolarHBondContact O-N 2.67Å; L240-N243 PolarHBondContact O-N 3.49Å; L240-M244 HydrophobicContact CD2-CE 4.06Å; L240-M244 HydrophobicContact CG-CE 4.33Å; L240-M244 PolarHBondContact O-N 3.24Å
241	E	71.1	Confident	68	Low	104 Å²	104	77.4 Å²	77.4	49%	0.486	41%	0.405	S	S	.	.	H	α-helix	trans	-61.5	-35.8	-178.4	-80.1	-161.5	-167.7	0	0	113.4	Y237 Q239 K245	Y237-E241 PolarHBondContact O-N 2.75Å; Q239-E241 PolarHBondContact O-N 3.06Å; E241-K245 WeakPolarHBondContact O-CD 3.23Å; E241-K245 VanDerWaalsContact O-CG 3.27Å; E241-K245 WeakPolarHBondContact O-CG 3.3Å; E241-K245 PolarHBondContact O-N 2.84Å; E241-K245 VanDerWaalsContact O-N 3.16Å; E241-K245 IonicContact OE2-NZ 3.17Å; E241-K245 PolarHBondContact OE2-NZ 3.33Å
242	R	74.3	Confident	68.7	Low	151 Å²	151	78.5 Å²	78.5	57%	0.57	39%	0.394	S	S	*	.	H	α-helix	trans	-67.5	-43.4	177	-68.1	177.8	-157.2	122.5	2.6	110.9	A238 Q239 L240 K245 L246	A238-R242 WeakPolarHBondContact O-CG 3.34Å; Q239-R242 PolarHBondContact O-N 3.1Å; L240-R242 VanDerWaalsContact C-N 3.3Å; L240-R242 PolarHBondContact O-N 2.67Å; R242-K245 PolarHBondContact O-N 2.69Å; R242-L246 PolarHBondContact O-N 2.95Å; R242-L246 VanDerWaalsContact O-N 3.08Å
243	N	68.9	Low	69.4	Low	31 Å²	31	75.9 Å²	75.9	17%	0.166	38%	0.379	C	S	.	.	H	α-helix	trans	-63.4	-47.9	179.1	-64.5	-9.6	0	0	0	111.1	Q239 L240 K245 L246 E247 I302	Q239-N243 PolarHBondContact O-N 3.25Å; L240-N243 PolarHBondContact O-N 3.49Å; N243-K245 VanDerWaalsContact C-N 3.3Å; N243-K245 PolarHBondContact O-N 2.88Å; N243-L246 PolarHBondContact O-N 2.89Å; N243-E247 PolarHBondContact O-N 3.15Å; N243-I302 VanDerWaalsContact ND2-CG2 3.34Å; N243-I302 WeakPolarHBondContact ND2-CG2 3.24Å
244	M	66.8	Low	70.1	Confident	56 Å²	56	76.5 Å²	76.5	28%	0.276	38%	0.384	S	S	.	.	H	α-helix	trans	-61.9	-33.4	177.1	-70.2	-160.6	-63.3	0	0	113.4	F212 W215 L240 N248	F212-M244 HydrophobicContact CZ-CG 4.27Å; W215-M244 HydrophobicContact CZ3-CG 4.46Å; L240-M244 HydrophobicContact CD2-CE 4.06Å; L240-M244 HydrophobicContact CG-CE 4.33Å; L240-M244 PolarHBondContact O-N 3.24Å; M244-N248 PolarHBondContact O-N 3.11Å; M244-N248 PolarHBondContact O-ND2 2.88Å
245	K	76.7	Confident	70.6	Confident	119 Å²	119	75.2 Å²	75.2	52%	0.517	37%	0.365	S	S	.	.	H	α-helix	trans	-67.7	-47	175.1	-74.5	164.3	-173.7	157.6	0	111	E241 R242 N243 E247 N248 E249	E241-K245 WeakPolarHBondContact O-CD 3.23Å; E241-K245 VanDerWaalsContact O-CG 3.27Å; E241-K245 WeakPolarHBondContact O-CG 3.3Å; E241-K245 PolarHBondContact O-N 2.84Å; E241-K245 VanDerWaalsContact O-N 3.16Å; E241-K245 IonicContact OE2-NZ 3.17Å; E241-K245 PolarHBondContact OE2-NZ 3.33Å; R242-K245 PolarHBondContact O-N 2.69Å; N243-K245 VanDerWaalsContact C-N 3.3Å; N243-K245 PolarHBondContact O-N 2.88Å; K245-E247 VanDerWaalsContact C-N 3.35Å; K245-E247 PolarHBondContact O-N 3.42Å; K245-N248 PolarHBondContact O-N 3Å; K245-E249 PolarHBondContact O-N 3.5Å
246	L	73.6	Confident	71.2	Confident	71 Å²	71	75.6 Å²	75.6	37%	0.372	36%	0.355	S	S	.	.	H	α-helix	trans	-58.4	-41.1	176.8	-86.1	160.1	0	0	0	113.1	R242 N243 R250	R242-L246 PolarHBondContact O-N 2.95Å; R242-L246 VanDerWaalsContact O-N 3.08Å; N243-L246 PolarHBondContact O-N 2.89Å; L246-R250 WeakPolarHBondContact O-CD 3.37Å; L246-R250 WeakPolarHBondContact O-CG 3.38Å; L246-R250 PolarHBondContact O-N 2.9Å; L246-R250 PolarHBondContact O-NE 3.02Å
247	E	66.3	Low	71.6	Confident	40 Å²	40	74.4 Å²	74.4	19%	0.187	35%	0.345	C	S	.	.	H	α-helix	trans	-72	-37.7	-179.6	-72.5	173	114.4	0	0	112.8	F212 W215 N243 K245 E249 R250 E251	F212-E247 HydrophobicContact CE2-CB 3.89Å; F212-E247 HydrophobicContact CE2-CG 4.39Å; F212-E247 WeakPolarHBondContact CE2-OE2 3.37Å; F212-E247 HydrophobicContact CZ-CB 4.08Å; W215-E247 WeakPolarHBondContact CZ3-OE2 3.28Å; N243-E247 PolarHBondContact O-N 3.15Å; K245-E247 VanDerWaalsContact C-N 3.35Å; K245-E247 PolarHBondContact O-N 3.42Å; E247-E249 PolarHBondContact O-N 3.37Å; E247-R250 PolarHBondContact O-N 3.4Å; E247-E251 PolarHBondContact O-N 3.11Å
248	N	71.2	Confident	71.9	Confident	89 Å²	89	71.8 Å²	71.8	48%	0.476	34%	0.337	S	S	.	.	H	α-helix	trans	-64	-38.2	175	-81.6	-64.3	0	0	0	112.9	M244 K245 R250 Y252	M244-N248 PolarHBondContact O-N 3.11Å; M244-N248 PolarHBondContact O-ND2 2.88Å; K245-N248 PolarHBondContact O-N 3Å; N248-R250 VanDerWaalsContact C-N 3.32Å; N248-R250 PolarHBondContact O-N 2.98Å; N248-Y252 PolarHBondContact O-N 3.36Å
249	E	76.4	Confident	72.2	Confident	126 Å²	126	76.5 Å²	76.5	59%	0.589	35%	0.351	S	S	*	.	H	α-helix	trans	-65.4	-35.9	175.5	-71.6	176	178.5	0	0	111.9	K245 E247 Y252 L253	K245-E249 PolarHBondContact O-N 3.5Å; E247-E249 PolarHBondContact O-N 3.37Å; E249-Y252 PolarHBondContact O-N 2.93Å; E249-L253 PolarHBondContact O-N 3.14Å
250	R	67.8	Low	72.6	Confident	65 Å²	65	75.2 Å²	75.2	25%	0.245	34%	0.344	C	S	.	.	H	α-helix	trans	-70.1	-42.9	178	-68.1	157.5	-168.3	-131.4	-18.9	112.2	L246 E247 N248 Y252 L253 V254 T295 E298	L246-R250 WeakPolarHBondContact O-CD 3.37Å; L246-R250 WeakPolarHBondContact O-CG 3.38Å; L246-R250 PolarHBondContact O-N 2.9Å; L246-R250 PolarHBondContact O-NE 3.02Å; E247-R250 PolarHBondContact O-N 3.4Å; N248-R250 VanDerWaalsContact C-N 3.32Å; N248-R250 PolarHBondContact O-N 2.98Å; R250-Y252 VanDerWaalsContact C-N 3.26Å; R250-Y252 PolarHBondContact O-N 3.38Å; R250-L253 PolarHBondContact O-N 2.97Å; R250-V254 PolarHBondContact O-N 2.69Å; R250-V254 VanDerWaalsContact O-N 3.08Å; R250-T295 HydrophobicContact CG-CG2 4.19Å; R250-E298 IonicContact CZ-OE2 2.63Å; R250-E298 IonicContact NH1-OE2 3.18Å; R250-E298 PolarHBondContact NH1-OE2 2.77Å; R250-E298 IonicContact NH2-OE2 3.92Å; R250-E298 PolarHBondContact NH2-OE2 3.43Å
251	E	68.2	Low	72.5	Confident	39 Å²	39	74.8 Å²	74.8	18%	0.182	34%	0.341	C	S	.	.	H	α-helix	trans	-57.1	-40.9	172.6	-79.2	-158.5	-179.7	0	0	112.3	R209 E247 L253 V254 Q255	R209-E251 VanDerWaalsContact CG-OE1 3.24Å; R209-E251 WeakPolarHBondContact CG-OE1 3.46Å; R209-E251 IonicContact CZ-OE2 3.17Å; R209-E251 IonicContact NE-OE1 2.85Å; R209-E251 IonicContact NE-OE2 3.68Å; R209-E251 PolarHBondContact NE-OE2 2.83Å; R209-E251 IonicContact NH2-OE2 2.72Å; R209-E251 PolarHBondContact NH2-OE2 3.17Å; E247-E251 PolarHBondContact O-N 3.11Å; E251-L253 VanDerWaalsContact C-N 3.34Å; E251-L253 PolarHBondContact O-N 3.06Å; E251-V254 PolarHBondContact O-N 3.1Å; E251-Q255 WeakPolarHBondContact O-CB 3.46Å; E251-Q255 WeakPolarHBondContact O-CG 3.31Å; E251-Q255 PolarHBondContact O-N 3.43Å
252	Y	74.8	Confident	72.6	Confident	151 Å²	151	74.3 Å²	74.3	59%	0.592	34%	0.335	S	S	*	.	H	α-helix	trans	-62.3	-40.7	179.5	174.5	-96.6	0	0	0	112	N248 E249 R250 K256	N248-Y252 PolarHBondContact O-N 3.36Å; E249-Y252 PolarHBondContact O-N 2.93Å; R250-Y252 VanDerWaalsContact C-N 3.26Å; R250-Y252 PolarHBondContact O-N 3.38Å; Y252-K256 HydrophobicContact CE1-CD 4.38Å; Y252-K256 VanDerWaalsContact O-CB 3.28Å; Y252-K256 WeakPolarHBondContact O-CB 3.48Å; Y252-K256 PolarHBondContact O-N 2.9Å
253	L	77.2	Confident	72.6	Confident	77 Å²	77	69.9 Å²	69.9	40%	0.403	33%	0.331	S	S	.	.	H	α-helix	trans	-65.8	-48.1	175.7	-68	172.2	0	0	0	112	E249 R250 E251 Q255 K256 D257	E249-L253 PolarHBondContact O-N 3.14Å; R250-L253 PolarHBondContact O-N 2.97Å; E251-L253 VanDerWaalsContact C-N 3.34Å; E251-L253 PolarHBondContact O-N 3.06Å; L253-Q255 VanDerWaalsContact C-N 3.34Å; L253-Q255 PolarHBondContact O-N 2.86Å; L253-K256 WeakPolarHBondContact O-CB 3.42Å; L253-K256 PolarHBondContact O-N 2.87Å; L253-K256 VanDerWaalsContact O-N 3.11Å; L253-D257 PolarHBondContact O-N 3.43Å
254	V	71.1	Confident	72.7	Confident	37 Å²	37	69.9 Å²	69.9	22%	0.224	33%	0.33	C	S	.	.	H	α-helix	trans	-59.8	-43.5	177.3	175.1	0	0	0	0	111.3	I205 R250 E251 K256 D257 V258 L288 L292	I205-V254 HydrophobicContact CD1-CG1 4.04Å; I205-V254 HydrophobicContact CG1-CG1 4.47Å; R250-V254 PolarHBondContact O-N 2.69Å; R250-V254 VanDerWaalsContact O-N 3.08Å; E251-V254 PolarHBondContact O-N 3.1Å; V254-K256 PolarHBondContact O-N 2.94Å; V254-D257 PolarHBondContact O-N 3.4Å; V254-V258 WeakPolarHBondContact O-CG2 3.1Å; V254-V258 PolarHBondContact O-N 3.46Å; V254-L288 HydrophobicContact CG2-CD2 4.41Å; V254-L292 HydrophobicContact CG2-CD1 4.5Å
255	Q	73.5	Confident	72.7	Confident	50 Å²	50	69.3 Å²	69.3	23%	0.234	33%	0.328	C	S	.	.	H	α-helix	trans	-65.1	-37.4	175.3	-75.6	-170.1	19	0	0	113.2	R209 E251 L253 D257 K259	R209-Q255 VanDerWaalsContact NH2-NE2 3.2Å; E251-Q255 WeakPolarHBondContact O-CB 3.46Å; E251-Q255 WeakPolarHBondContact O-CG 3.31Å; E251-Q255 PolarHBondContact O-N 3.43Å; L253-Q255 VanDerWaalsContact C-N 3.34Å; L253-Q255 PolarHBondContact O-N 2.86Å; Q255-D257 VanDerWaalsContact C-N 3.29Å; Q255-D257 PolarHBondContact O-N 3.39Å; Q255-K259 WeakPolarHBondContact O-CB 3.22Å; Q255-K259 WeakPolarHBondContact O-CD 3.44Å; Q255-K259 VanDerWaalsContact O-CG 3.22Å; Q255-K259 WeakPolarHBondContact O-CG 3.31Å; Q255-K259 PolarHBondContact O-N 3.01Å
256	K	79.4	Confident	72.3	Confident	93 Å²	93	67.8 Å²	67.8	40%	0.404	33%	0.326	S	S	.	.	H	α-helix	trans	-61.1	-41.6	176.6	-176.6	177.3	-176.8	176.9	0	110.4	Y252 L253 V254 K259 K260	Y252-K256 HydrophobicContact CE1-CD 4.38Å; Y252-K256 VanDerWaalsContact O-CB 3.28Å; Y252-K256 WeakPolarHBondContact O-CB 3.48Å; Y252-K256 PolarHBondContact O-N 2.9Å; L253-K256 WeakPolarHBondContact O-CB 3.42Å; L253-K256 PolarHBondContact O-N 2.87Å; L253-K256 VanDerWaalsContact O-N 3.11Å; V254-K256 PolarHBondContact O-N 2.94Å; K256-K259 PolarHBondContact O-N 3.23Å; K256-K260 WeakPolarHBondContact O-CG 3.29Å; K256-K260 PolarHBondContact O-N 3.5Å
257	D	73.2	Confident	72	Confident	23 Å²	23	68 Å²	68	12%	0.123	33%	0.328	C	S	.	.	H	α-helix	trans	-82.5	-31.4	-176.3	-76.8	13.2	0	0	0	113.3	L253 V254 Q255 K260 M261 L288	L253-D257 PolarHBondContact O-N 3.43Å; V254-D257 PolarHBondContact O-N 3.4Å; Q255-D257 VanDerWaalsContact C-N 3.29Å; Q255-D257 PolarHBondContact O-N 3.39Å; D257-K260 PolarHBondContact O-N 3.27Å; D257-K260 WeakPolarHBondContact OD1-CD 3.4Å; D257-K260 VanDerWaalsContact OD1-CE 3.24Å; D257-K260 WeakPolarHBondContact OD1-CE 3.36Å; D257-K260 IonicContact OD1-NZ 2.67Å; D257-K260 PolarHBondContact OD1-NZ 3.49Å; D257-K260 IonicContact OD2-NZ 2.58Å; D257-M261 WeakPolarHBondContact O-CG 3.4Å; D257-M261 PolarHBondContact O-N 2.89Å; D257-L288 HydrophobicContact CB-CD1 4.11Å; D257-L288 HydrophobicContact CB-CD2 4.07Å; D257-L288 HydrophobicContact CB-CG 4.33Å
258	V	71.3	Confident	71.7	Confident	20 Å²	20	66.8 Å²	66.8	12%	0.121	32%	0.323	C	S	.	.	H	α-helix	trans	-63.1	-40.6	165.7	171.6	0	0	0	0	111.6	I205 V254 M261 R262	I205-V258 HydrophobicContact CD1-CG2 3.89Å; V254-V258 WeakPolarHBondContact O-CG2 3.1Å; V254-V258 PolarHBondContact O-N 3.46Å; V258-M261 HydrophobicContact CB-CE 4.44Å; V258-M261 HydrophobicContact CG2-CE 3.89Å; V258-M261 PolarHBondContact O-N 3Å; V258-R262 PolarHBondContact O-N 3.44Å
259	K	77.1	Confident	71.1	Confident	136 Å²	136	67.6 Å²	67.6	59%	0.591	33%	0.327	S	S	*	.	H	α-helix	trans	-62.4	-42.4	172.7	-76	168.7	-177.8	171.1	0	111.8	Q255 K256 R262 A263	Q255-K259 WeakPolarHBondContact O-CB 3.22Å; Q255-K259 WeakPolarHBondContact O-CD 3.44Å; Q255-K259 VanDerWaalsContact O-CG 3.22Å; Q255-K259 WeakPolarHBondContact O-CG 3.31Å; Q255-K259 PolarHBondContact O-N 3.01Å; K256-K259 PolarHBondContact O-N 3.23Å; K259-R262 PolarHBondContact O-N 2.96Å; K259-A263 WeakPolarHBondContact O-CB 3.44Å; K259-A263 PolarHBondContact O-N 3.37Å
260	K	77.8	Confident	70.1	Confident	81 Å²	81	69.1 Å²	69.1	35%	0.352	33%	0.334	S	S	.	.	H	α-helix	trans	-63.2	-39.3	173.4	-72.6	175.9	-166	159.8	0	112.8	K256 D257 A263 L264	K256-K260 WeakPolarHBondContact O-CG 3.29Å; K256-K260 PolarHBondContact O-N 3.5Å; D257-K260 PolarHBondContact O-N 3.27Å; D257-K260 WeakPolarHBondContact OD1-CD 3.4Å; D257-K260 VanDerWaalsContact OD1-CE 3.24Å; D257-K260 WeakPolarHBondContact OD1-CE 3.36Å; D257-K260 IonicContact OD1-NZ 2.67Å; D257-K260 PolarHBondContact OD1-NZ 3.49Å; D257-K260 IonicContact OD2-NZ 2.58Å; K260-A263 PolarHBondContact O-N 3.39Å; K260-L264 WeakPolarHBondContact O-CG 3.44Å; K260-L264 PolarHBondContact O-N 3.45Å
261	M	66.8	Low	69.6	Low	11 Å²	11	70.1 Å²	70.1	5%	0.054	35%	0.347	C	S	.	.	H	α-helix	trans	-66.3	-41.4	176.2	-74.6	-171.5	-63.8	0	0	111.2	D257 V258 L264 L265 R284 L288	D257-M261 WeakPolarHBondContact O-CG 3.4Å; D257-M261 PolarHBondContact O-N 2.89Å; V258-M261 HydrophobicContact CB-CE 4.44Å; V258-M261 HydrophobicContact CG2-CE 3.89Å; V258-M261 PolarHBondContact O-N 3Å; M261-L264 PolarHBondContact O-N 3Å; M261-L265 WeakPolarHBondContact O-CB 3.24Å; M261-L265 WeakPolarHBondContact O-CG 3.42Å; M261-L265 PolarHBondContact O-N 3.35Å; M261-R284 HydrophobicContact CG-CB 4.19Å; M261-R284 HydrophobicContact SD-CB 4.31Å; M261-L288 HydrophobicContact CE-CD1 3.34Å; M261-L288 HydrophobicContact SD-CD1 4.05Å
262	R	71.5	Confident	68.9	Low	95 Å²	95	70.2 Å²	70.2	36%	0.358	36%	0.359	S	S	.	.	H	α-helix	trans	-62.2	-41.5	172.5	-173.7	174.1	-63.7	170.9	2.6	112.1	V258 K259 L265 N266	V258-R262 PolarHBondContact O-N 3.44Å; K259-R262 PolarHBondContact O-N 2.96Å; R262-L265 PolarHBondContact O-N 3.3Å; R262-N266 WeakPolarHBondContact O-CB 3.21Å; R262-N266 PolarHBondContact O-N 3.35Å; R262-N266 PolarHBondContact O-OD1 2.91Å
263	A	75.2	Confident	67.5	Low	58 Å²	58	67.4 Å²	67.4	48%	0.479	35%	0.354	S	S	.	.	H	α-helix	trans	-61.3	-46.8	175	0	0	0	0	0	111.7	K259 K260 L265 N266 D267	K259-A263 WeakPolarHBondContact O-CB 3.44Å; K259-A263 PolarHBondContact O-N 3.37Å; K260-A263 PolarHBondContact O-N 3.39Å; A263-L265 PolarHBondContact O-N 2.78Å; A263-N266 PolarHBondContact O-N 2.9Å; A263-D267 WeakPolarHBondContact O-CB 3.14Å; A263-D267 PolarHBondContact O-N 2.67Å
264	L	70.8	Confident	66.3	Low	30 Å²	30	73 Å²	73	16%	0.157	37%	0.37	C	S	.	.	H	α-helix	trans	-63.4	-37.9	175	-74.2	-174.8	0	0	0	113.4	K260 M261 S268 V277 E280 V281	K260-L264 WeakPolarHBondContact O-CG 3.44Å; K260-L264 PolarHBondContact O-N 3.45Å; M261-L264 PolarHBondContact O-N 3Å; L264-S268 WeakPolarHBondContact O-CB 3.32Å; L264-S268 PolarHBondContact O-N 2.97Å; L264-S268 PolarHBondContact O-OG 3.29Å; L264-V277 HydrophobicContact CB-CG1 4.18Å; L264-E280 HydrophobicContact CD1-CB 4.17Å; L264-E280 HydrophobicContact CD1-CG 3.57Å; L264-V281 HydrophobicContact CB-CG2 4.48Å; L264-V281 HydrophobicContact CD1-CG2 4.42Å
265	L	66.1	Low	65.6	Low	45 Å²	45	76.2 Å²	76.2	24%	0.236	39%	0.394	C	S	.	.	H	α-helix	trans	-66.6	-42.9	177.3	-79.2	163.9	0	0	0	111.2	C194 T198 M261 R262 A263 S268 L269	C194-L265 HydrophobicContact CB-CD2 4.46Å; T198-L265 HydrophobicContact CG2-CD1 3.69Å; M261-L265 WeakPolarHBondContact O-CB 3.24Å; M261-L265 WeakPolarHBondContact O-CG 3.42Å; M261-L265 PolarHBondContact O-N 3.35Å; R262-L265 PolarHBondContact O-N 3.3Å; A263-L265 PolarHBondContact O-N 2.78Å; L265-S268 PolarHBondContact O-N 3.31Å; L265-S268 PolarHBondContact O-OG 2.84Å; L265-L269 WeakPolarHBondContact O-CB 3.33Å; L265-L269 PolarHBondContact O-N 3.47Å; L265-L269 VanDerWaalsContact O-N 3.09Å
266	N	68.4	Low	65.1	Low	86 Å²	86	76 Å²	76	46%	0.46	41%	0.405	S	S	.	.	H	α-helix	trans	-65.7	-46.8	174.7	-71.5	4	0	0	0	111.6	R262 A263 S268 L269 E270	R262-N266 WeakPolarHBondContact O-CB 3.21Å; R262-N266 PolarHBondContact O-N 3.35Å; R262-N266 PolarHBondContact O-OD1 2.91Å; A263-N266 PolarHBondContact O-N 2.9Å; N266-S268 VanDerWaalsContact C-N 3.27Å; N266-S268 PolarHBondContact O-N 3.43Å; N266-L269 WeakPolarHBondContact O-CA 3.27Å; N266-L269 VanDerWaalsContact O-CB 3.29Å; N266-L269 WeakPolarHBondContact O-CB 3.4Å; N266-L269 PolarHBondContact O-N 3.37Å; N266-E270 PolarHBondContact O-N 3.39Å
267	D	67.4	Low	64	Low	77 Å²	77	72.5 Å²	72.5	41%	0.412	39%	0.391	S	S	.	.	H	α-helix	trans	-57.1	-39.5	175.4	-175.7	45.8	0	0	0	111.5	A263 L269 E270 T271	A263-D267 WeakPolarHBondContact O-CB 3.14Å; A263-D267 PolarHBondContact O-N 2.67Å; D267-L269 VanDerWaalsContact C-N 3.31Å; D267-L269 PolarHBondContact O-N 3.29Å; D267-E270 PolarHBondContact O-N 2.95Å; D267-T271 WeakPolarHBondContact O-CB 3.34Å; D267-T271 WeakPolarHBondContact O-CG2 3.34Å; D267-T271 PolarHBondContact O-N 3.33Å; D267-T271 PolarHBondContact O-OG1 3.35Å
268	S	61.1	Low	63.1	Low	14 Å²	14	75.6 Å²	75.6	10%	0.098	41%	0.405	C	S	.	.	H	α-helix	trans	-71.9	-21.4	174	74.1	0	0	0	0	115.1	L264 L265 N266 G272	L264-S268 WeakPolarHBondContact O-CB 3.32Å; L264-S268 PolarHBondContact O-N 2.97Å; L264-S268 PolarHBondContact O-OG 3.29Å; L265-S268 PolarHBondContact O-N 3.31Å; L265-S268 PolarHBondContact O-OG 2.84Å; N266-S268 VanDerWaalsContact C-N 3.27Å; N266-S268 PolarHBondContact O-N 3.43Å; S268-G272 PolarHBondContact O-N 2.96Å
269	L	58.2	Low	62.8	Low	105 Å²	105	76.8 Å²	76.8	55%	0.55	42%	0.417	S	S	.	.	H	α-helix	trans	-80.7	-28.2	175.2	-158.7	127.7	0	0	0	111.1	V191 L265 N266 D267	V191-L269 HydrophobicContact CG1-CD1 3.83Å; L265-L269 WeakPolarHBondContact O-CB 3.33Å; L265-L269 PolarHBondContact O-N 3.47Å; L265-L269 VanDerWaalsContact O-N 3.09Å; N266-L269 WeakPolarHBondContact O-CA 3.27Å; N266-L269 VanDerWaalsContact O-CB 3.29Å; N266-L269 WeakPolarHBondContact O-CB 3.4Å; N266-L269 PolarHBondContact O-N 3.37Å; D267-L269 VanDerWaalsContact C-N 3.31Å; D267-L269 PolarHBondContact O-N 3.29Å
270	E	56	Low	62.1	Low	158 Å²	158	73.2 Å²	73.2	74%	0.738	40%	0.402	S	S	*	.	H	α-helix	trans	-87.9	-34.2	176.5	-69	173	-163.6	0	0	113	N266 D267	N266-E270 PolarHBondContact O-N 3.39Å; D267-E270 PolarHBondContact O-N 2.95Å
271	T	57.6	Low	61.4	Low	86 Å²	86	71 Å²	71	53%	0.528	40%	0.395	S	S	.	.	H	α-helix	trans	-102.4	-5.3	-173.2	61.9	0	0	0	0	115.6	D267	D267-T271 WeakPolarHBondContact O-CB 3.34Å; D267-T271 WeakPolarHBondContact O-CG2 3.34Å; D267-T271 PolarHBondContact O-N 3.33Å; D267-T271 PolarHBondContact O-OG1 3.35Å
272	G	51.6	Low	61.3	Low	41 Å²	41	77 Å²	77	42%	0.423	42%	0.418	S	S	.	.			trans	81.5	145.8	-176.3	0	0	0	0	0	113.2	S268 R274	S268-G272 PolarHBondContact O-N 2.96Å; G272-R274 PolarHBondContact O-N 3.08Å
273	L	46	Very low	61.4	Low	93 Å²	93	78.6 Å²	78.6	49%	0.487	43%	0.427	S	S	.	.			trans	-70.6	82.4	-162	-157.2	78.9	0	0	0	114	S275	L273-S275 PolarHBondContact O-N 3.24Å
274	R	53	Low	61	Low	194 Å²	194	78.3 Å²	78.3	73%	0.732	41%	0.414	S	S	*	.			trans	-65.7	128.2	165.5	-72.7	-177.2	172.4	-165.2	-2.1	109.5	G272 G276 V277	G272-R274 PolarHBondContact O-N 3.08Å; R274-G276 PolarHBondContact O-N 3.48Å; R274-V277 HydrophobicContact CB-CG2 4.46Å; R274-V277 PolarHBondContact O-N 3.33Å
275	S	56.1	Low	60.6	Low	104 Å²	104	80.3 Å²	80.3	73%	0.727	42%	0.421	S	S	*	.	H	α-helix	trans	-55.4	-20.4	175.2	55.1	0	0	0	0	114.3	L273 A279	L273-S275 PolarHBondContact O-N 3.24Å; S275-A279 PolarHBondContact O-N 3.02Å
276	G	61.6	Low	60.7	Low	45 Å²	45	82.3 Å²	82.3	46%	0.464	44%	0.435	S	S	.	.	H	α-helix	trans	-65.2	-30.4	171.4	0	0	0	0	0	114.5	R274 A279 E280	R274-G276 PolarHBondContact O-N 3.48Å; G276-A279 PolarHBondContact O-N 2.64Å; G276-E280 WeakPolarHBondContact O-CB 3.36Å; G276-E280 PolarHBondContact O-N 3.3Å
277	V	56.8	Low	60.9	Low	21 Å²	21	82.7 Å²	82.7	13%	0.127	44%	0.437	C	S	.	.	H	α-helix	trans	-71.9	-41.1	179.7	-173.9	0	0	0	0	110.8	L264 R274 A279 E280 V281	L264-V277 HydrophobicContact CB-CG1 4.18Å; R274-V277 HydrophobicContact CB-CG2 4.46Å; R274-V277 PolarHBondContact O-N 3.33Å; V277-A279 VanDerWaalsContact C-N 3.26Å; V277-A279 PolarHBondContact O-N 3.48Å; V277-E280 PolarHBondContact O-N 3.42Å; V277-V281 HydrophobicContact CG1-CG2 4.1Å; V277-V281 WeakPolarHBondContact O-CB 3.37Å; V277-V281 WeakPolarHBondContact O-CG2 3.26Å; V277-V281 PolarHBondContact O-N 3.38Å
278	E	55.2	Low	60.7	Low	88 Å²	88	79.5 Å²	79.5	41%	0.411	42%	0.419	S	S	.	.	H	α-helix	trans	-58.7	-40	171.7	-67.6	-173.2	-165.6	0	0	111.8	R282	E278-R282 VanDerWaalsContact O-CB 3.27Å; E278-R282 WeakPolarHBondContact O-CB 3.39Å; E278-R282 WeakPolarHBondContact O-CD 3.38Å; E278-R282 WeakPolarHBondContact O-CG 3.4Å; E278-R282 PolarHBondContact O-N 3.11Å
279	A	64.1	Low	60.7	Low	45 Å²	45	80.5 Å²	80.5	37%	0.372	43%	0.425	S	S	.	.	H	α-helix	trans	-66.7	-40	176.8	0	0	0	0	0	112.1	S275 G276 V277 R282 K283	S275-A279 PolarHBondContact O-N 3.02Å; G276-A279 PolarHBondContact O-N 2.64Å; V277-A279 VanDerWaalsContact C-N 3.26Å; V277-A279 PolarHBondContact O-N 3.48Å; A279-R282 PolarHBondContact O-N 3.39Å; A279-K283 WeakPolarHBondContact O-CB 3.38Å; A279-K283 VanDerWaalsContact O-CG 3.28Å; A279-K283 WeakPolarHBondContact O-CG 3.46Å; A279-K283 PolarHBondContact O-N 3.24Å
280	E	63.5	Low	61.2	Low	60 Å²	60	78.6 Å²	78.6	28%	0.28	42%	0.415	S	S	.	.	H	α-helix	trans	-73.4	-38.3	179.4	-171.8	61.8	-165.3	0	0	112.5	L264 G276 V277 K283 R284	L264-E280 HydrophobicContact CD1-CB 4.17Å; L264-E280 HydrophobicContact CD1-CG 3.57Å; G276-E280 WeakPolarHBondContact O-CB 3.36Å; G276-E280 PolarHBondContact O-N 3.3Å; V277-E280 PolarHBondContact O-N 3.42Å; E280-K283 PolarHBondContact O-N 3.4Å; E280-K283 WeakPolarHBondContact OE2-CD 3.43Å; E280-K283 IonicContact OE2-NZ 3.14Å; E280-R284 WeakPolarHBondContact O-CG 3.4Å; E280-R284 PolarHBondContact O-N 3.5Å; E280-R284 IonicContact OE1-CZ 2.62Å; E280-R284 IonicContact OE1-NE 3.36Å; E280-R284 PolarHBondContact OE1-NE 3.39Å; E280-R284 IonicContact OE1-NH2 2.81Å; E280-R284 PolarHBondContact OE1-NH2 3.28Å
281	V	61.8	Low	61.6	Low	34 Å²	34	74.8 Å²	74.8	21%	0.206	40%	0.397	C	S	.	.	H	α-helix	trans	-62.7	-46.7	170.1	171.7	0	0	0	0	109.9	L264 V277 K283 R284 F285	L264-V281 HydrophobicContact CB-CG2 4.48Å; L264-V281 HydrophobicContact CD1-CG2 4.42Å; V277-V281 HydrophobicContact CG1-CG2 4.1Å; V277-V281 WeakPolarHBondContact O-CB 3.37Å; V277-V281 WeakPolarHBondContact O-CG2 3.26Å; V277-V281 PolarHBondContact O-N 3.38Å; V281-K283 PolarHBondContact O-N 3.2Å; V281-R284 PolarHBondContact O-N 3.02Å; V281-F285 VanDerWaalsContact O-CB 3.24Å; V281-F285 WeakPolarHBondContact O-CB 3.48Å; V281-F285 PolarHBondContact O-N 3.28Å
282	R	64.9	Low	61.6	Low	139 Å²	139	72 Å²	72	53%	0.525	38%	0.379	S	S	.	.	H	α-helix	trans	-58.5	-43.6	174.1	-75.4	168.5	-171	-88.1	1.1	112.3	E278 A279 F285 V286	E278-R282 VanDerWaalsContact O-CB 3.27Å; E278-R282 WeakPolarHBondContact O-CB 3.39Å; E278-R282 WeakPolarHBondContact O-CD 3.38Å; E278-R282 WeakPolarHBondContact O-CG 3.4Å; E278-R282 PolarHBondContact O-N 3.11Å; A279-R282 PolarHBondContact O-N 3.39Å; R282-F285 PolarHBondContact O-N 3.3Å; R282-V286 WeakPolarHBondContact O-CB 3.41Å; R282-V286 VanDerWaalsContact O-CG2 3.28Å; R282-V286 WeakPolarHBondContact O-CG2 3.4Å; R282-V286 PolarHBondContact O-N 3.5Å
283	K	74.2	Confident	62	Low	127 Å²	127	75.3 Å²	75.3	55%	0.552	38%	0.384	S	S	*	.	H	α-helix	trans	-60.1	-49.1	175.7	-77.7	170.9	-177.4	177.5	0	111.8	A279 E280 V281 F285 V286 L287	A279-K283 WeakPolarHBondContact O-CB 3.38Å; A279-K283 VanDerWaalsContact O-CG 3.28Å; A279-K283 WeakPolarHBondContact O-CG 3.46Å; A279-K283 PolarHBondContact O-N 3.24Å; E280-K283 PolarHBondContact O-N 3.4Å; E280-K283 WeakPolarHBondContact OE2-CD 3.43Å; E280-K283 IonicContact OE2-NZ 3.14Å; V281-K283 PolarHBondContact O-N 3.2Å; K283-F285 VanDerWaalsContact C-N 3.32Å; K283-F285 PolarHBondContact O-N 3.26Å; K283-V286 PolarHBondContact O-N 3.33Å; K283-L287 WeakPolarHBondContact O-CG 3.34Å; K283-L287 PolarHBondContact O-N 3.15Å
284	R	67	Low	63.1	Low	53 Å²	53	76.1 Å²	76.1	20%	0.2	38%	0.383	C	S	.	.	H	α-helix	trans	-65.9	-36.1	-180	-70	173.5	-169.4	-168.1	1.3	112	M261 E280 V281 L287 L288	M261-R284 HydrophobicContact CG-CB 4.19Å; M261-R284 HydrophobicContact SD-CB 4.31Å; E280-R284 WeakPolarHBondContact O-CG 3.4Å; E280-R284 PolarHBondContact O-N 3.5Å; E280-R284 IonicContact OE1-CZ 2.62Å; E280-R284 IonicContact OE1-NE 3.36Å; E280-R284 PolarHBondContact OE1-NE 3.39Å; E280-R284 IonicContact OE1-NH2 2.81Å; E280-R284 PolarHBondContact OE1-NH2 3.28Å; V281-R284 PolarHBondContact O-N 3.02Å; R284-L287 PolarHBondContact O-N 3.23Å; R284-L288 WeakPolarHBondContact O-CB 3.41Å; R284-L288 WeakPolarHBondContact O-CG 3.22Å; R284-L288 PolarHBondContact O-N 3.32Å
285	F	62	Low	63.2	Low	71 Å²	71	68.1 Å²	68.1	31%	0.311	36%	0.356	S	S	.	.	H	α-helix	trans	-63.3	-41	172.6	-160.6	-105	0	0	0	111.9	L201 V281 R282 K283 L288 T289 M316	L201-F285 HydrophobicContact CD1-CE2 4.4Å; V281-F285 VanDerWaalsContact O-CB 3.24Å; V281-F285 WeakPolarHBondContact O-CB 3.48Å; V281-F285 PolarHBondContact O-N 3.28Å; R282-F285 PolarHBondContact O-N 3.3Å; K283-F285 VanDerWaalsContact C-N 3.32Å; K283-F285 PolarHBondContact O-N 3.26Å; F285-L288 PolarHBondContact O-N 3.08Å; F285-T289 PolarHBondContact O-N 3.4Å; F285-T289 PolarHBondContact O-OG1 2.83Å; F285-M316 HydrophobicContact CD1-CE 3.82Å; F285-M316 HydrophobicContact CD1-CG 4.32Å; F285-M316 HydrophobicContact CD2-CE 3.75Å; F285-M316 HydrophobicContact CE1-CE 3.54Å; F285-M316 HydrophobicContact CE1-CG 3.39Å; F285-M316 HydrophobicContact CE1-SD 4.31Å; F285-M316 HydrophobicContact CE2-CE 3.46Å; F285-M316 VanDerWaalsContact CE2-CE 3.46Å; F285-M316 HydrophobicContact CG-CE 3.93Å; F285-M316 HydrophobicContact CZ-CE 3.35Å; F285-M316 HydrophobicContact CZ-CG 3.55Å; F285-M316 HydrophobicContact CZ-SD 4.21Å
286	V	69.4	Low	63	Low	87 Å²	87	63.4 Å²	63.4	53%	0.527	32%	0.322	S	S	.	.	H	α-helix	trans	-69.3	-38.5	175.2	169.1	0	0	0	0	112.4	R282 K283 T289 D290	R282-V286 WeakPolarHBondContact O-CB 3.41Å; R282-V286 VanDerWaalsContact O-CG2 3.28Å; R282-V286 WeakPolarHBondContact O-CG2 3.4Å; R282-V286 PolarHBondContact O-N 3.5Å; K283-V286 PolarHBondContact O-N 3.33Å; V286-T289 VanDerWaalsContact C-OG1 3.29Å; V286-T289 VanDerWaalsContact CA-OG1 3.26Å; V286-T289 WeakPolarHBondContact CA-OG1 3.33Å; V286-T289 PolarHBondContact O-N 3.24Å; V286-T289 PolarHBondContact O-OG1 3.38Å; V286-D290 PolarHBondContact O-N 3.27Å; V286-D290 VanDerWaalsContact O-N 3.1Å
287	L	71.9	Confident	63	Low	95 Å²	95	64 Å²	64	50%	0.497	32%	0.323	S	S	.	.	H	α-helix	trans	-65	-42.4	173.5	-70.2	168.5	0	0	0	111.2	K283 R284 T289 D290 E291	K283-L287 WeakPolarHBondContact O-CG 3.34Å; K283-L287 PolarHBondContact O-N 3.15Å; R284-L287 PolarHBondContact O-N 3.23Å; L287-T289 PolarHBondContact O-N 2.81Å; L287-D290 PolarHBondContact O-N 3.26Å; L287-E291 PolarHBondContact O-N 2.86Å
288	L	62.6	Low	63.1	Low	10 Å²	10	67 Å²	67	5%	0.052	34%	0.336	C	S	.	.	H	α-helix	trans	-65.1	-34.4	174.8	-77.9	165.2	0	0	0	112.8	V254 D257 M261 R284 F285 L292	V254-L288 HydrophobicContact CG2-CD2 4.41Å; D257-L288 HydrophobicContact CB-CD1 4.11Å; D257-L288 HydrophobicContact CB-CD2 4.07Å; D257-L288 HydrophobicContact CB-CG 4.33Å; M261-L288 HydrophobicContact CE-CD1 3.34Å; M261-L288 HydrophobicContact SD-CD1 4.05Å; R284-L288 WeakPolarHBondContact O-CB 3.41Å; R284-L288 WeakPolarHBondContact O-CG 3.22Å; R284-L288 PolarHBondContact O-N 3.32Å; F285-L288 PolarHBondContact O-N 3.08Å; L288-L292 WeakPolarHBondContact O-CB 3.21Å; L288-L292 VanDerWaalsContact O-CD1 3.27Å; L288-L292 WeakPolarHBondContact O-CD1 3.35Å; L288-L292 PolarHBondContact O-N 3.09Å
289	T	61.3	Low	63	Low	35 Å²	35	63.7 Å²	63.7	22%	0.215	32%	0.322	C	S	.	.	H	α-helix	trans	-62.8	-44.3	170.1	41.2	0	0	0	0	112	F285 V286 L287 L292 E293 M316	F285-T289 PolarHBondContact O-N 3.4Å; F285-T289 PolarHBondContact O-OG1 2.83Å; V286-T289 VanDerWaalsContact C-OG1 3.29Å; V286-T289 VanDerWaalsContact CA-OG1 3.26Å; V286-T289 WeakPolarHBondContact CA-OG1 3.33Å; V286-T289 PolarHBondContact O-N 3.24Å; V286-T289 PolarHBondContact O-OG1 3.38Å; L287-T289 PolarHBondContact O-N 2.81Å; T289-L292 PolarHBondContact O-N 3.21Å; T289-E293 WeakPolarHBondContact O-CB 3.48Å; T289-E293 WeakPolarHBondContact O-CG 3.43Å; T289-E293 PolarHBondContact O-N 3.03Å; T289-M316 HydrophobicContact CG2-CB 4.17Å; T289-M316 HydrophobicContact CG2-CE 3.53Å; T289-M316 HydrophobicContact CG2-CG 3.82Å; T289-M316 HydrophobicContact CG2-SD 3.29Å; T289-M316 WeakPolarHBondContact CG2-SD 3.5Å
290	D	68	Low	62.7	Low	64 Å²	64	66.4 Å²	66.4	34%	0.342	33%	0.325	S	S	.	.	H	α-helix	trans	-67.4	-39.4	-177.6	-179.5	47.3	0	0	0	111.6	V286 L287 E293 K294	V286-D290 PolarHBondContact O-N 3.27Å; V286-D290 VanDerWaalsContact O-N 3.1Å; L287-D290 PolarHBondContact O-N 3.26Å; D290-E293 PolarHBondContact O-N 2.79Å; D290-K294 VanDerWaalsContact CG-NZ 3.29Å; D290-K294 WeakPolarHBondContact O-CD 3.34Å; D290-K294 VanDerWaalsContact O-CG 3.29Å; D290-K294 WeakPolarHBondContact O-CG 3.39Å; D290-K294 PolarHBondContact O-N 2.94Å; D290-K294 VanDerWaalsContact OD1-CE 3.3Å; D290-K294 WeakPolarHBondContact OD1-CE 3.46Å; D290-K294 IonicContact OD1-NZ 2.61Å; D290-K294 PolarHBondContact OD1-NZ 2.9Å; D290-K294 WeakPolarHBondContact OD2-CE 3.27Å; D290-K294 IonicContact OD2-NZ 2.68Å; D290-K294 PolarHBondContact OD2-NZ 2.9Å
291	E	64.8	Low	62.4	Low	78 Å²	78	70.7 Å²	70.7	36%	0.364	35%	0.349	S	S	.	.	H	α-helix	trans	-66.9	-41.7	171.1	-70.7	-173.3	170.8	0	0	112.8	L287 E293 K294 T295	L287-E291 PolarHBondContact O-N 2.86Å; E291-E293 VanDerWaalsContact C-N 3.31Å; E291-E293 PolarHBondContact O-N 3.45Å; E291-K294 PolarHBondContact O-N 3.43Å; E291-T295 WeakPolarHBondContact O-CG2 3.12Å; E291-T295 PolarHBondContact O-N 2.99Å; E291-T295 PolarHBondContact O-OG1 2.85Å
292	L	58.2	Low	62	Low	27 Å²	27	73.3 Å²	73.3	14%	0.141	36%	0.361	C	S	.	.	H	α-helix	trans	-64.2	-35	173.6	-100.5	92.6	0	0	0	112.3	V254 L288 T289 T295 D296 I312	V254-L292 HydrophobicContact CG2-CD1 4.5Å; L288-L292 WeakPolarHBondContact O-CB 3.21Å; L288-L292 VanDerWaalsContact O-CD1 3.27Å; L288-L292 WeakPolarHBondContact O-CD1 3.35Å; L288-L292 PolarHBondContact O-N 3.09Å; T289-L292 PolarHBondContact O-N 3.21Å; L292-T295 PolarHBondContact O-OG1 2.78Å; L292-T295 VanDerWaalsContact O-OG1 3.09Å; L292-D296 WeakPolarHBondContact O-CB 3.46Å; L292-D296 PolarHBondContact O-N 3.25Å; L292-D296 VanDerWaalsContact O-N 3.15Å; L292-I312 HydrophobicContact CD2-CB 4.47Å; L292-I312 HydrophobicContact CD2-CD1 4.1Å; L292-I312 HydrophobicContact CD2-CG2 4.08Å
293	E	60.7	Low	61.4	Low	111 Å²	111	68.6 Å²	68.6	52%	0.519	35%	0.349	S	S	.	.	H	α-helix	trans	-69.1	-41.5	176.5	-76.9	-176.3	167.8	0	0	111.9	T289 D290 E291 D296 A297	T289-E293 WeakPolarHBondContact O-CB 3.48Å; T289-E293 WeakPolarHBondContact O-CG 3.43Å; T289-E293 PolarHBondContact O-N 3.03Å; D290-E293 PolarHBondContact O-N 2.79Å; E291-E293 VanDerWaalsContact C-N 3.31Å; E291-E293 PolarHBondContact O-N 3.45Å; E293-D296 PolarHBondContact O-N 2.84Å; E293-A297 PolarHBondContact O-N 3.31Å
294	K	67.7	Low	60.2	Low	111 Å²	111	66.5 Å²	66.5	48%	0.483	36%	0.364	S	S	.	.	H	α-helix	trans	-61.9	-48.4	173.7	-73.3	161.9	-178.7	166.3	0	112.6	D290 E291 D296 A297 E298	D290-K294 VanDerWaalsContact CG-NZ 3.29Å; D290-K294 WeakPolarHBondContact O-CD 3.34Å; D290-K294 VanDerWaalsContact O-CG 3.29Å; D290-K294 WeakPolarHBondContact O-CG 3.39Å; D290-K294 PolarHBondContact O-N 2.94Å; D290-K294 VanDerWaalsContact OD1-CE 3.3Å; D290-K294 WeakPolarHBondContact OD1-CE 3.46Å; D290-K294 IonicContact OD1-NZ 2.61Å; D290-K294 PolarHBondContact OD1-NZ 2.9Å; D290-K294 WeakPolarHBondContact OD2-CE 3.27Å; D290-K294 IonicContact OD2-NZ 2.68Å; D290-K294 PolarHBondContact OD2-NZ 2.9Å; E291-K294 PolarHBondContact O-N 3.43Å; K294-D296 VanDerWaalsContact C-N 3.26Å; K294-D296 PolarHBondContact O-N 3.49Å; K294-A297 PolarHBondContact O-N 2.92Å; K294-A297 VanDerWaalsContact O-N 3.17Å; K294-E298 PolarHBondContact O-N 3.31Å
295	T	54.6	Low	58.9	Low	25 Å²	25	67.3 Å²	67.3	15%	0.153	38%	0.382	C	S	.	.	H	α-helix	trans	-63.4	-32.7	178.6	58.3	0	0	0	0	112.7	R250 E291 L292 V299 R310	R250-T295 HydrophobicContact CG-CG2 4.19Å; E291-T295 WeakPolarHBondContact O-CG2 3.12Å; E291-T295 PolarHBondContact O-N 2.99Å; E291-T295 PolarHBondContact O-OG1 2.85Å; L292-T295 PolarHBondContact O-OG1 2.78Å; L292-T295 VanDerWaalsContact O-OG1 3.09Å; T295-V299 WeakPolarHBondContact O-CB 3.34Å; T295-V299 VanDerWaalsContact O-CG2 3.26Å; T295-V299 WeakPolarHBondContact O-CG2 3.39Å; T295-V299 PolarHBondContact O-N 3.09Å; T295-R310 PolarHBondContact OG1-NH1 3.33Å; T295-R310 VanDerWaalsContact OG1-NH1 3.14Å
296	D	53.8	Low	57.8	Low	5 Å²	5	68.8 Å²	68.8	3%	0.027	41%	0.407	C	S	.	.	H	α-helix	trans	-71.2	-30.6	177.5	-156.1	62.6	0	0	0	112.6	L292 E293 K294 K300 R310 K313	L292-D296 WeakPolarHBondContact O-CB 3.46Å; L292-D296 PolarHBondContact O-N 3.25Å; L292-D296 VanDerWaalsContact O-N 3.15Å; E293-D296 PolarHBondContact O-N 2.84Å; K294-D296 VanDerWaalsContact C-N 3.26Å; K294-D296 PolarHBondContact O-N 3.49Å; D296-K300 WeakPolarHBondContact O-CB 3.39Å; D296-K300 VanDerWaalsContact O-CD 3.3Å; D296-K300 WeakPolarHBondContact O-CD 3.37Å; D296-K300 WeakPolarHBondContact O-CG 3.48Å; D296-K300 PolarHBondContact O-N 2.91Å; D296-K300 IonicContact OD2-NZ 3.36Å; D296-K300 PolarHBondContact OD2-NZ 3.2Å; D296-R310 VanDerWaalsContact CA-NH2 3.3Å; D296-R310 IonicContact OD1-CZ 2.76Å; D296-R310 IonicContact OD1-NE 3.72Å; D296-R310 PolarHBondContact OD1-NE 3.09Å; D296-R310 IonicContact OD1-NH2 2.75Å; D296-R310 PolarHBondContact OD1-NH2 3Å; D296-K313 VanDerWaalsContact CB-NZ 3.27Å; D296-K313 VanDerWaalsContact CG-NZ 3.28Å; D296-K313 IonicContact OD2-NZ 3.95Å; D296-K313 PolarHBondContact OD2-NZ 3.41Å
297	A	60.1	Low	56.6	Low	58 Å²	58	68.2 Å²	68.2	48%	0.479	40%	0.398	S	S	.	.	H	α-helix	trans	-70.8	-43.3	173.6	0	0	0	0	0	112.2	E293 K294 L301	E293-A297 PolarHBondContact O-N 3.31Å; K294-A297 PolarHBondContact O-N 2.92Å; K294-A297 VanDerWaalsContact O-N 3.17Å; A297-L301 PolarHBondContact O-N 3.01Å
298	E	58.6	Low	55.6	Low	83 Å²	83	68 Å²	68	39%	0.388	40%	0.402	S	S	.	.	H	α-helix	trans	-71.5	-40.9	-179.2	-67	173.5	160.1	0	0	112.8	R250 K294 K300 L301 I302	R250-E298 IonicContact CZ-OE2 2.63Å; R250-E298 IonicContact NH1-OE2 3.18Å; R250-E298 PolarHBondContact NH1-OE2 2.77Å; R250-E298 IonicContact NH2-OE2 3.92Å; R250-E298 PolarHBondContact NH2-OE2 3.43Å; K294-E298 PolarHBondContact O-N 3.31Å; E298-K300 VanDerWaalsContact C-N 3.31Å; E298-K300 PolarHBondContact O-N 2.87Å; E298-L301 WeakPolarHBondContact O-CB 3.4Å; E298-L301 PolarHBondContact O-N 3.24Å; E298-L301 VanDerWaalsContact O-N 3.1Å; E298-I302 WeakPolarHBondContact O-CG1 3.37Å; E298-I302 PolarHBondContact O-N 2.98Å; E298-I302 VanDerWaalsContact O-N 3.1Å
299	V	52.9	Low	55.1	Low	20 Å²	20	75 Å²	75	12%	0.121	43%	0.434	C	S	.	.	H	α-helix	trans	-65.8	-35.9	177.1	171.6	0	0	0	0	111.2	T295 L301 I302 S303 F307	T295-V299 WeakPolarHBondContact O-CB 3.34Å; T295-V299 VanDerWaalsContact O-CG2 3.26Å; T295-V299 WeakPolarHBondContact O-CG2 3.39Å; T295-V299 PolarHBondContact O-N 3.09Å; V299-L301 VanDerWaalsContact C-N 3.29Å; V299-L301 PolarHBondContact O-N 3.3Å; V299-I302 PolarHBondContact O-N 3.45Å; V299-S303 WeakPolarHBondContact O-CB 3.35Å; V299-S303 PolarHBondContact O-N 3.11Å; V299-S303 PolarHBondContact O-OG 2.89Å; V299-F307 HydrophobicContact CG1-CD2 3.65Å; V299-F307 HydrophobicContact CG1-CE2 3.31Å; V299-F307 HydrophobicContact CG1-CZ 3.94Å
300	K	59.7	Low	54.8	Low	101 Å²	101	75.6 Å²	75.6	44%	0.439	43%	0.433	S	S	.	.	H	α-helix	trans	-64.6	-30.4	171.7	-79.4	171	176.3	158.7	0	113.1	D296 E298	D296-K300 WeakPolarHBondContact O-CB 3.39Å; D296-K300 VanDerWaalsContact O-CD 3.3Å; D296-K300 WeakPolarHBondContact O-CD 3.37Å; D296-K300 WeakPolarHBondContact O-CG 3.48Å; D296-K300 PolarHBondContact O-N 2.91Å; D296-K300 IonicContact OD2-NZ 3.36Å; D296-K300 PolarHBondContact OD2-NZ 3.2Å; E298-K300 VanDerWaalsContact C-N 3.31Å; E298-K300 PolarHBondContact O-N 2.87Å
301	L	57.1	Low	54.3	Low	151 Å²	151	76.7 Å²	76.7	79%	0.791	44%	0.443	S	S	*	.	H	α-helix	trans	-75.5	-32	176.1	-106.3	158.6	0	0	0	113.5	A297 E298 V299	A297-L301 PolarHBondContact O-N 3.01Å; E298-L301 WeakPolarHBondContact O-CB 3.4Å; E298-L301 PolarHBondContact O-N 3.24Å; E298-L301 VanDerWaalsContact O-N 3.1Å; V299-L301 VanDerWaalsContact C-N 3.29Å; V299-L301 PolarHBondContact O-N 3.3Å
302	I	52.8	Low	53.7	Low	89 Å²	89	74.2 Å²	74.2	46%	0.456	43%	0.432	S	S	.	.	H	α-helix	trans	-95.8	-32.2	-171.1	-66	168.1	0	0	0	113	N243 E298 V299	N243-I302 VanDerWaalsContact ND2-CG2 3.34Å; N243-I302 WeakPolarHBondContact ND2-CG2 3.24Å; E298-I302 WeakPolarHBondContact O-CG1 3.37Å; E298-I302 PolarHBondContact O-N 2.98Å; E298-I302 VanDerWaalsContact O-N 3.1Å; V299-I302 PolarHBondContact O-N 3.45Å
303	S	51.8	Low	53.6	Low	40 Å²	40	75.8 Å²	75.8	28%	0.28	44%	0.438	S	S	.	.	H	α-helix	trans	-94.2	-21	-166.2	61.4	0	0	0	0	115.9	V299 A305	V299-S303 WeakPolarHBondContact O-CB 3.35Å; V299-S303 PolarHBondContact O-N 3.11Å; V299-S303 PolarHBondContact O-OG 2.89Å; S303-A305 PolarHBondContact O-N 3.28Å
304	G	48.4	Very low	53.3	Low	83 Å²	83	76.7 Å²	76.7	86%	0.856	45%	0.446	S	S	*	.			trans	65	-21	179.4	0	0	0	0	0	116.3
305	A	40.3	Very low	52.8	Low	69 Å²	69	78.1 Å²	78.1	57%	0.57	45%	0.454	S	S	*	.	S	Bend	trans	-92.7	132.3	174.6	0	0	0	0	0	110.2	S303 F307	S303-A305 PolarHBondContact O-N 3.28Å; A305-F307 PolarHBondContact O-N 3.47Å
306	A	39.2	Very low	52.8	Low	103 Å²	103	78.2 Å²	78.2	85%	0.851	45%	0.453	S	S	*	.			trans	-65.6	107.2	-178.4	0	0	0	0	0	111.5
307	F	43.9	Very low	52.9	Low	75 Å²	75	86 Å²	86	33%	0.329	48%	0.482	S	S	.	.	P	Polyproline II helix	trans	-61.5	127.2	162.3	-98.6	-97.2	0	0	0	109.2	V299 A305	V299-F307 HydrophobicContact CG1-CD2 3.65Å; V299-F307 HydrophobicContact CG1-CE2 3.31Å; V299-F307 HydrophobicContact CG1-CZ 3.94Å; A305-F307 PolarHBondContact O-N 3.47Å
308	P	50.3	Low	53.1	Low	91 Å²	91	89.8 Å²	89.8	59%	0.591	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-61.2	148.8	167.5	27.7	-33.5	0	0	0	109.6	R310	P308-R310 PolarHBondContact O-N 3.38Å
309	E	52.3	Low	53	Low	156 Å²	156	88.9 Å²	88.9	73%	0.729	50%	0.497	S	S	*	.	P	Polyproline II helix	trans	-58.6	132.6	-177	-62.8	-155.3	138.6	0	0	111.7
310	R	54.9	Low	53.1	Low	47 Å²	47	92.3 Å²	92.3	18%	0.177	52%	0.517	C	S	.	.	P	Polyproline II helix	trans	-65.2	127.7	-178.8	-54.7	-177.2	-165.4	-171.1	-2.5	109.4	T295 D296 P308 I312 K313	T295-R310 PolarHBondContact OG1-NH1 3.33Å; T295-R310 VanDerWaalsContact OG1-NH1 3.14Å; D296-R310 VanDerWaalsContact CA-NH2 3.3Å; D296-R310 IonicContact OD1-CZ 2.76Å; D296-R310 IonicContact OD1-NE 3.72Å; D296-R310 PolarHBondContact OD1-NE 3.09Å; D296-R310 IonicContact OD1-NH2 2.75Å; D296-R310 PolarHBondContact OD1-NH2 3Å; P308-R310 PolarHBondContact O-N 3.38Å; R310-I312 PolarHBondContact O-N 2.93Å; R310-K313 PolarHBondContact O-N 2.94Å
311	P	57.5	Low	53	Low	87 Å²	87	90 Å²	90	57%	0.565	51%	0.514	S	S	*	.	H	α-helix	trans	-57.6	-26.7	-177.8	21.6	-33.1	0	0	0	113.2	K313	P311-K313 VanDerWaalsContact C-N 3.32Å; P311-K313 PolarHBondContact O-N 3.43Å
312	I	52.2	Low	53.1	Low	26 Å²	26	88 Å²	88	13%	0.133	50%	0.504	C	S	.	.	H	α-helix	trans	-58.4	-36.6	176.3	-60.4	164.7	0	0	0	112.6	A204 L292 R310 M316	A204-I312 HydrophobicContact CB-CD1 4.41Å; L292-I312 HydrophobicContact CD2-CB 4.47Å; L292-I312 HydrophobicContact CD2-CD1 4.1Å; L292-I312 HydrophobicContact CD2-CG2 4.08Å; R310-I312 PolarHBondContact O-N 2.93Å; I312-M316 HydrophobicContact CG2-SD 3.56Å; I312-M316 VanDerWaalsContact CG2-SD 3.56Å; I312-M316 PolarHBondContact O-N 2.86Å
313	K	57	Low	53.4	Low	61 Å²	61	86.7 Å²	86.7	27%	0.265	50%	0.5	S	S	.	.	H	α-helix	trans	-71.4	-32.4	-173.7	-76.1	-171.8	170.5	-172.7	0	113.5	D296 R310 P311	D296-K313 VanDerWaalsContact CB-NZ 3.27Å; D296-K313 VanDerWaalsContact CG-NZ 3.28Å; D296-K313 IonicContact OD2-NZ 3.95Å; D296-K313 PolarHBondContact OD2-NZ 3.41Å; R310-K313 PolarHBondContact O-N 2.94Å; P311-K313 VanDerWaalsContact C-N 3.32Å; P311-K313 PolarHBondContact O-N 3.43Å
314	L	54	Low	54.2	Low	129 Å²	129	88.3 Å²	88.3	68%	0.675	51%	0.506	S	S	*	.	H	α-helix	trans	-70.7	-52.9	-178	-151.3	79.7	0	0	0	110.2	M316 R317	L314-M316 VanDerWaalsContact C-N 3.34Å; L314-M316 PolarHBondContact O-N 2.86Å; L314-R317 PolarHBondContact O-N 3.37Å
315	Q	57.4	Low	54.6	Low	142 Å²	142	87.8 Å²	87.8	66%	0.664	49%	0.486	S	S	*	.	H	α-helix	trans	-65.1	-32.7	-175.9	-62.9	179.1	-8.6	0	0	113.1	R317	Q315-R317 VanDerWaalsContact C-N 3.31Å; Q315-R317 PolarHBondContact O-N 2.87Å
316	M	54.3	Low	55.5	Low	26 Å²	26	88.8 Å²	88.8	13%	0.128	48%	0.481	C	S	.	.	H	α-helix	trans	-68.1	-26.5	176.8	-102.5	153.3	159.1	0	0	113.9	F285 T289 I312 L314	F285-M316 HydrophobicContact CD1-CE 3.82Å; F285-M316 HydrophobicContact CD1-CG 4.32Å; F285-M316 HydrophobicContact CD2-CE 3.75Å; F285-M316 HydrophobicContact CE1-CE 3.54Å; F285-M316 HydrophobicContact CE1-CG 3.39Å; F285-M316 HydrophobicContact CE1-SD 4.31Å; F285-M316 HydrophobicContact CE2-CE 3.46Å; F285-M316 VanDerWaalsContact CE2-CE 3.46Å; F285-M316 HydrophobicContact CG-CE 3.93Å; F285-M316 HydrophobicContact CZ-CE 3.35Å; F285-M316 HydrophobicContact CZ-CG 3.55Å; F285-M316 HydrophobicContact CZ-SD 4.21Å; T289-M316 HydrophobicContact CG2-CB 4.17Å; T289-M316 HydrophobicContact CG2-CE 3.53Å; T289-M316 HydrophobicContact CG2-CG 3.82Å; T289-M316 HydrophobicContact CG2-SD 3.29Å; T289-M316 WeakPolarHBondContact CG2-SD 3.5Å; I312-M316 HydrophobicContact CG2-SD 3.56Å; I312-M316 VanDerWaalsContact CG2-SD 3.56Å; I312-M316 PolarHBondContact O-N 2.86Å; L314-M316 VanDerWaalsContact C-N 3.34Å; L314-M316 PolarHBondContact O-N 2.86Å
317	R	55.2	Low	56.8	Low	169 Å²	169	89.8 Å²	89.8	64%	0.638	47%	0.466	S	S	*	.	H	α-helix	trans	-80.2	-29.5	-169.8	-151.7	179	-151.9	-161.3	6.1	113.5	L314 Q315	L314-R317 PolarHBondContact O-N 3.37Å; Q315-R317 VanDerWaalsContact C-N 3.31Å; Q315-R317 PolarHBondContact O-N 2.87Å
318	E	66.2	Low	58	Low	138 Å²	138	90.9 Å²	90.9	65%	0.645	47%	0.472	S	S	*	.	H	α-helix	trans	-74.9	-44.9	-177.1	-172	177.4	-179.6	0	0	112	V320 S321	E318-V320 PolarHBondContact O-N 3.31Å; E318-V320 VanDerWaalsContact O-N 3.1Å; E318-S321 PolarHBondContact O-N 3.22Å; E318-S321 PolarHBondContact O-OG 3.45Å; E318-S321 VanDerWaalsContact O-OG 3.08Å
319	A	56.1	Low	58.3	Low	64 Å²	64	93.6 Å²	93.6	53%	0.529	47%	0.472	S	S	.	.	H	α-helix	trans	-61.3	-23.8	-177.3	0	0	0	0	0	114.5
320	V	54.9	Low	59.1	Low	91 Å²	91	90.4 Å²	90.4	55%	0.552	46%	0.456	S	S	*	.	H	α-helix	trans	-78.4	-41.4	-175.6	177.5	0	0	0	0	112.2	E318 N322 T323	E318-V320 PolarHBondContact O-N 3.31Å; E318-V320 VanDerWaalsContact O-N 3.1Å; V320-N322 PolarHBondContact O-N 2.97Å; V320-T323 PolarHBondContact O-OG1 3.39Å
321	S	57.3	Low	60.1	Low	53 Å²	53	94.2 Å²	94.2	37%	0.371	48%	0.476	S	S	.	.	H	α-helix	trans	-65.2	-42.1	-171.4	50.5	0	0	0	0	113.2	E318 T323 N324	E318-S321 PolarHBondContact O-N 3.22Å; E318-S321 PolarHBondContact O-OG 3.45Å; E318-S321 VanDerWaalsContact O-OG 3.08Å; S321-T323 PolarHBondContact O-N 2.93Å; S321-N324 WeakPolarHBondContact O-CA 3.35Å; S321-N324 WeakPolarHBondContact O-CB 3.38Å; S321-N324 PolarHBondContact O-N 2.86Å
322	N	58.9	Low	60.9	Low	110 Å²	110	96 Å²	96	59%	0.588	48%	0.479	S	S	*	.	H	α-helix	trans	-65.8	-37.8	-172.2	-64.8	-11.7	0	0	0	112.5	V320 N324 V325	V320-N322 PolarHBondContact O-N 2.97Å; N322-N324 PolarHBondContact O-N 2.76Å; N322-N324 VanDerWaalsContact O-N 3.09Å; N322-V325 PolarHBondContact O-N 3.04Å
323	T	59.1	Low	61.6	Low	61 Å²	61	96.7 Å²	96.7	37%	0.374	49%	0.489	S	S	.	.	H	α-helix	trans	-60.5	-23.8	173.8	71.8	0	0	0	0	112.6	K144 V320 S321 V325	K144-T323 PolarHBondContact NZ-O 2.89Å; V320-T323 PolarHBondContact O-OG1 3.39Å; S321-T323 PolarHBondContact O-N 2.93Å; T323-V325 VanDerWaalsContact C-N 3.34Å
324	N	68	Low	62.1	Low	73 Å²	73	98.7 Å²	98.7	39%	0.39	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	5	-175	-119.8	21.3	0	0	0	114	P142 A143 K144 S321 N322	P142-N324 HydrophobicContact CB-CB 4.02Å; P142-N324 WeakPolarHBondContact CB-O 3.11Å; P142-N324 HydrophobicContact CG-CB 3.61Å; P142-N324 VanDerWaalsContact CG-O 3.25Å; P142-N324 WeakPolarHBondContact CG-O 3.2Å; A143-N324 WeakPolarHBondContact CA-O 3.34Å; A143-N324 PolarHBondContact N-O 3.25Å; K144-N324 WeakPolarHBondContact CD-O 3.4Å; K144-N324 VanDerWaalsContact CE-C 3.5Å; K144-N324 WeakPolarHBondContact CE-O 3.43Å; K144-N324 WeakPolarHBondContact CE-OD1 3.3Å; K144-N324 VanDerWaalsContact CG-C 3.49Å; K144-N324 WeakPolarHBondContact CG-O 3.4Å; K144-N324 PolarHBondContact NZ-OD1 2.72Å; S321-N324 WeakPolarHBondContact O-CA 3.35Å; S321-N324 WeakPolarHBondContact O-CB 3.38Å; S321-N324 PolarHBondContact O-N 2.86Å; N322-N324 PolarHBondContact O-N 2.76Å; N322-N324 VanDerWaalsContact O-N 3.09Å
325	V	57.7	Low	63	Low	73 Å²	73	94.9 Å²	94.9	44%	0.442	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.4	22.5	171.6	-159	0	0	0	0	113.8	P142 K144 R145 N322 T323	P142-V325 HydrophobicContact CB-CG2 3.81Å; K144-V325 CarbonylContact C-O 2.77Å; K144-V325 VanDerWaalsContact CA-O 3.23Å; K144-V325 WeakPolarHBondContact CA-O 3.29Å; R145-V325 PolarHBondContact N-O 2.94Å; N322-V325 PolarHBondContact O-N 3.04Å; T323-V325 VanDerWaalsContact C-N 3.34Å
326	L	59.3	Low	63.3	Low	90 Å²	90	90.4 Å²	90.4	47%	0.471	48%	0.478	S	S	.	.	S	Bend	trans	-139.7	65.4	179.1	-58	168.4	0	0	0	119.8	K144 R145	K144-L326 VanDerWaalsContact CD-N 3.34Å; R145-L326 HydrophobicContact CB-CB 4.3Å; R145-L326 HydrophobicContact CB-CD2 4.4Å; R145-L326 VanDerWaalsContact CD-O 3.3Å; R145-L326 WeakPolarHBondContact CD-O 3.48Å; R145-L326 HydrophobicContact CG-CB 3.94Å; R145-L326 HydrophobicContact CG-CD2 3.96Å; R145-L326 PolarHBondContact NE-O 3.47Å; R145-L326 PolarHBondContact NH1-O 2.96Å
327	K	66.6	Low	63.8	Low	124 Å²	124	94.5 Å²	94.5	54%	0.539	50%	0.504	S	S	.	.	S	Bend	trans	-159.2	-70.2	171.5	-42.4	171.9	175.6	178.4	0	116.7	K144 Y329 K330	K144-K327 VanDerWaalsContact C-N 3.34Å; K144-K327 HydrophobicContact CB-CB 4.49Å; K144-K327 HydrophobicContact CD-CB 3.45Å; K144-K327 VanDerWaalsContact CD-CB 3.45Å; K144-K327 HydrophobicContact CD-CD 4.13Å; K144-K327 HydrophobicContact CD-CG 3.51Å; K144-K327 HydrophobicContact CG-CB 4.44Å; K144-K327 VanDerWaalsContact CG-N 3.33Å; K144-K327 CarbonylContact O-C 3.51Å; K144-K327 WeakPolarHBondContact O-CA 3.44Å; K144-K327 PolarHBondContact O-N 2.67Å; K144-K327 VanDerWaalsContact O-O 3.09Å; K327-Y329 PolarHBondContact O-N 3.25Å; K327-K330 VanDerWaalsContact O-CA 3.27Å; K327-K330 WeakPolarHBondContact O-CA 3.45Å; K327-K330 WeakPolarHBondContact O-CB 3.47Å; K327-K330 PolarHBondContact O-N 2.76Å
328	E	69.5	Low	64.4	Low	97 Å²	97	94.7 Å²	94.7	45%	0.453	51%	0.505	S	S	.	.	H	α-helix	trans	-36.2	-57.4	176.8	-57.6	176.4	-170.2	0	0	119.2	A143 K144 K330 E331 I332	A143-E328 HydrophobicContact CB-CG 3.98Å; A143-E328 WeakPolarHBondContact CB-OE1 3.25Å; A143-E328 WeakPolarHBondContact CB-OE2 3.34Å; K144-E328 HydrophobicContact CB-CB 3.69Å; K144-E328 HydrophobicContact CB-CG 3.9Å; K144-E328 HydrophobicContact CG-CG 4.48Å; K144-E328 CarbonylContact O-C 3.56Å; K144-E328 PolarHBondContact O-N 2.96Å; E328-K330 PolarHBondContact O-N 3.25Å; E328-K330 VanDerWaalsContact O-N 3.09Å; E328-E331 WeakPolarHBondContact O-CA 3.42Å; E328-E331 VanDerWaalsContact O-CB 3.25Å; E328-E331 WeakPolarHBondContact O-CB 3.42Å; E328-E331 PolarHBondContact O-N 3.2Å; E328-I332 PolarHBondContact O-N 3.22Å
329	Y	56.5	Low	64.6	Low	149 Å²	149	97 Å²	97	58%	0.584	51%	0.508	S	S	*	.	H	α-helix	trans	-56.5	-25.2	174.1	178.5	-33.8	0	0	0	110.5	K144 R145 K327 E331 I332 A333	K144-Y329 WeakPolarHBondContact O-CA 3.31Å; K144-Y329 WeakPolarHBondContact O-CB 3.41Å; K144-Y329 PolarHBondContact O-N 2.99Å; R145-Y329 VanDerWaalsContact C-CD1 3.48Å; R145-Y329 CarbonylContact O-C 3.57Å; R145-Y329 VanDerWaalsContact O-CA 3.23Å; R145-Y329 WeakPolarHBondContact O-CA 3.2Å; R145-Y329 WeakPolarHBondContact O-CB 3.25Å; R145-Y329 WeakPolarHBondContact O-CD1 3.36Å; K327-Y329 PolarHBondContact O-N 3.25Å; Y329-E331 VanDerWaalsContact C-N 3.27Å; Y329-E331 PolarHBondContact O-N 3.35Å; Y329-I332 PolarHBondContact O-N 3.47Å; Y329-A333 PolarHBondContact O-N 3Å; Y329-A333 VanDerWaalsContact O-N 3.09Å
330	K	69.5	Low	64.6	Low	89 Å²	89	99.5 Å²	99.5	39%	0.387	51%	0.507	S	S	.	.	H	α-helix	trans	-66.8	-31.5	172.1	-160.9	-160.1	173.4	-168.7	0	111.1	K144 R145 S146 K327 E328 Q334	K144-K330 PolarHBondContact O-N 2.76Å; R145-K330 HydrophobicContact CB-CB 4.26Å; R145-K330 PolarHBondContact O-N 3.49Å; S146-K330 WeakPolarHBondContact OG-CG 3.5Å; K327-K330 VanDerWaalsContact O-CA 3.27Å; K327-K330 WeakPolarHBondContact O-CA 3.45Å; K327-K330 WeakPolarHBondContact O-CB 3.47Å; K327-K330 PolarHBondContact O-N 2.76Å; E328-K330 PolarHBondContact O-N 3.25Å; E328-K330 VanDerWaalsContact O-N 3.09Å; K330-Q334 VanDerWaalsContact O-CG 3.31Å; K330-Q334 WeakPolarHBondContact O-CG 3.37Å
331	E	74.3	Confident	65.1	Low	127 Å²	127	102 Å²	102	59%	0.593	51%	0.51	S	S	*	.	H	α-helix	trans	-79.6	-41.1	179.8	-58.8	169.7	164.4	0	0	109.7	E328 Y329 Q334 A335	E328-E331 WeakPolarHBondContact O-CA 3.42Å; E328-E331 VanDerWaalsContact O-CB 3.25Å; E328-E331 WeakPolarHBondContact O-CB 3.42Å; E328-E331 PolarHBondContact O-N 3.2Å; Y329-E331 VanDerWaalsContact C-N 3.27Å; Y329-E331 PolarHBondContact O-N 3.35Å; E331-Q334 PolarHBondContact O-N 3.1Å; E331-A335 PolarHBondContact O-N 3.25Å
332	I	74.3	Confident	65.8	Low	124 Å²	124	103.6 Å²	103.6	64%	0.636	52%	0.515	S	S	*	.	H	α-helix	trans	-58.2	-51.5	175	-60.3	174.9	0	0	0	111	E328 Y329 Q334 A335	E328-I332 PolarHBondContact O-N 3.22Å; Y329-I332 PolarHBondContact O-N 3.47Å; I332-Q334 PolarHBondContact O-N 3.04Å; I332-A335 PolarHBondContact O-N 3.48Å; I332-A335 VanDerWaalsContact O-N 3.13Å
333	A	67.3	Low	66.3	Low	41 Å²	41	103.4 Å²	103.4	34%	0.339	51%	0.51	S	S	.	.	H	α-helix	trans	-60.4	-31.8	-179.3	0	0	0	0	0	113.2	Y329	Y329-A333 PolarHBondContact O-N 3Å; Y329-A333 VanDerWaalsContact O-N 3.09Å
334	Q	67.7	Low	66.2	Low	103 Å²	103	105.3 Å²	105.3	48%	0.481	52%	0.518	S	S	.	.	H	α-helix	trans	-80.8	-19.4	179.5	-71.5	-173.7	-15.3	0	0	113.9	K330 E331 I332	K330-Q334 VanDerWaalsContact O-CG 3.31Å; K330-Q334 WeakPolarHBondContact O-CG 3.37Å; E331-Q334 PolarHBondContact O-N 3.1Å; I332-Q334 PolarHBondContact O-N 3.04Å
335	A	72	Confident	65.6	Low	49 Å²	49	108.1 Å²	108.1	41%	0.405	53%	0.527	S	S	.	.	H	α-helix	trans	-76	-41	179.4	0	0	0	0	0	112.7	E331 I332 V337 R338	E331-A335 PolarHBondContact O-N 3.25Å; I332-A335 PolarHBondContact O-N 3.48Å; I332-A335 VanDerWaalsContact O-N 3.13Å; A335-V337 PolarHBondContact O-N 3.34Å; A335-R338 PolarHBondContact O-N 3.16Å
336	G	64.1	Low	66	Low	48 Å²	48	108.1 Å²	108.1	50%	0.495	53%	0.529	S	S	.	.	H	α-helix	trans	-61.7	-45	-177.7	0	0	0	0	0	113.5	R338 R339	G336-R338 PolarHBondContact O-N 3.08Å; G336-R338 VanDerWaalsContact O-N 3.15Å; G336-R339 PolarHBondContact O-N 3.23Å
337	V	66.4	Low	65.7	Low	111 Å²	111	111.2 Å²	111.2	67%	0.673	54%	0.539	S	S	*	.	H	α-helix	trans	-60.6	-26.6	-178.9	-179.2	0	0	0	0	112.9	A335	A335-V337 PolarHBondContact O-N 3.34Å
338	R	67.1	Low	64.9	Low	173 Å²	173	109.4 Å²	109.4	65%	0.653	53%	0.532	S	S	*	.	H	α-helix	trans	-76.5	-48.5	-179.7	-68.1	179.9	179.5	176.3	0.2	112.4	A335 G336 F340 K341 D342	A335-R338 PolarHBondContact O-N 3.16Å; G336-R338 PolarHBondContact O-N 3.08Å; G336-R338 VanDerWaalsContact O-N 3.15Å; R338-F340 VanDerWaalsContact C-N 3.32Å; R338-F340 PolarHBondContact O-N 3.15Å; R338-K341 WeakPolarHBondContact O-CB 3.24Å; R338-K341 PolarHBondContact O-N 3.23Å; R338-K341 VanDerWaalsContact O-N 3.07Å; R338-D342 PolarHBondContact O-N 3.26Å
339	R	69.5	Low	64	Low	186 Å²	186	109.4 Å²	109.4	70%	0.702	54%	0.54	S	S	*	.	H	α-helix	trans	-56.2	-45.7	-177.4	-69.7	-176.9	176.6	156.6	-1	112.1	G336 K341 D342 E343	G336-R339 PolarHBondContact O-N 3.23Å; R339-K341 VanDerWaalsContact C-N 3.29Å; R339-K341 PolarHBondContact O-N 3.17Å; R339-D342 PolarHBondContact O-N 3Å; R339-D342 VanDerWaalsContact O-N 3.1Å; R339-E343 PolarHBondContact O-N 3.18Å
340	F	57.8	Low	63.2	Low	117 Å²	117	111.1 Å²	111.1	51%	0.513	55%	0.553	S	S	.	*	H	α-helix	trans	-63.3	-33.5	179.9	-146.7	-89.5	0	0	0	113.1	R338 D342 L344 L373	R338-F340 VanDerWaalsContact C-N 3.32Å; R338-F340 PolarHBondContact O-N 3.15Å; F340-D342 VanDerWaalsContact C-N 3.33Å; F340-L344 HydrophobicContact CD1-CD1 3.85Å; F340-L344 HydrophobicContact CD1-CG 4.37Å; F340-L344 HydrophobicContact CE1-CD1 4.03Å; F340-L344 HydrophobicContact CE1-CG 4.45Å; F340-L344 WeakPolarHBondContact O-CB 3.42Å; F340-L344 WeakPolarHBondContact O-CG 3.35Å; F340-L344 PolarHBondContact O-N 3.28Å; F340-L344 VanDerWaalsContact O-N 3.12Å; F340-L373 HydrophobicContact CE1-CD2 4.3Å; F340-L373 HydrophobicContact CZ-CD2 4.07Å
341	K	63.9	Low	61.9	Low	143 Å²	143	111.4 Å²	111.4	62%	0.622	56%	0.558	S	S	*	*	H	α-helix	trans	-71.7	-27	176.5	-173.4	172.8	-176	174.1	0	112.7	R338 R339 K345	R338-K341 WeakPolarHBondContact O-CB 3.24Å; R338-K341 PolarHBondContact O-N 3.23Å; R338-K341 VanDerWaalsContact O-N 3.07Å; R339-K341 VanDerWaalsContact C-N 3.29Å; R339-K341 PolarHBondContact O-N 3.17Å; K341-K345 WeakPolarHBondContact O-CG 3.37Å
342	D	71.6	Confident	59.8	Low	88 Å²	88	111 Å²	111	47%	0.471	57%	0.569	S	S	.	*	H	α-helix	trans	-89.1	-33.5	179.6	-64.7	-34.2	0	0	0	111.7	R338 R339 F340 K345 S346	R338-D342 PolarHBondContact O-N 3.26Å; R339-D342 PolarHBondContact O-N 3Å; R339-D342 VanDerWaalsContact O-N 3.1Å; F340-D342 VanDerWaalsContact C-N 3.33Å; D342-K345 PolarHBondContact O-N 3.11Å; D342-K345 IonicContact OD1-NZ 3.39Å; D342-K345 PolarHBondContact OD1-NZ 3.3Å; D342-S346 PolarHBondContact O-N 3.43Å
343	E	70.6	Confident	58	Low	106 Å²	106	110.6 Å²	110.6	50%	0.495	56%	0.563	S	S	.	*	H	α-helix	trans	-64.2	-41.1	168.9	-73.5	172.6	-165.1	0	0	112.2	R339 K345 S346 F347	R339-E343 PolarHBondContact O-N 3.18Å; E343-K345 PolarHBondContact O-N 2.86Å; E343-S346 WeakPolarHBondContact CA-OG 3.2Å; E343-S346 PolarHBondContact O-N 3.41Å; E343-S346 PolarHBondContact O-OG 3.07Å; E343-F347 VanDerWaalsContact O-CD2 3.27Å; E343-F347 WeakPolarHBondContact O-CD2 3.42Å; E343-F347 PolarHBondContact O-N 3.14Å
344	L	55.8	Low	56.5	Low	101 Å²	101	117.8 Å²	117.8	53%	0.529	59%	0.59	S	S	.	*	H	α-helix	trans	-61.7	-24.1	174.1	-83.9	168.7	0	0	0	113.8	F340	F340-L344 HydrophobicContact CD1-CD1 3.85Å; F340-L344 HydrophobicContact CD1-CG 4.37Å; F340-L344 HydrophobicContact CE1-CD1 4.03Å; F340-L344 HydrophobicContact CE1-CG 4.45Å; F340-L344 WeakPolarHBondContact O-CB 3.42Å; F340-L344 WeakPolarHBondContact O-CG 3.35Å; F340-L344 PolarHBondContact O-N 3.28Å; F340-L344 VanDerWaalsContact O-N 3.12Å
345	K	57.1	Low	54.8	Low	132 Å²	132	115.6 Å²	115.6	57%	0.574	59%	0.594	S	S	*	*	H	α-helix	trans	-81.5	-28.5	173.2	-67.8	168.9	-169.5	159.3	0	112.9	K341 D342 E343	K341-K345 WeakPolarHBondContact O-CG 3.37Å; D342-K345 PolarHBondContact O-N 3.11Å; D342-K345 IonicContact OD1-NZ 3.39Å; D342-K345 PolarHBondContact OD1-NZ 3.3Å; E343-K345 PolarHBondContact O-N 2.86Å
346	S	65.3	Low	53.1	Low	72 Å²	72	118.3 Å²	118.3	50%	0.503	61%	0.611	S	S	.	*	H	α-helix	trans	-80.2	-22.4	-175.8	57.8	0	0	0	0	114	D342 E343	D342-S346 PolarHBondContact O-N 3.43Å; E343-S346 WeakPolarHBondContact CA-OG 3.2Å; E343-S346 PolarHBondContact O-N 3.41Å; E343-S346 PolarHBondContact O-OG 3.07Å
347	F	52.7	Low	52	Low	155 Å²	155	120.1 Å²	120.1	68%	0.68	61%	0.614	S	S	*	*	S	Bend	trans	-91.2	-3.3	-176.8	-73.8	-69.6	0	0	0	115.6	E343	E343-F347 VanDerWaalsContact O-CD2 3.27Å; E343-F347 WeakPolarHBondContact O-CD2 3.42Å; E343-F347 PolarHBondContact O-N 3.14Å
348	F	49.8	Very low	50.7	Low	87 Å²	87	124.2 Å²	124.2	38%	0.382	62%	0.617	S	S	.	*			trans	-126.3	69	175.6	-70.2	-79.7	0	0	0	113.3	H350 I351 L365 L369	F348-H350 PolarHBondContact O-N 2.87Å; F348-I351 HydrophobicContact CD1-CD1 4.38Å; F348-L365 HydrophobicContact CE1-CD2 4.28Å; F348-L365 HydrophobicContact CZ-CD2 4.28Å; F348-L369 HydrophobicContact CE2-CD1 4.42Å; F348-L369 HydrophobicContact CZ-CD1 3.98Å; F348-L369 HydrophobicContact CZ-CD2 4.37Å
349	P	51.1	Low	49.8	Very low	97 Å²	97	123.5 Å²	123.5	63%	0.63	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.4	-6.6	-167.8	-12.1	31	0	0	0	115.9
350	H	39	Very low	48.9	Very low	185 Å²	185	118.9 Å²	118.9	86%	0.856	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.9	36	-170.9	-73.7	-54.7	0	0	0	114.3	F348	F348-H350 PolarHBondContact O-N 2.87Å
351	I	42.9	Very low	48.3	Very low	95 Å²	95	120.3 Å²	120.3	49%	0.487	63%	0.625	S	S	.	*			trans	-124.2	87	169.5	-56.8	-178.6	0	0	0	109.3	F348 F353	F348-I351 HydrophobicContact CD1-CD1 4.38Å; I351-F353 HydrophobicContact CG2-CB 4.41Å; I351-F353 HydrophobicContact CG2-CD1 4.33Å; I351-F353 HydrophobicContact CG2-CD2 3.07Å; I351-F353 HydrophobicContact CG2-CE1 4.4Å; I351-F353 HydrophobicContact CG2-CE2 3.19Å; I351-F353 HydrophobicContact CG2-CG 3.68Å; I351-F353 HydrophobicContact CG2-CZ 3.88Å
352	S	29.4	Very low	47.7	Very low	118 Å²	118	118 Å²	118	83%	0.825	62%	0.62	S	S	*	*			trans	-85.9	98.5	157.6	-76.4	0	0	0	0	108.1	E354	S352-E354 VanDerWaalsContact C-N 3.26Å; S352-E354 PolarHBondContact O-N 3.27Å; S352-E354 VanDerWaalsContact O-N 3.14Å
353	F	36.7	Very low	47.1	Very low	116 Å²	116	119.5 Å²	119.5	51%	0.509	63%	0.626	S	S	.	*			trans	-87.6	63.7	173.7	-85.6	-45.1	0	0	0	112.8	I351 G355 L362	I351-F353 HydrophobicContact CG2-CB 4.41Å; I351-F353 HydrophobicContact CG2-CD1 4.33Å; I351-F353 HydrophobicContact CG2-CD2 3.07Å; I351-F353 HydrophobicContact CG2-CE1 4.4Å; I351-F353 HydrophobicContact CG2-CE2 3.19Å; I351-F353 HydrophobicContact CG2-CG 3.68Å; I351-F353 HydrophobicContact CG2-CZ 3.88Å; F353-G355 WeakPolarHBondContact CD1-O 3.47Å; F353-L362 HydrophobicContact CE2-CD1 3.81Å; F353-L362 HydrophobicContact CZ-CD1 4.16Å
354	E	35.3	Very low	46.6	Very low	192 Å²	192	117.6 Å²	117.6	90%	0.897	63%	0.629	S	S	*	*	S	Bend	trans	-80.6	97.5	140.4	-74.8	-175.4	136	0	0	107.5	S352	S352-E354 VanDerWaalsContact C-N 3.26Å; S352-E354 PolarHBondContact O-N 3.27Å; S352-E354 VanDerWaalsContact O-N 3.14Å
355	G	33.5	Very low	46.7	Very low	56 Å²	56	116.7 Å²	116.7	58%	0.577	62%	0.624	S	S	*	*	S	Bend	trans	93	131	172.9	0	0	0	0	0	116.3	F353	F353-G355 WeakPolarHBondContact CD1-O 3.47Å
356	S	35.3	Very low	46.9	Very low	107 Å²	107	113.4 Å²	113.4	75%	0.748	62%	0.617	S	S	*	*			trans	-49.9	140	176.2	-177.2	0	0	0	0	113.9
357	P	40.3	Very low	46.9	Very low	86 Å²	86	112.6 Å²	112.6	56%	0.558	62%	0.615	S	S	*	*				-143.4	145.5	105.1	24.8	-4.2	0	0	0	116.9
358	R	40.9	Very low	47.4	Very low	197 Å²	197	111 Å²	111	74%	0.743	61%	0.613	S	S	*	*			trans	67.8	85.9	155	-62.5	178.3	-170.4	164.7	5	118	S360	R358-S360 PolarHBondContact O-N 2.83Å; R358-S360 VanDerWaalsContact O-N 3.12Å
359	E	47.3	Very low	47.9	Very low	158 Å²	158	110.4 Å²	110.4	74%	0.738	61%	0.614	S	S	*	*	H	α-helix	trans	-56.5	-23	178.6	-61.7	162.5	148	0	0	115.6	E361 L362 I363	E359-E361 PolarHBondContact O-N 3.45Å; E359-L362 PolarHBondContact O-N 3.4Å; E359-I363 WeakPolarHBondContact O-CG1 3.41Å; E359-I363 PolarHBondContact O-N 3.32Å
360	S	50.5	Low	48.8	Very low	89 Å²	89	108.5 Å²	108.5	62%	0.622	60%	0.602	S	S	*	*	H	α-helix	trans	-69	-32.7	-172.8	50.7	0	0	0	0	114.8	R358	R358-S360 PolarHBondContact O-N 2.83Å; R358-S360 VanDerWaalsContact O-N 3.12Å
361	E	46.3	Very low	50.4	Low	147 Å²	147	102.5 Å²	102.5	69%	0.687	59%	0.585	S	S	*	*	H	α-helix	trans	-84	-29	179.4	-68.1	173.6	-163.3	0	0	111.6	E359 I363 A364 L365	E359-E361 PolarHBondContact O-N 3.45Å; E361-I363 VanDerWaalsContact C-N 3.35Å; E361-A364 PolarHBondContact O-N 2.84Å; E361-L365 PolarHBondContact O-N 3.44Å; E361-L365 VanDerWaalsContact O-N 3.08Å
362	L	49.3	Very low	51.4	Low	95 Å²	95	106.1 Å²	106.1	50%	0.497	59%	0.593	S	S	.	*	H	α-helix	trans	-69.4	-31.4	178.3	-132	156	0	0	0	112.2	F353 E359 S366	F353-L362 HydrophobicContact CE2-CD1 3.81Å; F353-L362 HydrophobicContact CZ-CD1 4.16Å; E359-L362 PolarHBondContact O-N 3.4Å; L362-S366 WeakPolarHBondContact O-CB 3.49Å; L362-S366 PolarHBondContact O-N 3.18Å; L362-S366 PolarHBondContact O-OG 2.88Å
363	I	59.7	Low	52.9	Low	118 Å²	118	104.4 Å²	104.4	61%	0.605	57%	0.574	S	S	*	*	H	α-helix	trans	-69.8	-40.7	172.4	-66.6	165.3	0	0	0	111.3	E359 E361 S366 A367	E359-I363 WeakPolarHBondContact O-CG1 3.41Å; E359-I363 PolarHBondContact O-N 3.32Å; E361-I363 VanDerWaalsContact C-N 3.35Å; I363-S366 WeakPolarHBondContact CA-OG 3.29Å; I363-S366 PolarHBondContact O-OG 2.79Å; I363-S366 VanDerWaalsContact O-OG 3.07Å; I363-A367 WeakPolarHBondContact O-CB 3.33Å; I363-A367 PolarHBondContact O-N 2.83Å; I363-A367 VanDerWaalsContact O-N 3.08Å
364	A	59.9	Low	54.6	Low	67 Å²	67	102.9 Å²	102.9	55%	0.554	57%	0.571	S	S	*	*	H	α-helix	trans	-65.9	-40.3	177	0	0	0	0	0	112.2	E361 L368	E361-A364 PolarHBondContact O-N 2.84Å; A364-L368 PolarHBondContact O-N 3.1Å; A364-L368 VanDerWaalsContact O-N 3.12Å
365	L	59	Low	56.5	Low	82 Å²	82	98 Å²	98	43%	0.429	55%	0.55	S	S	.	*	H	α-helix	trans	-71.6	-37.5	179.2	-128.8	167.6	0	0	0	112.4	F348 E361 L368 L369	F348-L365 HydrophobicContact CE1-CD2 4.28Å; F348-L365 HydrophobicContact CZ-CD2 4.28Å; E361-L365 PolarHBondContact O-N 3.44Å; E361-L365 VanDerWaalsContact O-N 3.08Å; L365-L368 PolarHBondContact O-N 3.22Å; L365-L369 HydrophobicContact CD2-CD1 4.19Å; L365-L369 HydrophobicContact CD2-CG 4.3Å; L365-L369 VanDerWaalsContact O-CG 3.32Å; L365-L369 WeakPolarHBondContact O-CG 3.38Å; L365-L369 PolarHBondContact O-N 2.88Å
366	S	60.4	Low	58	Low	62 Å²	62	99.6 Å²	99.6	43%	0.434	54%	0.542	S	S	.	.	H	α-helix	trans	-67.7	-36.7	174.4	50.3	0	0	0	0	112.9	L362 I363 L369 S370	L362-S366 WeakPolarHBondContact O-CB 3.49Å; L362-S366 PolarHBondContact O-N 3.18Å; L362-S366 PolarHBondContact O-OG 2.88Å; I363-S366 WeakPolarHBondContact CA-OG 3.29Å; I363-S366 PolarHBondContact O-OG 2.79Å; I363-S366 VanDerWaalsContact O-OG 3.07Å; S366-L369 PolarHBondContact O-N 2.96Å; S366-S370 PolarHBondContact O-N 3.02Å; S366-S370 PolarHBondContact O-OG 3.37Å
367	A	64.5	Low	59.5	Low	56 Å²	56	99.1 Å²	99.1	46%	0.463	53%	0.528	S	S	.	.	H	α-helix	trans	-65.7	-37	172.7	0	0	0	0	0	113.1	I363 S370 A371	I363-A367 WeakPolarHBondContact O-CB 3.33Å; I363-A367 PolarHBondContact O-N 2.83Å; I363-A367 VanDerWaalsContact O-N 3.08Å; A367-S370 PolarHBondContact O-OG 3.34Å; A367-S370 VanDerWaalsContact O-OG 3.12Å; A367-A371 WeakPolarHBondContact O-CB 3.42Å; A367-A371 PolarHBondContact O-N 2.91Å
368	L	63.4	Low	61.2	Low	122 Å²	122	101.3 Å²	101.3	64%	0.639	53%	0.528	S	S	*	.	H	α-helix	trans	-65.5	-42	173.1	-172.7	76.5	0	0	0	111.5	A364 L365 R372	A364-L368 PolarHBondContact O-N 3.1Å; A364-L368 VanDerWaalsContact O-N 3.12Å; L365-L368 PolarHBondContact O-N 3.22Å; L368-R372 WeakPolarHBondContact O-CB 3.44Å; L368-R372 PolarHBondContact O-N 2.93Å; L368-R372 VanDerWaalsContact O-N 3.13Å
369	L	60.7	Low	62.6	Low	74 Å²	74	96.4 Å²	96.4	39%	0.387	51%	0.514	S	S	.	.	H	α-helix	trans	-65.6	-44	178.8	-76.1	166.6	0	0	0	112.4	F348 L365 S366 R372 L373	F348-L369 HydrophobicContact CE2-CD1 4.42Å; F348-L369 HydrophobicContact CZ-CD1 3.98Å; F348-L369 HydrophobicContact CZ-CD2 4.37Å; L365-L369 HydrophobicContact CD2-CD1 4.19Å; L365-L369 HydrophobicContact CD2-CG 4.3Å; L365-L369 VanDerWaalsContact O-CG 3.32Å; L365-L369 WeakPolarHBondContact O-CG 3.38Å; L365-L369 PolarHBondContact O-N 2.88Å; S366-L369 PolarHBondContact O-N 2.96Å; L369-R372 PolarHBondContact O-N 3.48Å; L369-L373 PolarHBondContact O-N 3Å
370	S	70.9	Confident	63.2	Low	56 Å²	56	94.6 Å²	94.6	39%	0.392	51%	0.508	S	S	.	.	H	α-helix	trans	-64.4	-47.7	177.8	61.2	0	0	0	0	111.4	S366 A367 R372 L373 D374	S366-S370 PolarHBondContact O-N 3.02Å; S366-S370 PolarHBondContact O-OG 3.37Å; A367-S370 PolarHBondContact O-OG 3.34Å; A367-S370 VanDerWaalsContact O-OG 3.12Å; S370-R372 PolarHBondContact O-N 2.95Å; S370-L373 WeakPolarHBondContact O-CB 3.22Å; S370-L373 PolarHBondContact O-N 3.21Å; S370-D374 PolarHBondContact O-N 3.45Å
371	A	73.1	Confident	64	Low	60 Å²	60	96.3 Å²	96.3	50%	0.496	51%	0.507	S	S	.	.	H	α-helix	trans	-60.2	-31.9	177.6	0	0	0	0	0	113.1	A367 L375	A367-A371 WeakPolarHBondContact O-CB 3.42Å; A367-A371 PolarHBondContact O-N 2.91Å; A371-L375 PolarHBondContact O-N 2.95Å
372	R	63.3	Low	65.5	Low	171 Å²	171	95.7 Å²	95.7	65%	0.645	50%	0.504	S	S	*	.	H	α-helix	trans	-75.9	-35.6	175.5	-165.1	69.3	174.9	-170.6	0.8	112.6	L368 L369 S370 K376	L368-R372 WeakPolarHBondContact O-CB 3.44Å; L368-R372 PolarHBondContact O-N 2.93Å; L368-R372 VanDerWaalsContact O-N 3.13Å; L369-R372 PolarHBondContact O-N 3.48Å; S370-R372 PolarHBondContact O-N 2.95Å; R372-K376 PolarHBondContact O-N 3.38Å
373	L	60.9	Low	66.3	Low	81 Å²	81	96.7 Å²	96.7	42%	0.424	51%	0.507	S	S	.	.	H	α-helix	trans	-63.7	-48.7	171.7	-85.3	161.2	0	0	0	110.9	F340 L369 S370 L375 K376 Q377	F340-L373 HydrophobicContact CE1-CD2 4.3Å; F340-L373 HydrophobicContact CZ-CD2 4.07Å; L369-L373 PolarHBondContact O-N 3Å; S370-L373 WeakPolarHBondContact O-CB 3.22Å; S370-L373 PolarHBondContact O-N 3.21Å; L373-L375 VanDerWaalsContact C-N 3.32Å; L373-L375 PolarHBondContact O-N 2.92Å; L373-K376 PolarHBondContact O-N 3Å; L373-K376 VanDerWaalsContact O-N 3.11Å; L373-Q377 WeakPolarHBondContact O-CG 3.47Å; L373-Q377 PolarHBondContact O-N 2.93Å
374	D	71.8	Confident	66.8	Low	84 Å²	84	93.7 Å²	93.7	45%	0.449	50%	0.5	S	S	.	.	H	α-helix	trans	-59.1	-41.5	-178.7	-61.9	-20.7	0	0	0	112.1	S370 Q377 K378	S370-D374 PolarHBondContact O-N 3.45Å; D374-Q377 PolarHBondContact O-N 3.44Å; D374-K378 WeakPolarHBondContact O-CG 3.46Å; D374-K378 PolarHBondContact O-N 3.04Å; D374-K378 VanDerWaalsContact O-N 3.09Å
375	L	74.9	Confident	67.3	Low	89 Å²	89	93 Å²	93	47%	0.466	49%	0.491	S	S	.	.	H	α-helix	trans	-62.8	-42.5	176.9	-173.3	73	0	0	0	111.8	A371 L373 K378 E379	A371-L375 PolarHBondContact O-N 2.95Å; L373-L375 VanDerWaalsContact C-N 3.32Å; L373-L375 PolarHBondContact O-N 2.92Å; L375-K378 PolarHBondContact O-N 3.24Å; L375-E379 PolarHBondContact O-N 3.16Å
376	K	65.5	Low	68.2	Low	91 Å²	91	92.2 Å²	92.2	40%	0.396	49%	0.489	S	S	.	.	H	α-helix	trans	-79	-26.9	-179.5	-73.4	-66.3	173.8	-155.6	0	113.4	R372 L373 E379 L380	R372-K376 PolarHBondContact O-N 3.38Å; L373-K376 PolarHBondContact O-N 3Å; L373-K376 VanDerWaalsContact O-N 3.11Å; K376-E379 IonicContact NZ-OE1 3.7Å; K376-E379 PolarHBondContact NZ-OE1 3.12Å; K376-E379 IonicContact NZ-OE2 2.78Å; K376-E379 PolarHBondContact NZ-OE2 2.9Å; K376-L380 WeakPolarHBondContact O-CB 3.35Å; K376-L380 WeakPolarHBondContact O-CG 3.28Å; K376-L380 PolarHBondContact O-N 3.48Å
377	Q	67.5	Low	68.7	Low	97 Å²	97	94.9 Å²	94.9	45%	0.453	50%	0.495	S	S	.	.	H	α-helix	trans	-62.7	-44.9	167.6	-77.4	178.4	-38.7	0	0	110.8	L373 D374 L380 E381	L373-Q377 WeakPolarHBondContact O-CG 3.47Å; L373-Q377 PolarHBondContact O-N 2.93Å; D374-Q377 PolarHBondContact O-N 3.44Å; Q377-L380 PolarHBondContact O-N 3.12Å; Q377-E381 WeakPolarHBondContact O-CB 3.35Å; Q377-E381 VanDerWaalsContact O-CG 3.3Å; Q377-E381 WeakPolarHBondContact O-CG 3.42Å; Q377-E381 PolarHBondContact O-N 3.46Å
378	K	74.9	Confident	68.9	Low	132 Å²	132	98.8 Å²	98.8	57%	0.574	51%	0.505	S	S	*	.	H	α-helix	trans	-60.9	-46.6	175.9	-73	178.5	-180	179.1	0	113.6	D374 L375 L380 E381 E382	D374-K378 WeakPolarHBondContact O-CG 3.46Å; D374-K378 PolarHBondContact O-N 3.04Å; D374-K378 VanDerWaalsContact O-N 3.09Å; L375-K378 PolarHBondContact O-N 3.24Å; K378-L380 VanDerWaalsContact C-N 3.29Å; K378-L380 PolarHBondContact O-N 2.94Å; K378-E381 PolarHBondContact O-N 2.93Å; K378-E382 WeakPolarHBondContact O-CB 3.5Å; K378-E382 WeakPolarHBondContact O-CG 3.31Å; K378-E382 PolarHBondContact O-N 3.28Å
379	E	70	Confident	69.5	Low	93 Å²	93	99.1 Å²	99.1	44%	0.435	50%	0.502	S	S	.	.	H	α-helix	trans	-60.8	-37.9	175.6	-72.4	179.4	-154.8	0	0	112.5	L375 K376 M383	L375-E379 PolarHBondContact O-N 3.16Å; K376-E379 IonicContact NZ-OE1 3.7Å; K376-E379 PolarHBondContact NZ-OE1 3.12Å; K376-E379 IonicContact NZ-OE2 2.78Å; K376-E379 PolarHBondContact NZ-OE2 2.9Å; E379-M383 WeakPolarHBondContact O-CB 3.22Å; E379-M383 PolarHBondContact O-N 2.96Å; E379-M383 VanDerWaalsContact O-N 3.09Å
380	L	59.7	Low	70.1	Confident	120 Å²	120	103.5 Å²	103.5	63%	0.628	51%	0.513	S	S	*	.	H	α-helix	trans	-70.4	-39.5	175.8	-83	165.6	0	0	0	112.5	K376 Q377 K378 A384	K376-L380 WeakPolarHBondContact O-CB 3.35Å; K376-L380 WeakPolarHBondContact O-CG 3.28Å; K376-L380 PolarHBondContact O-N 3.48Å; Q377-L380 PolarHBondContact O-N 3.12Å; K378-L380 VanDerWaalsContact C-N 3.29Å; K378-L380 PolarHBondContact O-N 2.94Å; L380-A384 WeakPolarHBondContact O-CB 3.37Å; L380-A384 PolarHBondContact O-N 2.84Å
381	E	68.5	Low	70	Confident	125 Å²	125	103.3 Å²	103.3	58%	0.584	52%	0.515	S	S	*	.	H	α-helix	trans	-68	-41.5	177	-75.8	169.6	-168.5	0	0	111.6	Q377 K378 S385	Q377-E381 WeakPolarHBondContact O-CB 3.35Å; Q377-E381 VanDerWaalsContact O-CG 3.3Å; Q377-E381 WeakPolarHBondContact O-CG 3.42Å; Q377-E381 PolarHBondContact O-N 3.46Å; K378-E381 PolarHBondContact O-N 2.93Å; E381-S385 WeakPolarHBondContact O-CB 3.38Å; E381-S385 PolarHBondContact O-N 2.81Å; E381-S385 PolarHBondContact O-OG 3.47Å
382	E	78.1	Confident	70.2	Confident	134 Å²	134	105.6 Å²	105.6	63%	0.626	52%	0.516	S	S	*	.	H	α-helix	trans	-62.3	-50.8	174.1	-75.3	-179.3	-170.2	0	0	110.9	K378 S385 V386	K378-E382 WeakPolarHBondContact O-CB 3.5Å; K378-E382 WeakPolarHBondContact O-CG 3.31Å; K378-E382 PolarHBondContact O-N 3.28Å; E382-S385 PolarHBondContact O-N 2.96Å; E382-S385 PolarHBondContact O-OG 3.42Å; E382-V386 WeakPolarHBondContact O-CG2 3.47Å; E382-V386 PolarHBondContact O-N 3.33Å; E382-V386 VanDerWaalsContact O-N 3.08Å
383	M	65.2	Low	71.1	Confident	117 Å²	117	103 Å²	103	58%	0.576	51%	0.511	S	S	*	.	H	α-helix	trans	-61.4	-47.5	177.5	-171.6	178	-66.9	0	0	111.7	E379 S385 V386 E387	E379-M383 WeakPolarHBondContact O-CB 3.22Å; E379-M383 PolarHBondContact O-N 2.96Å; E379-M383 VanDerWaalsContact O-N 3.09Å; M383-S385 VanDerWaalsContact C-N 3.34Å; M383-S385 PolarHBondContact O-N 3.36Å; M383-V386 PolarHBondContact O-N 3.06Å; M383-E387 WeakPolarHBondContact O-CB 3.34Å; M383-E387 WeakPolarHBondContact O-CG 3.44Å; M383-E387 PolarHBondContact O-N 3.29Å
384	A	71	Confident	71.9	Confident	55 Å²	55	103 Å²	103	46%	0.455	51%	0.514	S	S	.	.	H	α-helix	trans	-62.5	-38.3	178	0	0	0	0	0	112.1	L380 M388	L380-A384 WeakPolarHBondContact O-CB 3.37Å; L380-A384 PolarHBondContact O-N 2.84Å; A384-M388 WeakPolarHBondContact O-CA 3.26Å; A384-M388 WeakPolarHBondContact O-CB 3.47Å; A384-M388 PolarHBondContact O-N 2.82Å
385	S	70.3	Confident	72.1	Confident	51 Å²	51	103.1 Å²	103.1	36%	0.357	52%	0.517	S	S	.	.	H	α-helix	trans	-68.6	-35	178	77.3	0	0	0	0	112.7	E381 E382 M383 K389	E381-S385 WeakPolarHBondContact O-CB 3.38Å; E381-S385 PolarHBondContact O-N 2.81Å; E381-S385 PolarHBondContact O-OG 3.47Å; E382-S385 PolarHBondContact O-N 2.96Å; E382-S385 PolarHBondContact O-OG 3.42Å; M383-S385 VanDerWaalsContact C-N 3.34Å; M383-S385 PolarHBondContact O-N 3.36Å; S385-K389 WeakPolarHBondContact O-CB 3.27Å; S385-K389 VanDerWaalsContact O-CG 3.26Å; S385-K389 WeakPolarHBondContact O-CG 3.43Å; S385-K389 PolarHBondContact O-N 3.24Å; S385-K389 VanDerWaalsContact O-N 3.08Å
386	V	78.2	Confident	72.4	Confident	66 Å²	66	102.8 Å²	102.8	40%	0.4	52%	0.516	S	S	.	.	H	α-helix	trans	-73.8	-42.7	176.3	172.5	0	0	0	0	111	E382 M383 R390	E382-V386 WeakPolarHBondContact O-CG2 3.47Å; E382-V386 PolarHBondContact O-N 3.33Å; E382-V386 VanDerWaalsContact O-N 3.08Å; M383-V386 PolarHBondContact O-N 3.06Å; V386-R390 WeakPolarHBondContact O-CG 3.24Å; V386-R390 PolarHBondContact O-N 2.97Å
387	E	70.2	Confident	73.2	Confident	119 Å²	119	104.2 Å²	104.2	56%	0.556	52%	0.522	S	S	*	.	H	α-helix	trans	-68	-39.6	175.6	-70.6	-168.3	163.7	0	0	112	M383 R390 A391	M383-E387 WeakPolarHBondContact O-CB 3.34Å; M383-E387 WeakPolarHBondContact O-CG 3.44Å; M383-E387 PolarHBondContact O-N 3.29Å; E387-R390 PolarHBondContact O-N 3.36Å; E387-A391 VanDerWaalsContact O-CB 3.29Å; E387-A391 WeakPolarHBondContact O-CB 3.44Å; E387-A391 PolarHBondContact O-N 2.67Å
388	M	69.2	Low	73.5	Confident	137 Å²	137	105 Å²	105	68%	0.675	53%	0.526	S	S	*	.	H	α-helix	trans	-63.2	-43.8	175.6	-172.8	168.4	-179.3	0	0	111.3	A384 R390 A391 E392	A384-M388 WeakPolarHBondContact O-CA 3.26Å; A384-M388 WeakPolarHBondContact O-CB 3.47Å; A384-M388 PolarHBondContact O-N 2.82Å; M388-R390 PolarHBondContact O-N 3.14Å; M388-A391 PolarHBondContact O-N 2.86Å; M388-E392 VanDerWaalsContact O-CB 3.22Å; M388-E392 WeakPolarHBondContact O-CB 3.27Å; M388-E392 PolarHBondContact O-N 3.39Å
389	K	75.7	Confident	73.7	Confident	129 Å²	129	100.7 Å²	100.7	56%	0.561	52%	0.515	S	S	*	.	H	α-helix	trans	-63.7	-36.4	173.7	-75.9	171.2	-178.5	173	0	113.2	S385 Q393	S385-K389 WeakPolarHBondContact O-CB 3.27Å; S385-K389 VanDerWaalsContact O-CG 3.26Å; S385-K389 WeakPolarHBondContact O-CG 3.43Å; S385-K389 PolarHBondContact O-N 3.24Å; S385-K389 VanDerWaalsContact O-N 3.08Å; K389-Q393 WeakPolarHBondContact O-CB 3.19Å; K389-Q393 WeakPolarHBondContact O-CG 3.24Å; K389-Q393 PolarHBondContact O-N 3.36Å
390	R	72.9	Confident	74.4	Confident	166 Å²	166	102.4 Å²	102.4	63%	0.626	52%	0.523	S	S	*	.	H	α-helix	trans	-69.9	-40.3	174.2	-74.6	176.1	-177.4	160	2.5	111.7	V386 E387 M388 V394	V386-R390 WeakPolarHBondContact O-CG 3.24Å; V386-R390 PolarHBondContact O-N 2.97Å; E387-R390 PolarHBondContact O-N 3.36Å; M388-R390 PolarHBondContact O-N 3.14Å; R390-V394 VanDerWaalsContact O-CG2 3.29Å; R390-V394 WeakPolarHBondContact O-CG2 3.24Å; R390-V394 PolarHBondContact O-N 3.04Å; R390-V394 VanDerWaalsContact O-N 3.1Å
391	A	68.7	Low	75.5	Confident	53 Å²	53	103.3 Å²	103.3	44%	0.438	52%	0.522	S	S	.	.	H	α-helix	trans	-65.3	-45.9	176.3	0	0	0	0	0	110.9	E387 M388 V394 V395	E387-A391 VanDerWaalsContact O-CB 3.29Å; E387-A391 WeakPolarHBondContact O-CB 3.44Å; E387-A391 PolarHBondContact O-N 2.67Å; M388-A391 PolarHBondContact O-N 2.86Å; A391-V394 PolarHBondContact O-N 3.36Å; A391-V395 WeakPolarHBondContact O-CB 3.36Å; A391-V395 VanDerWaalsContact O-CG2 3.26Å; A391-V395 WeakPolarHBondContact O-CG2 3.34Å; A391-V395 PolarHBondContact O-N 3.09Å
392	E	78.1	Confident	76	Confident	108 Å²	108	103 Å²	103	51%	0.505	52%	0.523	S	S	.	.	H	α-helix	trans	-55.5	-54.6	174.1	-173	171.5	-142.3	0	0	110.7	M388 V394 V395 D396	M388-E392 VanDerWaalsContact O-CB 3.22Å; M388-E392 WeakPolarHBondContact O-CB 3.27Å; M388-E392 PolarHBondContact O-N 3.39Å; E392-V394 PolarHBondContact O-N 3.36Å; E392-V394 VanDerWaalsContact O-N 3.14Å; E392-V395 CarbonylContact O-C 3.6Å; E392-V395 PolarHBondContact O-N 3.06Å; E392-D396 WeakPolarHBondContact O-CB 3.44Å; E392-D396 VanDerWaalsContact O-CG 3.25Å; E392-D396 PolarHBondContact O-N 2.95Å
393	Q	80.9	Confident	76.3	Confident	116 Å²	116	101.4 Å²	101.4	54%	0.542	52%	0.519	S	S	.	.	H	α-helix	trans	-60.8	-27.9	177.1	-73.2	-178.1	8.2	0	0	114.9	K389 K397	K389-Q393 WeakPolarHBondContact O-CB 3.19Å; K389-Q393 WeakPolarHBondContact O-CG 3.24Å; K389-Q393 PolarHBondContact O-N 3.36Å; Q393-K397 WeakPolarHBondContact O-CB 3.44Å; Q393-K397 WeakPolarHBondContact O-CD 3.42Å; Q393-K397 VanDerWaalsContact O-CG 3.26Å; Q393-K397 WeakPolarHBondContact O-CG 3.32Å; Q393-K397 PolarHBondContact O-N 3.02Å
394	V	78.1	Confident	77.4	Confident	80 Å²	80	98.7 Å²	98.7	49%	0.485	51%	0.506	S	S	.	.	H	α-helix	trans	-79.7	-39.1	174.3	170.3	0	0	0	0	110.8	R390 A391 E392 Q398	R390-V394 VanDerWaalsContact O-CG2 3.29Å; R390-V394 WeakPolarHBondContact O-CG2 3.24Å; R390-V394 PolarHBondContact O-N 3.04Å; R390-V394 VanDerWaalsContact O-N 3.1Å; A391-V394 PolarHBondContact O-N 3.36Å; E392-V394 PolarHBondContact O-N 3.36Å; E392-V394 VanDerWaalsContact O-N 3.14Å; V394-Q398 WeakPolarHBondContact O-CB 3.34Å; V394-Q398 WeakPolarHBondContact O-CG 3.5Å; V394-Q398 PolarHBondContact O-N 3.16Å
395	V	76.9	Confident	78.1	Confident	87 Å²	87	100 Å²	100	53%	0.527	51%	0.506	S	S	.	.	H	α-helix	trans	-65.3	-43.9	175.3	167.7	0	0	0	0	110.5	A391 E392 Q398 A399	A391-V395 WeakPolarHBondContact O-CB 3.36Å; A391-V395 VanDerWaalsContact O-CG2 3.26Å; A391-V395 WeakPolarHBondContact O-CG2 3.34Å; A391-V395 PolarHBondContact O-N 3.09Å; E392-V395 CarbonylContact O-C 3.6Å; E392-V395 PolarHBondContact O-N 3.06Å; V395-Q398 CarbonylContact O-C 3.57Å; V395-Q398 PolarHBondContact O-N 3.34Å; V395-Q398 VanDerWaalsContact O-N 3.16Å; V395-A399 VanDerWaalsContact O-CB 3.29Å; V395-A399 WeakPolarHBondContact O-CB 3.46Å; V395-A399 PolarHBondContact O-N 2.82Å
396	D	81.1	Confident	78.3	Confident	82 Å²	82	99.7 Å²	99.7	44%	0.439	50%	0.504	S	S	.	.	H	α-helix	trans	-62.8	-49.2	177.5	-65.6	-22.5	0	0	0	111	E392 Q398 A399 E400	E392-D396 WeakPolarHBondContact O-CB 3.44Å; E392-D396 VanDerWaalsContact O-CG 3.25Å; E392-D396 PolarHBondContact O-N 2.95Å; D396-Q398 PolarHBondContact O-N 3.44Å; D396-A399 CarbonylContact O-C 3.59Å; D396-A399 PolarHBondContact O-N 3.46Å; D396-E400 WeakPolarHBondContact O-CG 3.38Å; D396-E400 PolarHBondContact O-N 2.95Å
397	K	82.7	Confident	78.8	Confident	122 Å²	122	101.7 Å²	101.7	53%	0.53	51%	0.508	S	S	.	.	H	α-helix	trans	-64.9	-22.7	175.6	-73	174	-176.6	170	0	113.5	Q393 K401	Q393-K397 WeakPolarHBondContact O-CB 3.44Å; Q393-K397 WeakPolarHBondContact O-CD 3.42Å; Q393-K397 VanDerWaalsContact O-CG 3.26Å; Q393-K397 WeakPolarHBondContact O-CG 3.32Å; Q393-K397 PolarHBondContact O-N 3.02Å; K397-K401 VanDerWaalsContact O-CD 3.3Å; K397-K401 WeakPolarHBondContact O-CD 3.24Å; K397-K401 WeakPolarHBondContact O-CG 3.45Å
398	Q	73.1	Confident	79.7	Confident	113 Å²	113	102.3 Å²	102.3	53%	0.528	51%	0.506	S	S	.	.	H	α-helix	trans	-81.5	-38.6	169.9	-76.2	177.4	10.3	0	0	111.2	V394 V395 D396 K401 L402	V394-Q398 WeakPolarHBondContact O-CB 3.34Å; V394-Q398 WeakPolarHBondContact O-CG 3.5Å; V394-Q398 PolarHBondContact O-N 3.16Å; V395-Q398 CarbonylContact O-C 3.57Å; V395-Q398 PolarHBondContact O-N 3.34Å; V395-Q398 VanDerWaalsContact O-N 3.16Å; D396-Q398 PolarHBondContact O-N 3.44Å; Q398-K401 PolarHBondContact O-N 3.22Å; Q398-L402 VanDerWaalsContact O-CB 3.28Å; Q398-L402 WeakPolarHBondContact O-CB 3.33Å; Q398-L402 WeakPolarHBondContact O-CG 3.33Å; Q398-L402 PolarHBondContact O-N 3.44Å
399	A	78.5	Confident	80.6	Confident	41 Å²	41	104.5 Å²	104.5	34%	0.339	51%	0.506	S	S	.	.	H	α-helix	trans	-65.6	-49.2	178.1	0	0	0	0	0	111.2	V395 D396 K401 L402 L403	V395-A399 VanDerWaalsContact O-CB 3.29Å; V395-A399 WeakPolarHBondContact O-CB 3.46Å; V395-A399 PolarHBondContact O-N 2.82Å; D396-A399 CarbonylContact O-C 3.59Å; D396-A399 PolarHBondContact O-N 3.46Å; A399-K401 VanDerWaalsContact C-N 3.33Å; A399-K401 PolarHBondContact O-N 3.33Å; A399-L402 CarbonylContact O-C 3.57Å; A399-L402 PolarHBondContact O-N 3.49Å; A399-L402 VanDerWaalsContact O-N 3.11Å; A399-L403 WeakPolarHBondContact O-CB 3.45Å; A399-L403 VanDerWaalsContact O-CG 3.31Å; A399-L403 WeakPolarHBondContact O-CG 3.24Å; A399-L403 PolarHBondContact O-N 3.1Å
400	E	85.5	Confident	81	Confident	129 Å²	129	103.5 Å²	103.5	60%	0.603	51%	0.506	S	S	*	.	H	α-helix	trans	-55	-46.8	173.7	-71.7	177.2	164.1	0	0	111.6	D396 L402 L403 D404	D396-E400 WeakPolarHBondContact O-CG 3.38Å; D396-E400 PolarHBondContact O-N 2.95Å; E400-L402 PolarHBondContact O-N 3.07Å; E400-L403 PolarHBondContact O-N 3.37Å; E400-D404 WeakPolarHBondContact O-CB 3.3Å; E400-D404 PolarHBondContact O-N 2.74Å
401	K	82	Confident	81.8	Confident	140 Å²	140	100.7 Å²	100.7	61%	0.609	50%	0.5	S	S	*	.	H	α-helix	trans	-67.2	-34.9	177.1	-72.8	177.5	-174.8	-179.9	0	112.8	K397 Q398 A399 L405	K397-K401 VanDerWaalsContact O-CD 3.3Å; K397-K401 WeakPolarHBondContact O-CD 3.24Å; K397-K401 WeakPolarHBondContact O-CG 3.45Å; Q398-K401 PolarHBondContact O-N 3.22Å; A399-K401 VanDerWaalsContact C-N 3.33Å; A399-K401 PolarHBondContact O-N 3.33Å; K401-L405 WeakPolarHBondContact O-CB 3.37Å; K401-L405 WeakPolarHBondContact O-CD1 3.28Å; K401-L405 WeakPolarHBondContact O-CG 3.43Å; K401-L405 PolarHBondContact O-N 3.3Å
402	L	80.2	Confident	82.8	Confident	117 Å²	117	102.2 Å²	102.2	61%	0.613	50%	0.501	S	S	*	.	H	α-helix	trans	-73.1	-34.7	176	-75.1	169.9	0	0	0	111.6	Q398 A399 E400 S406	Q398-L402 VanDerWaalsContact O-CB 3.28Å; Q398-L402 WeakPolarHBondContact O-CB 3.33Å; Q398-L402 WeakPolarHBondContact O-CG 3.33Å; Q398-L402 PolarHBondContact O-N 3.44Å; A399-L402 CarbonylContact O-C 3.57Å; A399-L402 PolarHBondContact O-N 3.49Å; A399-L402 VanDerWaalsContact O-N 3.11Å; E400-L402 PolarHBondContact O-N 3.07Å; L402-S406 WeakPolarHBondContact O-CB 3.39Å; L402-S406 PolarHBondContact O-N 3.37Å; L402-S406 PolarHBondContact O-OG 2.96Å
403	L	84.2	Confident	83.1	Confident	101 Å²	101	99.2 Å²	99.2	53%	0.529	49%	0.494	S	S	.	.	H	α-helix	trans	-64.7	-55.7	172.5	-73.9	171.6	0	0	0	110.2	A399 E400 L405 S406 E407	A399-L403 WeakPolarHBondContact O-CB 3.45Å; A399-L403 VanDerWaalsContact O-CG 3.31Å; A399-L403 WeakPolarHBondContact O-CG 3.24Å; A399-L403 PolarHBondContact O-N 3.1Å; E400-L403 PolarHBondContact O-N 3.37Å; L403-L405 VanDerWaalsContact C-N 3.33Å; L403-L405 PolarHBondContact O-N 2.89Å; L403-S406 WeakPolarHBondContact CA-OG 3.42Å; L403-S406 CarbonylContact O-C 2.84Å; L403-S406 WeakPolarHBondContact O-CA 3.38Å; L403-S406 WeakPolarHBondContact O-CB 3.31Å; L403-S406 PolarHBondContact O-N 3.46Å; L403-S406 PolarHBondContact O-OG 2.94Å; L403-E407 WeakPolarHBondContact O-CG 3.22Å; L403-E407 PolarHBondContact O-N 3.13Å
404	D	87	Confident	83.5	Confident	60 Å²	60	99.1 Å²	99.1	32%	0.321	49%	0.494	S	S	.	.	H	α-helix	trans	-55.9	-42.7	175.8	175.8	45.7	0	0	0	112.3	E400 S406 R408	E400-D404 WeakPolarHBondContact O-CB 3.3Å; E400-D404 PolarHBondContact O-N 2.74Å; D404-S406 VanDerWaalsContact C-N 3.31Å; D404-S406 PolarHBondContact O-N 3.14Å; D404-R408 VanDerWaalsContact CG-CZ 3.5Å; D404-R408 WeakPolarHBondContact O-CB 3.45Å; D404-R408 VanDerWaalsContact O-CG 3.24Å; D404-R408 WeakPolarHBondContact O-CG 3.39Å; D404-R408 PolarHBondContact O-N 3.07Å; D404-R408 IonicContact OD1-CZ 2.82Å; D404-R408 IonicContact OD1-NE 2.67Å; D404-R408 PolarHBondContact OD1-NE 3.05Å; D404-R408 IonicContact OD1-NH2 3.14Å; D404-R408 PolarHBondContact OD1-NH2 3.13Å; D404-R408 IonicContact OD2-CZ 2.57Å; D404-R408 IonicContact OD2-NE 3.09Å; D404-R408 PolarHBondContact OD2-NE 2.9Å; D404-R408 IonicContact OD2-NH1 2.86Å; D404-R408 IonicContact OD2-NH2 3.87Å; D404-R408 PolarHBondContact OD2-NH2 3.05Å
405	L	87.4	Confident	84.1	Confident	83 Å²	83	99.1 Å²	99.1	44%	0.435	49%	0.489	S	S	.	.	H	α-helix	trans	-70.2	-22.7	173.3	-72.5	173.4	0	0	0	113.9	K401 L403 R409	K401-L405 WeakPolarHBondContact O-CB 3.37Å; K401-L405 WeakPolarHBondContact O-CD1 3.28Å; K401-L405 WeakPolarHBondContact O-CG 3.43Å; K401-L405 PolarHBondContact O-N 3.3Å; L403-L405 VanDerWaalsContact C-N 3.33Å; L403-L405 PolarHBondContact O-N 2.89Å; L405-R409 WeakPolarHBondContact O-CB 3.41Å; L405-R409 WeakPolarHBondContact O-CD 3.35Å; L405-R409 WeakPolarHBondContact O-CG 3.36Å; L405-R409 PolarHBondContact O-N 3.43Å
406	S	74.7	Confident	84.8	Confident	45 Å²	45	101.2 Å²	101.2	32%	0.315	49%	0.492	S	S	.	.	H	α-helix	trans	-82.9	-42.2	174.8	74.5	0	0	0	0	111.6	L402 L403 D404 R409 I410	L402-S406 WeakPolarHBondContact O-CB 3.39Å; L402-S406 PolarHBondContact O-N 3.37Å; L402-S406 PolarHBondContact O-OG 2.96Å; L403-S406 WeakPolarHBondContact CA-OG 3.42Å; L403-S406 CarbonylContact O-C 2.84Å; L403-S406 WeakPolarHBondContact O-CA 3.38Å; L403-S406 WeakPolarHBondContact O-CB 3.31Å; L403-S406 PolarHBondContact O-N 3.46Å; L403-S406 PolarHBondContact O-OG 2.94Å; D404-S406 VanDerWaalsContact C-N 3.31Å; D404-S406 PolarHBondContact O-N 3.14Å; S406-R409 CarbonylContact O-C 3.57Å; S406-R409 WeakPolarHBondContact O-CB 3.5Å; S406-R409 PolarHBondContact O-N 3.24Å; S406-R409 VanDerWaalsContact O-N 3.1Å; S406-I410 VanDerWaalsContact O-CG1 3.31Å; S406-I410 WeakPolarHBondContact O-CG1 3.46Å; S406-I410 PolarHBondContact O-N 3.12Å
407	E	88.7	Confident	85.1	Confident	107 Å²	107	101.9 Å²	101.9	50%	0.5	50%	0.495	S	S	.	.	H	α-helix	trans	-61.4	-48	175.3	-72	177	-175.6	0	0	110.5	L403 R409 I410 Q411	L403-E407 WeakPolarHBondContact O-CG 3.22Å; L403-E407 PolarHBondContact O-N 3.13Å; E407-R409 PolarHBondContact O-N 2.78Å; E407-I410 PolarHBondContact O-N 2.98Å; E407-I410 VanDerWaalsContact O-N 3.12Å; E407-Q411 WeakPolarHBondContact O-CB 3.49Å; E407-Q411 WeakPolarHBondContact O-CG 3.27Å; E407-Q411 PolarHBondContact O-N 2.85Å
408	R	87.4	Confident	85.6	Confident	133 Å²	133	102 Å²	102	50%	0.502	50%	0.498	S	S	.	.	H	α-helix	trans	-61	-30.9	173.5	-68.8	176.6	-160.2	-172.9	6.8	113.3	D404 N412	D404-R408 VanDerWaalsContact CG-CZ 3.5Å; D404-R408 WeakPolarHBondContact O-CB 3.45Å; D404-R408 VanDerWaalsContact O-CG 3.24Å; D404-R408 WeakPolarHBondContact O-CG 3.39Å; D404-R408 PolarHBondContact O-N 3.07Å; D404-R408 IonicContact OD1-CZ 2.82Å; D404-R408 IonicContact OD1-NE 2.67Å; D404-R408 PolarHBondContact OD1-NE 3.05Å; D404-R408 IonicContact OD1-NH2 3.14Å; D404-R408 PolarHBondContact OD1-NH2 3.13Å; D404-R408 IonicContact OD2-CZ 2.57Å; D404-R408 IonicContact OD2-NE 3.09Å; D404-R408 PolarHBondContact OD2-NE 2.9Å; D404-R408 IonicContact OD2-NH1 2.86Å; D404-R408 IonicContact OD2-NH2 3.87Å; D404-R408 PolarHBondContact OD2-NH2 3.05Å; R408-N412 VanDerWaalsContact O-CB 3.28Å; R408-N412 WeakPolarHBondContact O-CB 3.38Å; R408-N412 PolarHBondContact O-N 3.03Å; R408-N412 PolarHBondContact O-ND2 3.28Å; R408-N412 PolarHBondContact O-OD1 3.07Å
409	R	88.3	Confident	86.4	Confident	183 Å²	183	103.1 Å²	103.1	69%	0.691	50%	0.497	S	S	*	.	H	α-helix	trans	-75.5	-36.1	175	-80.9	174.3	-178.7	167.9	5.6	112.3	L405 S406 E407 A413	L405-R409 WeakPolarHBondContact O-CB 3.41Å; L405-R409 WeakPolarHBondContact O-CD 3.35Å; L405-R409 WeakPolarHBondContact O-CG 3.36Å; L405-R409 PolarHBondContact O-N 3.43Å; S406-R409 CarbonylContact O-C 3.57Å; S406-R409 WeakPolarHBondContact O-CB 3.5Å; S406-R409 PolarHBondContact O-N 3.24Å; S406-R409 VanDerWaalsContact O-N 3.1Å; E407-R409 PolarHBondContact O-N 2.78Å; R409-A413 WeakPolarHBondContact O-CB 3.44Å; R409-A413 PolarHBondContact O-N 2.94Å
410	I	84.9	Confident	86.8	Confident	108 Å²	108	103.1 Å²	103.1	55%	0.554	50%	0.495	S	S	*	.	H	α-helix	trans	-66.3	-48.7	174.1	-68.5	163.2	0	0	0	109	S406 E407 A413 E414	S406-I410 VanDerWaalsContact O-CG1 3.31Å; S406-I410 WeakPolarHBondContact O-CG1 3.46Å; S406-I410 PolarHBondContact O-N 3.12Å; E407-I410 PolarHBondContact O-N 2.98Å; E407-I410 VanDerWaalsContact O-N 3.12Å; I410-A413 PolarHBondContact O-N 2.98Å; I410-E414 WeakPolarHBondContact O-CB 3.48Å; I410-E414 PolarHBondContact O-N 3.39Å
411	Q	89.5	Confident	87	Confident	107 Å²	107	104.4 Å²	104.4	50%	0.5	50%	0.495	S	S	.	.	H	α-helix	trans	-57.6	-50.6	175.2	-72.5	171.4	-7.6	0	0	111.9	E407 A413 E414 E415	E407-Q411 WeakPolarHBondContact O-CB 3.49Å; E407-Q411 WeakPolarHBondContact O-CG 3.27Å; E407-Q411 PolarHBondContact O-N 2.85Å; Q411-A413 VanDerWaalsContact C-N 3.3Å; Q411-A413 PolarHBondContact O-N 3.4Å; Q411-E414 PolarHBondContact O-N 3.17Å; Q411-E415 WeakPolarHBondContact O-CG 3.38Å; Q411-E415 PolarHBondContact O-N 2.99Å
412	N	89.2	Confident	87.3	Confident	85 Å²	85	100.4 Å²	100.4	46%	0.455	49%	0.485	S	S	.	.	H	α-helix	trans	-60.5	-39.3	177.1	-71.4	-1.9	0	0	0	112.2	R408 E416	R408-N412 VanDerWaalsContact O-CB 3.28Å; R408-N412 WeakPolarHBondContact O-CB 3.38Å; R408-N412 PolarHBondContact O-N 3.03Å; R408-N412 PolarHBondContact O-ND2 3.28Å; R408-N412 PolarHBondContact O-OD1 3.07Å; N412-E416 VanDerWaalsContact O-CB 3.32Å; N412-E416 WeakPolarHBondContact O-CB 3.34Å; N412-E416 VanDerWaalsContact O-CG 3.26Å; N412-E416 WeakPolarHBondContact O-CG 3.37Å; N412-E416 PolarHBondContact O-N 3.33Å
413	A	85.8	Confident	87.9	Confident	44 Å²	44	98.3 Å²	98.3	36%	0.364	48%	0.477	S	S	.	.	H	α-helix	trans	-70	-37.7	177.6	0	0	0	0	0	112.4	R409 I410 Q411 E416 I417	R409-A413 WeakPolarHBondContact O-CB 3.44Å; R409-A413 PolarHBondContact O-N 2.94Å; I410-A413 PolarHBondContact O-N 2.98Å; Q411-A413 VanDerWaalsContact C-N 3.3Å; Q411-A413 PolarHBondContact O-N 3.4Å; A413-E416 PolarHBondContact O-N 3.46Å; A413-I417 VanDerWaalsContact O-CB 3.32Å; A413-I417 WeakPolarHBondContact O-CB 3.1Å; A413-I417 WeakPolarHBondContact O-CD1 3.3Å; A413-I417 WeakPolarHBondContact O-CG1 3.31Å; A413-I417 PolarHBondContact O-N 3.29Å
414	E	88.4	Confident	88.3	Confident	114 Å²	114	97.8 Å²	97.8	53%	0.533	47%	0.47	S	S	.	.	H	α-helix	trans	-63.5	-49.9	174	-174.6	167.2	-152.7	0	0	110.3	I410 Q411 E416 I417 E418	I410-E414 WeakPolarHBondContact O-CB 3.48Å; I410-E414 PolarHBondContact O-N 3.39Å; Q411-E414 PolarHBondContact O-N 3.17Å; E414-E416 VanDerWaalsContact C-N 3.35Å; E414-E416 PolarHBondContact O-N 3.38Å; E414-I417 PolarHBondContact O-N 2.92Å; E414-E418 WeakPolarHBondContact O-CG 3.47Å; E414-E418 PolarHBondContact O-N 3.46Å
415	E	91.1	Very high	88.4	Confident	81 Å²	81	101.4 Å²	101.4	38%	0.379	48%	0.484	S	S	.	.	H	α-helix	trans	-60.6	-39.7	174.1	-67.6	-175.3	169.5	0	0	112.7	Q411 R419	Q411-E415 WeakPolarHBondContact O-CG 3.38Å; Q411-E415 PolarHBondContact O-N 2.99Å; E415-R419 VanDerWaalsContact CB-NH1 3.31Å; E415-R419 VanDerWaalsContact O-CB 3.22Å; E415-R419 WeakPolarHBondContact O-CB 3.27Å; E415-R419 WeakPolarHBondContact O-CD 3.42Å; E415-R419 WeakPolarHBondContact O-CG 3.27Å; E415-R419 PolarHBondContact O-N 3.26Å; E415-R419 IonicContact OE1-NH2 3.1Å; E415-R419 IonicContact OE2-CZ 2.76Å; E415-R419 IonicContact OE2-NH1 2.74Å; E415-R419 PolarHBondContact OE2-NH1 3.48Å; E415-R419 IonicContact OE2-NH2 3.49Å; E415-R419 PolarHBondContact OE2-NH2 2.82Å
416	E	92	Very high	88.7	Confident	130 Å²	130	103.1 Å²	103.1	61%	0.607	49%	0.489	S	S	*	.	H	α-helix	trans	-65.2	-40.4	175.1	-80.7	176.5	-161.7	0	0	111.7	N412 A413 E414 S420	N412-E416 VanDerWaalsContact O-CB 3.32Å; N412-E416 WeakPolarHBondContact O-CB 3.34Å; N412-E416 VanDerWaalsContact O-CG 3.26Å; N412-E416 WeakPolarHBondContact O-CG 3.37Å; N412-E416 PolarHBondContact O-N 3.33Å; A413-E416 PolarHBondContact O-N 3.46Å; E414-E416 VanDerWaalsContact C-N 3.35Å; E414-E416 PolarHBondContact O-N 3.38Å; E416-S420 VanDerWaalsContact O-CB 3.29Å; E416-S420 WeakPolarHBondContact O-CB 3.45Å; E416-S420 PolarHBondContact O-N 3.44Å
417	I	87.5	Confident	89.6	Confident	96 Å²	96	105.3 Å²	105.3	49%	0.492	50%	0.498	S	S	.	.	H	α-helix	trans	-63.5	-52.1	175	-74.2	165.6	0	0	0	109.8	A413 E414 S420 Y421	A413-I417 VanDerWaalsContact O-CB 3.32Å; A413-I417 WeakPolarHBondContact O-CB 3.1Å; A413-I417 WeakPolarHBondContact O-CD1 3.3Å; A413-I417 WeakPolarHBondContact O-CG1 3.31Å; A413-I417 PolarHBondContact O-N 3.29Å; E414-I417 PolarHBondContact O-N 2.92Å; I417-S420 CarbonylContact O-C 3.59Å; I417-S420 PolarHBondContact O-N 2.81Å; I417-S420 VanDerWaalsContact O-N 3.1Å; I417-S420 PolarHBondContact O-OG 3.18Å; I417-Y421 HydrophobicContact CG2-CD2 3.62Å; I417-Y421 HydrophobicContact CG2-CE2 3.73Å; I417-Y421 WeakPolarHBondContact O-CD2 3.32Å; I417-Y421 PolarHBondContact O-N 2.84Å
418	E	92.2	Very high	89.8	Confident	125 Å²	125	106.8 Å²	106.8	58%	0.584	50%	0.504	S	S	*	.	H	α-helix	trans	-57.8	-48.8	177.7	-73.9	-166.1	150.4	0	0	112	E414 S420 Y421 S422	E414-E418 WeakPolarHBondContact O-CG 3.47Å; E414-E418 PolarHBondContact O-N 3.46Å; E418-S420 VanDerWaalsContact C-N 3.28Å; E418-S420 PolarHBondContact O-N 3.19Å; E418-Y421 PolarHBondContact O-N 2.97Å; E418-Y421 VanDerWaalsContact O-N 3.17Å; E418-S422 PolarHBondContact O-N 2.8Å; E418-S422 PolarHBondContact O-OG 3.44Å; E418-S422 VanDerWaalsContact O-OG 3.06Å
419	R	89.3	Confident	90	Very high	137 Å²	137	104.1 Å²	104.1	52%	0.517	50%	0.5	S	S	.	.	H	α-helix	trans	-58	-40.4	173.9	-73.3	166.9	-173.9	132.9	7.9	111.7	E415 S422 T423	E415-R419 VanDerWaalsContact CB-NH1 3.31Å; E415-R419 VanDerWaalsContact O-CB 3.22Å; E415-R419 WeakPolarHBondContact O-CB 3.27Å; E415-R419 WeakPolarHBondContact O-CD 3.42Å; E415-R419 WeakPolarHBondContact O-CG 3.27Å; E415-R419 PolarHBondContact O-N 3.26Å; E415-R419 IonicContact OE1-NH2 3.1Å; E415-R419 IonicContact OE2-CZ 2.76Å; E415-R419 IonicContact OE2-NH1 2.74Å; E415-R419 PolarHBondContact OE2-NH1 3.48Å; E415-R419 IonicContact OE2-NH2 3.49Å; E415-R419 PolarHBondContact OE2-NH2 2.82Å; R419-S422 WeakPolarHBondContact CA-OG 3.16Å; R419-S422 PolarHBondContact O-OG 3.32Å; R419-S422 VanDerWaalsContact O-OG 3.11Å; R419-T423 WeakPolarHBondContact O-CB 3.41Å; R419-T423 PolarHBondContact O-N 3.37Å; R419-T423 PolarHBondContact O-OG1 3.19Å
420	S	87.9	Confident	90.3	Very high	41 Å²	41	99.2 Å²	99.2	29%	0.287	49%	0.487	S	S	.	.	H	α-helix	trans	-69.6	-35.8	178.1	89.8	0	0	0	0	112.3	E416 I417 E418 K424	E416-S420 VanDerWaalsContact O-CB 3.29Å; E416-S420 WeakPolarHBondContact O-CB 3.45Å; E416-S420 PolarHBondContact O-N 3.44Å; I417-S420 CarbonylContact O-C 3.59Å; I417-S420 PolarHBondContact O-N 2.81Å; I417-S420 VanDerWaalsContact O-N 3.1Å; I417-S420 PolarHBondContact O-OG 3.18Å; E418-S420 VanDerWaalsContact C-N 3.28Å; E418-S420 PolarHBondContact O-N 3.19Å; S420-K424 WeakPolarHBondContact O-CB 3.43Å; S420-K424 VanDerWaalsContact O-CD 3.27Å; S420-K424 WeakPolarHBondContact O-CD 3.39Å; S420-K424 WeakPolarHBondContact O-CG 3.49Å; S420-K424 PolarHBondContact O-N 2.87Å; S420-K424 PolarHBondContact OG-NZ 3.5Å
421	Y	89.6	Confident	90.8	Very high	155 Å²	155	96.6 Å²	96.6	61%	0.608	48%	0.476	S	S	*	.	H	α-helix	trans	-73.8	-45.2	178	-90.6	-73.4	0	0	0	111.9	I417 E418 K424 F425	I417-Y421 HydrophobicContact CG2-CD2 3.62Å; I417-Y421 HydrophobicContact CG2-CE2 3.73Å; I417-Y421 WeakPolarHBondContact O-CD2 3.32Å; I417-Y421 PolarHBondContact O-N 2.84Å; E418-Y421 PolarHBondContact O-N 2.97Å; E418-Y421 VanDerWaalsContact O-N 3.17Å; Y421-K424 PolarHBondContact O-N 3.41Å; Y421-F425 VanDerWaalsContact O-CB 3.3Å; Y421-F425 WeakPolarHBondContact O-CB 3.19Å; Y421-F425 PolarHBondContact O-N 2.93Å
422	S	89	Confident	90.8	Very high	57 Å²	57	93.1 Å²	93.1	40%	0.399	47%	0.466	S	S	.	.	H	α-helix	trans	-60.8	-46.6	174.6	58.7	0	0	0	0	111	E418 R419 K424 F425 E426	E418-S422 PolarHBondContact O-N 2.8Å; E418-S422 PolarHBondContact O-OG 3.44Å; E418-S422 VanDerWaalsContact O-OG 3.06Å; R419-S422 WeakPolarHBondContact CA-OG 3.16Å; R419-S422 PolarHBondContact O-OG 3.32Å; R419-S422 VanDerWaalsContact O-OG 3.11Å; S422-K424 PolarHBondContact O-N 3.07Å; S422-F425 PolarHBondContact O-N 3.32Å; S422-E426 WeakPolarHBondContact O-CB 3.3Å; S422-E426 WeakPolarHBondContact O-CG 3.34Å; S422-E426 PolarHBondContact O-N 3.42Å
423	T	91.3	Very high	91	Very high	73 Å²	73	92.4 Å²	92.4	45%	0.448	46%	0.462	S	S	.	.	H	α-helix	trans	-61.4	-39.9	175.8	-55.4	0	0	0	0	112.2	R419 N427	R419-T423 WeakPolarHBondContact O-CB 3.41Å; R419-T423 PolarHBondContact O-N 3.37Å; R419-T423 PolarHBondContact O-OG1 3.19Å; T423-N427 VanDerWaalsContact O-CB 3.31Å; T423-N427 WeakPolarHBondContact O-CB 3.45Å; T423-N427 VanDerWaalsContact O-CG 3.27Å; T423-N427 PolarHBondContact O-N 3.43Å; T423-N427 PolarHBondContact O-ND2 3.14Å
424	K	92.8	Very high	91.3	Very high	90 Å²	90	95.6 Å²	95.6	39%	0.391	47%	0.469	S	S	.	.	H	α-helix	trans	-65.7	-45.2	174.7	-76.4	163	-168.7	157.8	0	111.5	S420 Y421 S422 N427 E428	S420-K424 WeakPolarHBondContact O-CB 3.43Å; S420-K424 VanDerWaalsContact O-CD 3.27Å; S420-K424 WeakPolarHBondContact O-CD 3.39Å; S420-K424 WeakPolarHBondContact O-CG 3.49Å; S420-K424 PolarHBondContact O-N 2.87Å; S420-K424 PolarHBondContact OG-NZ 3.5Å; Y421-K424 PolarHBondContact O-N 3.41Å; S422-K424 PolarHBondContact O-N 3.07Å; K424-N427 PolarHBondContact O-N 3.02Å; K424-E428 WeakPolarHBondContact O-CG 3.18Å; K424-E428 PolarHBondContact O-N 3.22Å
425	F	90.3	Very high	91.6	Very high	136 Å²	136	96.8 Å²	96.8	60%	0.596	47%	0.469	S	S	*	.	H	α-helix	trans	-64	-45.3	179.9	-173.3	-99.3	0	0	0	111.7	Y421 S422 N427 E428 L429	Y421-F425 VanDerWaalsContact O-CB 3.3Å; Y421-F425 WeakPolarHBondContact O-CB 3.19Å; Y421-F425 PolarHBondContact O-N 2.93Å; S422-F425 PolarHBondContact O-N 3.32Å; F425-N427 VanDerWaalsContact C-N 3.34Å; F425-N427 PolarHBondContact O-N 3.47Å; F425-E428 PolarHBondContact O-N 2.85Å; F425-L429 HydrophobicContact CD1-CD1 4.48Å; F425-L429 HydrophobicContact CE1-CD1 3.9Å; F425-L429 HydrophobicContact CZ-CD1 4.48Å; F425-L429 VanDerWaalsContact O-CB 3.24Å; F425-L429 WeakPolarHBondContact O-CB 3.26Å; F425-L429 PolarHBondContact O-N 3.03Å
426	E	93	Very high	91.5	Very high	118 Å²	118	99.2 Å²	99.2	55%	0.551	48%	0.479	S	S	*	.	H	α-helix	trans	-59.6	-42.5	172.4	-74.7	-179.3	-176.6	0	0	111.8	S422 L429 N430	S422-E426 WeakPolarHBondContact O-CB 3.3Å; S422-E426 WeakPolarHBondContact O-CG 3.34Å; S422-E426 PolarHBondContact O-N 3.42Å; E426-L429 PolarHBondContact O-N 3.02Å; E426-N430 WeakPolarHBondContact O-CB 3.15Å; E426-N430 PolarHBondContact O-N 2.96Å; E426-N430 PolarHBondContact O-ND2 3.31Å; E426-N430 VanDerWaalsContact O-ND2 3.09Å
427	N	93.9	Very high	91.6	Very high	92 Å²	92	97.6 Å²	97.6	49%	0.492	47%	0.471	S	S	.	.	H	α-helix	trans	-65.9	-39.5	175.9	-80	-51.4	0	0	0	112.8	T423 K424 F425 V431	T423-N427 VanDerWaalsContact O-CB 3.31Å; T423-N427 WeakPolarHBondContact O-CB 3.45Å; T423-N427 VanDerWaalsContact O-CG 3.27Å; T423-N427 PolarHBondContact O-N 3.43Å; T423-N427 PolarHBondContact O-ND2 3.14Å; K424-N427 PolarHBondContact O-N 3.02Å; F425-N427 VanDerWaalsContact C-N 3.34Å; F425-N427 PolarHBondContact O-N 3.47Å; N427-V431 WeakPolarHBondContact O-CB 3.33Å; N427-V431 VanDerWaalsContact O-CG2 3.24Å; N427-V431 WeakPolarHBondContact O-CG2 3.26Å; N427-V431 PolarHBondContact O-N 2.86Å
428	E	92.3	Very high	92	Very high	137 Å²	137	98.1 Å²	98.1	64%	0.64	48%	0.475	S	S	*	.	H	α-helix	trans	-67.7	-41.2	175.6	-75.4	178.1	-173.2	0	0	111.7	K424 F425 V431 A432	K424-E428 WeakPolarHBondContact O-CG 3.18Å; K424-E428 PolarHBondContact O-N 3.22Å; F425-E428 PolarHBondContact O-N 2.85Å; E428-V431 PolarHBondContact O-N 3.41Å; E428-A432 VanDerWaalsContact O-CB 3.27Å; E428-A432 WeakPolarHBondContact O-CB 3.44Å; E428-A432 PolarHBondContact O-N 3.34Å
429	L	92.1	Very high	92.1	Very high	77 Å²	77	96.2 Å²	96.2	40%	0.403	47%	0.468	S	S	.	.	H	α-helix	trans	-65.3	-43	175.2	-156.4	169.5	0	0	0	110.6	F425 E426 A432 N433	F425-L429 HydrophobicContact CD1-CD1 4.48Å; F425-L429 HydrophobicContact CE1-CD1 3.9Å; F425-L429 HydrophobicContact CZ-CD1 4.48Å; F425-L429 VanDerWaalsContact O-CB 3.24Å; F425-L429 WeakPolarHBondContact O-CB 3.26Å; F425-L429 PolarHBondContact O-N 3.03Å; E426-L429 PolarHBondContact O-N 3.02Å; L429-A432 PolarHBondContact O-N 2.8Å; L429-N433 WeakPolarHBondContact CD2-ND2 3.5Å; L429-N433 WeakPolarHBondContact O-CB 3.28Å; L429-N433 VanDerWaalsContact O-CG 3.29Å; L429-N433 PolarHBondContact O-N 2.78Å
430	N	93.1	Very high	92.2	Very high	80 Å²	80	94.7 Å²	94.7	43%	0.428	47%	0.47	S	S	.	.	H	α-helix	trans	-64.4	-42.7	174.3	-74.9	-30.4	0	0	0	112.3	E426 A432 N433 Q434	E426-N430 WeakPolarHBondContact O-CB 3.15Å; E426-N430 PolarHBondContact O-N 2.96Å; E426-N430 PolarHBondContact O-ND2 3.31Å; E426-N430 VanDerWaalsContact O-ND2 3.09Å; N430-A432 VanDerWaalsContact C-N 3.34Å; N430-N433 PolarHBondContact O-N 2.78Å; N430-Q434 WeakPolarHBondContact O-CB 3.32Å; N430-Q434 VanDerWaalsContact O-CG 3.24Å; N430-Q434 WeakPolarHBondContact O-CG 3.13Å; N430-Q434 PolarHBondContact O-N 3.31Å
431	V	95.6	Very high	92.5	Very high	53 Å²	53	96.7 Å²	96.7	32%	0.321	48%	0.477	S	S	.	.	H	α-helix	trans	-67.7	-34.6	175.6	168	0	0	0	0	111.6	N427 E428 R435	N427-V431 WeakPolarHBondContact O-CB 3.33Å; N427-V431 VanDerWaalsContact O-CG2 3.24Å; N427-V431 WeakPolarHBondContact O-CG2 3.26Å; N427-V431 PolarHBondContact O-N 2.86Å; E428-V431 PolarHBondContact O-N 3.41Å; V431-R435 VanDerWaalsContact O-CG 3.27Å; V431-R435 WeakPolarHBondContact O-CG 3.29Å; V431-R435 PolarHBondContact O-N 2.94Å; V431-R435 VanDerWaalsContact O-N 3.13Å
432	A	91.3	Very high	92.7	Very high	35 Å²	35	97 Å²	97	29%	0.289	48%	0.477	S	S	.	.	H	α-helix	trans	-67.6	-48.7	173	0	0	0	0	0	111.2	E428 L429 N430 Q434 R435 F436	E428-A432 VanDerWaalsContact O-CB 3.27Å; E428-A432 WeakPolarHBondContact O-CB 3.44Å; E428-A432 PolarHBondContact O-N 3.34Å; L429-A432 PolarHBondContact O-N 2.8Å; N430-A432 VanDerWaalsContact C-N 3.34Å; A432-Q434 PolarHBondContact O-N 2.91Å; A432-R435 WeakPolarHBondContact O-CB 3.28Å; A432-R435 PolarHBondContact O-N 3.24Å; A432-R435 VanDerWaalsContact O-N 3.12Å; A432-F436 HydrophobicContact CB-CD2 4.49Å; A432-F436 HydrophobicContact CB-CE2 4.29Å; A432-F436 WeakPolarHBondContact O-CD2 3.29Å; A432-F436 PolarHBondContact O-N 2.92Å
433	N	91.6	Very high	92.9	Very high	70 Å²	70	99.7 Å²	99.7	37%	0.374	48%	0.484	S	S	.	.	H	α-helix	trans	-56.9	-48.6	175.1	-77.3	-9.9	0	0	0	111.3	L429 N430 R435 F436 E437	L429-N433 WeakPolarHBondContact CD2-ND2 3.5Å; L429-N433 WeakPolarHBondContact O-CB 3.28Å; L429-N433 VanDerWaalsContact O-CG 3.29Å; L429-N433 PolarHBondContact O-N 2.78Å; N430-N433 PolarHBondContact O-N 2.78Å; N433-R435 VanDerWaalsContact C-N 3.28Å; N433-R435 PolarHBondContact O-N 2.89Å; N433-F436 CarbonylContact O-C 3.46Å; N433-F436 PolarHBondContact O-N 2.74Å; N433-F436 VanDerWaalsContact O-N 3.14Å; N433-E437 WeakPolarHBondContact O-CB 3.22Å; N433-E437 WeakPolarHBondContact O-CG 3.33Å; N433-E437 PolarHBondContact O-N 2.83Å
434	Q	93.7	Very high	93	Very high	110 Å²	110	101 Å²	101	51%	0.514	49%	0.488	S	S	.	.	H	α-helix	trans	-59.8	-36	176.5	-75.1	173.1	7.5	0	0	112.5	N430 A432 N438	N430-Q434 WeakPolarHBondContact O-CB 3.32Å; N430-Q434 VanDerWaalsContact O-CG 3.24Å; N430-Q434 WeakPolarHBondContact O-CG 3.13Å; N430-Q434 PolarHBondContact O-N 3.31Å; A432-Q434 PolarHBondContact O-N 2.91Å; Q434-N438 VanDerWaalsContact O-CB 3.27Å; Q434-N438 WeakPolarHBondContact O-CB 3.47Å; Q434-N438 PolarHBondContact O-N 3.29Å; Q434-N438 PolarHBondContact O-ND2 3.27Å
435	R	94.4	Very high	93.1	Very high	139 Å²	139	104.3 Å²	104.3	53%	0.525	50%	0.502	S	S	.	.	H	α-helix	trans	-66.8	-49.5	173	-71.8	172.8	-160.6	-169.4	8.7	111	V431 A432 N433 E437 N438 D439	V431-R435 VanDerWaalsContact O-CG 3.27Å; V431-R435 WeakPolarHBondContact O-CG 3.29Å; V431-R435 PolarHBondContact O-N 2.94Å; V431-R435 VanDerWaalsContact O-N 3.13Å; A432-R435 WeakPolarHBondContact O-CB 3.28Å; A432-R435 PolarHBondContact O-N 3.24Å; A432-R435 VanDerWaalsContact O-N 3.12Å; N433-R435 VanDerWaalsContact C-N 3.28Å; N433-R435 PolarHBondContact O-N 2.89Å; R435-E437 VanDerWaalsContact C-N 3.34Å; R435-E437 PolarHBondContact O-N 3.36Å; R435-N438 PolarHBondContact O-N 3.32Å; R435-D439 WeakPolarHBondContact O-CB 3.09Å; R435-D439 PolarHBondContact O-N 3.16Å
436	F	89.6	Confident	93.4	Very high	133 Å²	133	102.8 Å²	102.8	58%	0.583	50%	0.497	S	S	*	.	H	α-helix	trans	-61.1	-39.4	177.6	-70.6	-57.1	0	0	0	112.8	A432 N433 D439 L440	A432-F436 HydrophobicContact CB-CD2 4.49Å; A432-F436 HydrophobicContact CB-CE2 4.29Å; A432-F436 WeakPolarHBondContact O-CD2 3.29Å; A432-F436 PolarHBondContact O-N 2.92Å; N433-F436 CarbonylContact O-C 3.46Å; N433-F436 PolarHBondContact O-N 2.74Å; N433-F436 VanDerWaalsContact O-N 3.14Å; F436-D439 PolarHBondContact O-N 2.85Å; F436-L440 WeakPolarHBondContact O-CB 3.35Å; F436-L440 WeakPolarHBondContact O-CG 3.44Å; F436-L440 PolarHBondContact O-N 2.93Å
437	E	94.2	Very high	93.4	Very high	96 Å²	96	102 Å²	102	45%	0.449	49%	0.493	S	S	.	.	H	α-helix	trans	-65.5	-42.4	174	-75.3	175.9	-178.4	0	0	111.5	N433 R435 N441	N433-E437 WeakPolarHBondContact O-CB 3.22Å; N433-E437 WeakPolarHBondContact O-CG 3.33Å; N433-E437 PolarHBondContact O-N 2.83Å; R435-E437 VanDerWaalsContact C-N 3.34Å; R435-E437 PolarHBondContact O-N 3.36Å; E437-N441 WeakPolarHBondContact O-CB 3.45Å; E437-N441 PolarHBondContact O-N 3.49Å; E437-N441 PolarHBondContact O-ND2 3.12Å
438	N	94.5	Very high	93.4	Very high	107 Å²	107	100.4 Å²	100.4	57%	0.572	49%	0.493	S	S	*	.	H	α-helix	trans	-65.8	-41.3	175.9	-78.4	-47.6	0	0	0	112.2	Q434 R435 N441 R442	Q434-N438 VanDerWaalsContact O-CB 3.27Å; Q434-N438 WeakPolarHBondContact O-CB 3.47Å; Q434-N438 PolarHBondContact O-N 3.29Å; Q434-N438 PolarHBondContact O-ND2 3.27Å; R435-N438 PolarHBondContact O-N 3.32Å; N438-N441 PolarHBondContact O-N 3.46Å; N438-R442 WeakPolarHBondContact O-CB 3.49Å; N438-R442 PolarHBondContact O-N 2.85Å
439	D	94.3	Very high	93.6	Very high	84 Å²	84	96 Å²	96	45%	0.449	48%	0.48	S	S	.	.	H	α-helix	trans	-69.5	-42.6	177.4	-69.2	-25.2	0	0	0	111.4	R435 F436 R442 H443	R435-D439 WeakPolarHBondContact O-CB 3.09Å; R435-D439 PolarHBondContact O-N 3.16Å; F436-D439 PolarHBondContact O-N 2.85Å; D439-R442 WeakPolarHBondContact O-CB 3.29Å; D439-R442 PolarHBondContact O-N 2.93Å; D439-H443 WeakPolarHBondContact O-CB 3.28Å; D439-H443 VanDerWaalsContact O-CG 3.31Å; D439-H443 PolarHBondContact O-N 2.86Å
440	L	91.9	Very high	93.6	Very high	106 Å²	106	95 Å²	95	56%	0.555	48%	0.482	S	S	*	.	H	α-helix	trans	-61.7	-45.1	172	-76.5	170.1	0	0	0	111.5	F436 R442 H443 L444	F436-L440 WeakPolarHBondContact O-CB 3.35Å; F436-L440 WeakPolarHBondContact O-CG 3.44Å; F436-L440 PolarHBondContact O-N 2.93Å; L440-R442 VanDerWaalsContact C-N 3.29Å; L440-R442 PolarHBondContact O-N 3.16Å; L440-H443 PolarHBondContact O-N 2.82Å; L440-L444 VanDerWaalsContact O-CB 3.29Å; L440-L444 WeakPolarHBondContact O-CB 3.49Å; L440-L444 VanDerWaalsContact O-CG 3.28Å; L440-L444 WeakPolarHBondContact O-CG 3.35Å; L440-L444 PolarHBondContact O-N 2.9Å
441	N	93.8	Very high	93.5	Very high	82 Å²	82	96.9 Å²	96.9	44%	0.439	49%	0.489	S	S	.	.	H	α-helix	trans	-63.4	-35.4	175.6	-79.1	-41.9	0	0	0	111.8	E437 N438 K445	E437-N441 WeakPolarHBondContact O-CB 3.45Å; E437-N441 PolarHBondContact O-N 3.49Å; E437-N441 PolarHBondContact O-ND2 3.12Å; N438-N441 PolarHBondContact O-N 3.46Å; N441-K445 VanDerWaalsContact O-CB 3.3Å; N441-K445 WeakPolarHBondContact O-CB 3.36Å; N441-K445 WeakPolarHBondContact O-CG 3.41Å; N441-K445 PolarHBondContact O-N 2.86Å
442	R	93.9	Very high	93.5	Very high	161 Å²	161	96.9 Å²	96.9	61%	0.608	49%	0.494	S	S	*	.	H	α-helix	trans	-66.5	-48.3	173.9	-174.4	179.9	-177.1	121.4	2.5	111.1	N438 D439 L440 K445 Q446	N438-R442 WeakPolarHBondContact O-CB 3.49Å; N438-R442 PolarHBondContact O-N 2.85Å; D439-R442 WeakPolarHBondContact O-CB 3.29Å; D439-R442 PolarHBondContact O-N 2.93Å; L440-R442 VanDerWaalsContact C-N 3.29Å; L440-R442 PolarHBondContact O-N 3.16Å; R442-K445 PolarHBondContact O-N 3.44Å; R442-Q446 WeakPolarHBondContact O-CB 3.4Å; R442-Q446 WeakPolarHBondContact O-CG 3.5Å; R442-Q446 PolarHBondContact O-N 3.31Å
443	H	93	Very high	93.7	Very high	114 Å²	114	101.5 Å²	101.5	53%	0.528	51%	0.51	S	S	.	.	H	α-helix	trans	-64.7	-42	178.1	-68.1	174.3	0	0	0	111.9	D439 L440 Q446 Q447	D439-H443 WeakPolarHBondContact O-CB 3.28Å; D439-H443 VanDerWaalsContact O-CG 3.31Å; D439-H443 PolarHBondContact O-N 2.86Å; L440-H443 PolarHBondContact O-N 2.82Å; H443-Q446 PolarHBondContact O-N 3.41Å; H443-Q447 VanDerWaalsContact O-CB 3.22Å; H443-Q447 WeakPolarHBondContact O-CB 3.4Å; H443-Q447 PolarHBondContact O-N 3.44Å
444	L	94.1	Very high	93.9	Very high	102 Å²	102	102.8 Å²	102.8	53%	0.534	52%	0.516	S	S	.	.	H	α-helix	trans	-64.1	-39.2	174.9	-74.4	171.9	0	0	0	112	L440 A448	L440-L444 VanDerWaalsContact O-CB 3.29Å; L440-L444 WeakPolarHBondContact O-CB 3.49Å; L440-L444 VanDerWaalsContact O-CG 3.28Å; L440-L444 WeakPolarHBondContact O-CG 3.35Å; L440-L444 PolarHBondContact O-N 2.9Å; L444-A448 WeakPolarHBondContact O-CB 3.4Å; L444-A448 PolarHBondContact O-N 3.03Å
445	K	95.7	Very high	94	Very high	158 Å²	158	102.6 Å²	102.6	69%	0.687	52%	0.518	S	S	*	.	H	α-helix	trans	-65.5	-42.7	173.4	-77.3	172.2	-178.4	-179.6	0	112.1	N441 R442 A448 A449	N441-K445 VanDerWaalsContact O-CB 3.3Å; N441-K445 WeakPolarHBondContact O-CB 3.36Å; N441-K445 WeakPolarHBondContact O-CG 3.41Å; N441-K445 PolarHBondContact O-N 2.86Å; R442-K445 PolarHBondContact O-N 3.44Å; K445-A448 PolarHBondContact O-N 3.33Å; K445-A449 VanDerWaalsContact O-CB 3.29Å; K445-A449 WeakPolarHBondContact O-CB 3.39Å; K445-A449 PolarHBondContact O-N 2.94Å
446	Q	95.3	Very high	94.1	Very high	104 Å²	104	99.4 Å²	99.4	49%	0.486	51%	0.514	S	S	.	.	H	α-helix	trans	-65.6	-43.1	176.1	-73.3	174.8	-38.6	0	0	111.8	R442 H443 A449 A450	R442-Q446 WeakPolarHBondContact O-CB 3.4Å; R442-Q446 WeakPolarHBondContact O-CG 3.5Å; R442-Q446 PolarHBondContact O-N 3.31Å; H443-Q446 PolarHBondContact O-N 3.41Å; Q446-A449 PolarHBondContact O-N 2.88Å; Q446-A450 WeakPolarHBondContact O-CB 3.15Å; Q446-A450 PolarHBondContact O-N 2.87Å
447	Q	93	Very high	94.5	Very high	101 Å²	101	99.4 Å²	99.4	47%	0.472	52%	0.516	S	S	.	.	H	α-helix	trans	-66.4	-41.6	176	176.2	169.8	0.4	0	0	111.5	H443 A450 H451	H443-Q447 VanDerWaalsContact O-CB 3.22Å; H443-Q447 WeakPolarHBondContact O-CB 3.4Å; H443-Q447 PolarHBondContact O-N 3.44Å; Q447-A450 PolarHBondContact O-N 3.38Å; Q447-H451 PolarHBondContact NE2-NE2 2.91Å; Q447-H451 WeakPolarHBondContact O-CB 3.28Å; Q447-H451 PolarHBondContact O-CD2 2.81Å; Q447-H451 PolarHBondContact O-N 3.26Å
448	A	94.6	Very high	94.5	Very high	60 Å²	60	97.1 Å²	97.1	50%	0.496	51%	0.51	S	S	.	.	H	α-helix	trans	-66.3	-39.1	175.7	0	0	0	0	0	112	L444 K445 A452	L444-A448 WeakPolarHBondContact O-CB 3.4Å; L444-A448 PolarHBondContact O-N 3.03Å; K445-A448 PolarHBondContact O-N 3.33Å; A448-A452 VanDerWaalsContact O-CB 3.28Å; A448-A452 WeakPolarHBondContact O-CB 3.38Å; A448-A452 PolarHBondContact O-N 3.29Å
449	A	95	Very high	94.6	Very high	45 Å²	45	97 Å²	97	37%	0.372	51%	0.509	S	S	.	.	H	α-helix	trans	-63.6	-48.7	173	0	0	0	0	0	111.4	K445 Q446 H451 A452 E453	K445-A449 VanDerWaalsContact O-CB 3.29Å; K445-A449 WeakPolarHBondContact O-CB 3.39Å; K445-A449 PolarHBondContact O-N 2.94Å; Q446-A449 PolarHBondContact O-N 2.88Å; A449-H451 VanDerWaalsContact C-N 3.35Å; A449-H451 PolarHBondContact O-N 2.88Å; A449-A452 WeakPolarHBondContact O-CB 3.25Å; A449-A452 PolarHBondContact O-N 3.46Å; A449-A452 VanDerWaalsContact O-N 3.12Å; A449-E453 WeakPolarHBondContact O-CB 3.35Å; A449-E453 WeakPolarHBondContact O-CG 3.18Å; A449-E453 PolarHBondContact O-N 3.1Å
450	A	93.8	Very high	94.7	Very high	54 Å²	54	99 Å²	99	45%	0.446	51%	0.514	S	S	.	.	H	α-helix	trans	-62.5	-38.1	177.2	0	0	0	0	0	112.9	Q446 Q447 L454	Q446-A450 WeakPolarHBondContact O-CB 3.15Å; Q446-A450 PolarHBondContact O-N 2.87Å; Q447-A450 PolarHBondContact O-N 3.38Å; A450-L454 VanDerWaalsContact O-CB 3.24Å; A450-L454 WeakPolarHBondContact O-CB 3.35Å; A450-L454 PolarHBondContact O-N 2.85Å
451	H	89.6	Confident	94.8	Very high	121 Å²	121	95.8 Å²	95.8	56%	0.56	50%	0.5	S	S	*	.	H	α-helix	trans	-68.6	-37.2	172.1	-83.7	-65.3	0	0	0	112.2	Q447 A449 L455	Q447-H451 PolarHBondContact NE2-NE2 2.91Å; Q447-H451 WeakPolarHBondContact O-CB 3.28Å; Q447-H451 PolarHBondContact O-CD2 2.81Å; Q447-H451 PolarHBondContact O-N 3.26Å; A449-H451 VanDerWaalsContact C-N 3.35Å; A449-H451 PolarHBondContact O-N 2.88Å; H451-L455 VanDerWaalsContact O-CB 3.25Å; H451-L455 WeakPolarHBondContact O-CB 3.4Å; H451-L455 WeakPolarHBondContact O-CG 3.48Å; H451-L455 PolarHBondContact O-N 2.86Å
452	A	95.8	Very high	94.8	Very high	53 Å²	53	97.2 Å²	97.2	44%	0.438	50%	0.504	S	S	.	.	H	α-helix	trans	-66	-45.1	175.1	0	0	0	0	0	111.4	A448 A449 L455 T456	A448-A452 VanDerWaalsContact O-CB 3.28Å; A448-A452 WeakPolarHBondContact O-CB 3.38Å; A448-A452 PolarHBondContact O-N 3.29Å; A449-A452 WeakPolarHBondContact O-CB 3.25Å; A449-A452 PolarHBondContact O-N 3.46Å; A449-A452 VanDerWaalsContact O-N 3.12Å; A452-L455 PolarHBondContact O-N 2.8Å; A452-T456 WeakPolarHBondContact O-CG2 3.49Å; A452-T456 PolarHBondContact O-N 2.85Å; A452-T456 PolarHBondContact O-OG1 2.84Å
453	E	95.5	Very high	95	Very high	132 Å²	132	95.4 Å²	95.4	62%	0.617	50%	0.502	S	S	*	.	H	α-helix	trans	-57.7	-53.7	173.9	-73.9	170.2	-168	0	0	110.6	A449 L455 T456 E457	A449-E453 WeakPolarHBondContact O-CB 3.35Å; A449-E453 WeakPolarHBondContact O-CG 3.18Å; A449-E453 PolarHBondContact O-N 3.1Å; E453-L455 VanDerWaalsContact C-N 3.32Å; E453-L455 PolarHBondContact O-N 3.37Å; E453-T456 PolarHBondContact O-N 3.46Å; E453-T456 VanDerWaalsContact O-N 3.1Å; E453-T456 PolarHBondContact O-OG1 3.34Å; E453-E457 PolarHBondContact O-N 3.33Å
454	L	96.1	Very high	95.1	Very high	97 Å²	97	95.4 Å²	95.4	51%	0.508	50%	0.503	S	S	.	.	H	α-helix	trans	-57.9	-40.9	176.8	179.9	63.9	0	0	0	112.7	A450 E457 S458	A450-L454 VanDerWaalsContact O-CB 3.24Å; A450-L454 WeakPolarHBondContact O-CB 3.35Å; A450-L454 PolarHBondContact O-N 2.85Å; L454-E457 PolarHBondContact O-N 3.06Å; L454-S458 VanDerWaalsContact O-CB 3.3Å; L454-S458 WeakPolarHBondContact O-CB 3.5Å; L454-S458 PolarHBondContact O-N 3.5Å; L454-S458 PolarHBondContact O-OG 2.91Å
455	L	96.6	Very high	95.2	Very high	105 Å²	105	97.2 Å²	97.2	55%	0.55	50%	0.502	S	S	.	.	H	α-helix	trans	-64.4	-45.8	175.2	-77.4	170.6	0	0	0	110.9	H451 A452 E453 E457 S458 L459	H451-L455 VanDerWaalsContact O-CB 3.25Å; H451-L455 WeakPolarHBondContact O-CB 3.4Å; H451-L455 WeakPolarHBondContact O-CG 3.48Å; H451-L455 PolarHBondContact O-N 2.86Å; A452-L455 PolarHBondContact O-N 2.8Å; E453-L455 VanDerWaalsContact C-N 3.32Å; E453-L455 PolarHBondContact O-N 3.37Å; L455-E457 PolarHBondContact O-N 2.94Å; L455-S458 WeakPolarHBondContact CA-OG 3.24Å; L455-S458 PolarHBondContact O-N 2.99Å; L455-S458 PolarHBondContact O-OG 3.09Å; L455-L459 WeakPolarHBondContact O-CB 3.41Å; L455-L459 VanDerWaalsContact O-CG 3.28Å; L455-L459 WeakPolarHBondContact O-CG 3.21Å; L455-L459 PolarHBondContact O-N 3.47Å
456	T	96.5	Very high	95.3	Very high	72 Å²	72	95.2 Å²	95.2	44%	0.442	50%	0.499	S	S	.	.	H	α-helix	trans	-64.9	-36.6	177.4	62.5	0	0	0	0	113	A452 E453 L459 K460	A452-T456 WeakPolarHBondContact O-CG2 3.49Å; A452-T456 PolarHBondContact O-N 2.85Å; A452-T456 PolarHBondContact O-OG1 2.84Å; E453-T456 PolarHBondContact O-N 3.46Å; E453-T456 VanDerWaalsContact O-N 3.1Å; E453-T456 PolarHBondContact O-OG1 3.34Å; T456-L459 PolarHBondContact O-N 3.33Å; T456-K460 WeakPolarHBondContact O-CB 3.27Å; T456-K460 VanDerWaalsContact O-CG 3.27Å; T456-K460 WeakPolarHBondContact O-CG 3.46Å; T456-K460 PolarHBondContact O-N 2.96Å
457	E	96.7	Very high	95.4	Very high	134 Å²	134	94.7 Å²	94.7	63%	0.626	50%	0.496	S	S	*	.	H	α-helix	trans	-66.7	-44.4	173.7	-174	175.6	-167.1	0	0	110.9	E453 L454 L455 L459 K460 S461	E453-E457 PolarHBondContact O-N 3.33Å; L454-E457 PolarHBondContact O-N 3.06Å; L455-E457 PolarHBondContact O-N 2.94Å; E457-L459 VanDerWaalsContact C-N 3.33Å; E457-L459 PolarHBondContact O-N 2.86Å; E457-K460 PolarHBondContact O-N 3.4Å; E457-S461 WeakPolarHBondContact O-CB 3.32Å; E457-S461 PolarHBondContact O-N 2.79Å
458	S	94.6	Very high	95.5	Very high	48 Å²	48	95.7 Å²	95.7	34%	0.336	50%	0.501	S	S	.	.	H	α-helix	trans	-63.5	-37.2	176.2	77.3	0	0	0	0	112.6	L454 L455 Q462	L454-S458 VanDerWaalsContact O-CB 3.3Å; L454-S458 WeakPolarHBondContact O-CB 3.5Å; L454-S458 PolarHBondContact O-N 3.5Å; L454-S458 PolarHBondContact O-OG 2.91Å; L455-S458 WeakPolarHBondContact CA-OG 3.24Å; L455-S458 PolarHBondContact O-N 2.99Å; L455-S458 PolarHBondContact O-OG 3.09Å; S458-Q462 WeakPolarHBondContact O-CB 3.42Å; S458-Q462 WeakPolarHBondContact O-CG 3.29Å; S458-Q462 PolarHBondContact O-N 3.42Å
459	L	96.2	Very high	95.7	Very high	105 Å²	105	98.5 Å²	98.5	55%	0.55	51%	0.507	S	S	.	.	H	α-helix	trans	-69.2	-47.6	176.6	-75.5	171	0	0	0	111.5	L455 T456 E457 S461 Q462 E463	L455-L459 WeakPolarHBondContact O-CB 3.41Å; L455-L459 VanDerWaalsContact O-CG 3.28Å; L455-L459 WeakPolarHBondContact O-CG 3.21Å; L455-L459 PolarHBondContact O-N 3.47Å; T456-L459 PolarHBondContact O-N 3.33Å; E457-L459 VanDerWaalsContact C-N 3.33Å; E457-L459 PolarHBondContact O-N 2.86Å; L459-S461 VanDerWaalsContact C-N 3.3Å; L459-S461 PolarHBondContact O-N 2.87Å; L459-Q462 CarbonylContact O-C 3.51Å; L459-Q462 WeakPolarHBondContact O-CA 3.47Å; L459-Q462 PolarHBondContact O-N 3.43Å; L459-E463 WeakPolarHBondContact O-CB 3.3Å; L459-E463 PolarHBondContact O-N 3.49Å
460	K	97	Very high	95.7	Very high	126 Å²	126	101.8 Å²	101.8	55%	0.548	51%	0.514	S	S	.	.	H	α-helix	trans	-57.3	-44.7	172.6	-73.2	168.7	-178.9	175.1	0	111.4	T456 E457 Q462 E463 E464	T456-K460 WeakPolarHBondContact O-CB 3.27Å; T456-K460 VanDerWaalsContact O-CG 3.27Å; T456-K460 WeakPolarHBondContact O-CG 3.46Å; T456-K460 PolarHBondContact O-N 2.96Å; E457-K460 PolarHBondContact O-N 3.4Å; K460-Q462 VanDerWaalsContact C-N 3.25Å; K460-Q462 PolarHBondContact O-N 3.14Å; K460-E463 PolarHBondContact O-N 3.29Å; K460-E464 WeakPolarHBondContact O-CB 3.39Å; K460-E464 WeakPolarHBondContact O-CG 3.27Å; K460-E464 PolarHBondContact O-N 3.35Å
461	S	94.2	Very high	95.9	Very high	37 Å²	37	104.3 Å²	104.3	26%	0.259	52%	0.515	S	S	.	.	H	α-helix	trans	-66.9	-25.1	177.4	-162.8	0	0	0	0	112.7	E457 L459 R465	E457-S461 WeakPolarHBondContact O-CB 3.32Å; E457-S461 PolarHBondContact O-N 2.79Å; L459-S461 VanDerWaalsContact C-N 3.3Å; L459-S461 PolarHBondContact O-N 2.87Å; S461-R465 VanDerWaalsContact C-NH1 3.32Å; S461-R465 VanDerWaalsContact O-CG 3.27Å; S461-R465 WeakPolarHBondContact O-CG 3.35Å; S461-R465 PolarHBondContact O-N 3.45Å; S461-R465 PolarHBondContact O-NH1 3.33Å; S461-R465 PolarHBondContact OG-NH1 3.44Å; S461-R465 PolarHBondContact OG-NH2 2.82Å
462	Q	94.6	Very high	96.2	Very high	112 Å²	112	100.7 Å²	100.7	52%	0.523	51%	0.506	S	S	.	.	H	α-helix	trans	-79.7	-40.2	169.9	-78.6	-175.4	2	0	0	112.1	S458 L459 K460 R465 L466	S458-Q462 WeakPolarHBondContact O-CB 3.42Å; S458-Q462 WeakPolarHBondContact O-CG 3.29Å; S458-Q462 PolarHBondContact O-N 3.42Å; L459-Q462 CarbonylContact O-C 3.51Å; L459-Q462 WeakPolarHBondContact O-CA 3.47Å; L459-Q462 PolarHBondContact O-N 3.43Å; K460-Q462 VanDerWaalsContact C-N 3.25Å; K460-Q462 PolarHBondContact O-N 3.14Å; Q462-R465 PolarHBondContact O-N 3.2Å; Q462-L466 WeakPolarHBondContact O-CB 3.43Å; Q462-L466 VanDerWaalsContact O-CG 3.29Å; Q462-L466 WeakPolarHBondContact O-CG 3.47Å; Q462-L466 PolarHBondContact O-N 2.79Å
463	E	96.6	Very high	96.2	Very high	123 Å²	123	100.6 Å²	100.6	58%	0.575	50%	0.499	S	S	*	.	H	α-helix	trans	-59.9	-50	175.3	-175.4	171.1	-153.8	0	0	111	L459 K460 R465 L466 E467	L459-E463 WeakPolarHBondContact O-CB 3.3Å; L459-E463 PolarHBondContact O-N 3.49Å; K460-E463 PolarHBondContact O-N 3.29Å; E463-R465 VanDerWaalsContact C-N 3.33Å; E463-R465 PolarHBondContact O-N 2.77Å; E463-L466 PolarHBondContact O-N 2.84Å; E463-L466 VanDerWaalsContact O-N 3.14Å; E463-E467 PolarHBondContact O-N 2.61Å
464	E	96.7	Very high	96.3	Very high	115 Å²	115	97.7 Å²	97.7	54%	0.537	49%	0.487	S	S	.	.	H	α-helix	trans	-57.6	-42	174.1	-73.1	174.4	-178.8	0	0	112.5	K460 Q468	K460-E464 WeakPolarHBondContact O-CB 3.39Å; K460-E464 WeakPolarHBondContact O-CG 3.27Å; K460-E464 PolarHBondContact O-N 3.35Å; E464-Q468 WeakPolarHBondContact O-CB 3.2Å; E464-Q468 WeakPolarHBondContact O-CG 3.34Å; E464-Q468 PolarHBondContact O-N 2.68Å
465	R	95.6	Very high	96.3	Very high	139 Å²	139	98.3 Å²	98.3	53%	0.525	49%	0.487	S	S	.	.	H	α-helix	trans	-67.2	-40.7	175.6	-77.1	-177.1	-167.8	92.2	0.3	112	S461 Q462 E463 Q468 L469	S461-R465 VanDerWaalsContact C-NH1 3.32Å; S461-R465 VanDerWaalsContact O-CG 3.27Å; S461-R465 WeakPolarHBondContact O-CG 3.35Å; S461-R465 PolarHBondContact O-N 3.45Å; S461-R465 PolarHBondContact O-NH1 3.33Å; S461-R465 PolarHBondContact OG-NH1 3.44Å; S461-R465 PolarHBondContact OG-NH2 2.82Å; Q462-R465 PolarHBondContact O-N 3.2Å; E463-R465 VanDerWaalsContact C-N 3.33Å; E463-R465 PolarHBondContact O-N 2.77Å; R465-Q468 PolarHBondContact O-N 2.77Å; R465-L469 WeakPolarHBondContact O-CB 3.46Å; R465-L469 VanDerWaalsContact O-CG 3.24Å; R465-L469 WeakPolarHBondContact O-CG 3.32Å; R465-L469 PolarHBondContact O-N 3.02Å
466	L	97.1	Very high	96.3	Very high	116 Å²	116	96.2 Å²	96.2	61%	0.607	48%	0.478	S	S	*	.	H	α-helix	trans	-66.1	-41	176.7	-75.6	169.8	0	0	0	111.1	Q462 E463 L469 H470	Q462-L466 WeakPolarHBondContact O-CB 3.43Å; Q462-L466 VanDerWaalsContact O-CG 3.29Å; Q462-L466 WeakPolarHBondContact O-CG 3.47Å; Q462-L466 PolarHBondContact O-N 2.79Å; E463-L466 PolarHBondContact O-N 2.84Å; E463-L466 VanDerWaalsContact O-N 3.14Å; L466-L469 PolarHBondContact O-N 2.83Å; L466-H470 WeakPolarHBondContact O-CB 3.38Å; L466-H470 PolarHBondContact O-N 3.28Å
467	E	97.3	Very high	96.2	Very high	93 Å²	93	99.4 Å²	99.4	44%	0.435	48%	0.482	S	S	.	.	H	α-helix	trans	-60.6	-46.9	171.6	-79	-161	-175.9	0	0	112	E463 H470 K471	E463-E467 PolarHBondContact O-N 2.61Å; E467-H470 PolarHBondContact O-N 2.87Å; E467-K471 VanDerWaalsContact O-CB 3.32Å; E467-K471 WeakPolarHBondContact O-CB 3.38Å; E467-K471 WeakPolarHBondContact O-CD 3.38Å; E467-K471 WeakPolarHBondContact O-CG 3.31Å; E467-K471 PolarHBondContact O-N 3.38Å; E467-K471 IonicContact OE2-NZ 3.95Å; E467-K471 PolarHBondContact OE2-NZ 3.35Å
468	Q	96	Very high	96.2	Very high	122 Å²	122	96.9 Å²	96.9	57%	0.57	47%	0.473	S	S	*	.	H	α-helix	trans	-61.7	-45.3	178.4	-74.8	169.2	15.7	0	0	111.4	E464 R465 H470 K471 A472	E464-Q468 WeakPolarHBondContact O-CB 3.2Å; E464-Q468 WeakPolarHBondContact O-CG 3.34Å; E464-Q468 PolarHBondContact O-N 2.68Å; R465-Q468 PolarHBondContact O-N 2.77Å; Q468-H470 VanDerWaalsContact C-N 3.34Å; Q468-H470 PolarHBondContact O-N 3.47Å; Q468-K471 PolarHBondContact O-N 2.85Å; Q468-A472 WeakPolarHBondContact O-CB 3.24Å; Q468-A472 PolarHBondContact O-N 2.83Å
469	L	97.6	Very high	96.2	Very high	119 Å²	119	101.9 Å²	101.9	62%	0.623	49%	0.485	S	S	*	.	H	α-helix	trans	-63.2	-39.5	175.1	-72.1	171	0	0	0	111.9	R465 L466 D473	R465-L469 WeakPolarHBondContact O-CB 3.46Å; R465-L469 VanDerWaalsContact O-CG 3.24Å; R465-L469 WeakPolarHBondContact O-CG 3.32Å; R465-L469 PolarHBondContact O-N 3.02Å; L466-L469 PolarHBondContact O-N 2.83Å; L469-D473 VanDerWaalsContact O-CB 3.31Å; L469-D473 WeakPolarHBondContact O-CB 3.21Å; L469-D473 PolarHBondContact O-N 3.5Å
470	H	95.6	Very high	96.1	Very high	114 Å²	114	104.2 Å²	104.2	53%	0.528	49%	0.487	S	S	.	.	H	α-helix	trans	-70.3	-40.6	178.3	-173	49.9	0	0	0	112.3	L466 E467 Q468 D473 I474	L466-H470 WeakPolarHBondContact O-CB 3.38Å; L466-H470 PolarHBondContact O-N 3.28Å; E467-H470 PolarHBondContact O-N 2.87Å; Q468-H470 VanDerWaalsContact C-N 3.34Å; Q468-H470 PolarHBondContact O-N 3.47Å; H470-D473 PolarHBondContact O-N 3.45Å; H470-I474 WeakPolarHBondContact NE2-CD1 3.37Å; H470-I474 WeakPolarHBondContact O-CB 3.42Å; H470-I474 WeakPolarHBondContact O-CG1 3.33Å; H470-I474 PolarHBondContact O-N 2.9Å
471	K	97.2	Very high	95.9	Very high	107 Å²	107	104.3 Å²	104.3	47%	0.465	49%	0.489	S	S	.	.	H	α-helix	trans	-60.3	-47.5	172.8	-73.6	160.4	-178.6	164.6	0	110.4	E467 Q468 D473 I474 E475	E467-K471 VanDerWaalsContact O-CB 3.32Å; E467-K471 WeakPolarHBondContact O-CB 3.38Å; E467-K471 WeakPolarHBondContact O-CD 3.38Å; E467-K471 WeakPolarHBondContact O-CG 3.31Å; E467-K471 PolarHBondContact O-N 3.38Å; E467-K471 IonicContact OE2-NZ 3.95Å; E467-K471 PolarHBondContact OE2-NZ 3.35Å; Q468-K471 PolarHBondContact O-N 2.85Å; K471-D473 PolarHBondContact O-N 2.8Å; K471-I474 PolarHBondContact O-N 2.95Å; K471-E475 WeakPolarHBondContact O-CB 3.5Å; K471-E475 WeakPolarHBondContact O-CG 3.2Å; K471-E475 PolarHBondContact O-N 2.93Å
472	A	96	Very high	95.9	Very high	45 Å²	45	108.2 Å²	108.2	37%	0.372	50%	0.501	S	S	.	.	H	α-helix	trans	-64.4	-37.8	175.6	0	0	0	0	0	113.5	Q468 T476	Q468-A472 WeakPolarHBondContact O-CB 3.24Å; Q468-A472 PolarHBondContact O-N 2.83Å; A472-T476 WeakPolarHBondContact O-CB 3.33Å; A472-T476 VanDerWaalsContact O-CG2 3.3Å; A472-T476 WeakPolarHBondContact O-CG2 3.42Å; A472-T476 PolarHBondContact O-N 3.37Å; A472-T476 PolarHBondContact O-OG1 2.92Å
473	D	97.1	Very high	95.8	Very high	52 Å²	52	108.3 Å²	108.3	28%	0.278	50%	0.502	S	S	.	.	H	α-helix	trans	-67	-42.5	174.2	179.2	44.7	0	0	0	111.6	L469 H470 K471 T476 R477	L469-D473 VanDerWaalsContact O-CB 3.31Å; L469-D473 WeakPolarHBondContact O-CB 3.21Å; L469-D473 PolarHBondContact O-N 3.5Å; H470-D473 PolarHBondContact O-N 3.45Å; K471-D473 PolarHBondContact O-N 2.8Å; D473-T476 WeakPolarHBondContact CA-OG1 3.4Å; D473-T476 PolarHBondContact O-OG1 3.1Å; D473-T476 VanDerWaalsContact O-OG1 3.1Å; D473-R477 WeakPolarHBondContact O-CB 3.42Å; D473-R477 WeakPolarHBondContact O-CG 3.33Å; D473-R477 PolarHBondContact O-N 2.93Å; D473-R477 IonicContact OD1-CZ 2.67Å; D473-R477 IonicContact OD1-NE 3.17Å; D473-R477 PolarHBondContact OD1-NE 3.44Å; D473-R477 IonicContact OD1-NH2 2.64Å; D473-R477 PolarHBondContact OD1-NH2 2.88Å; D473-R477 IonicContact OD2-CZ 2.69Å; D473-R477 IonicContact OD2-NE 2.76Å; D473-R477 PolarHBondContact OD2-NE 2.89Å; D473-R477 IonicContact OD2-NH2 3.89Å; D473-R477 PolarHBondContact OD2-NH2 2.85Å
474	I	96.3	Very high	95.6	Very high	71 Å²	71	106.8 Å²	106.8	36%	0.364	49%	0.494	S	S	.	.	H	α-helix	trans	-61.4	-48.4	172.5	-72.2	168.2	0	0	0	110.7	H470 K471 R477 L478	H470-I474 WeakPolarHBondContact NE2-CD1 3.37Å; H470-I474 WeakPolarHBondContact O-CB 3.42Å; H470-I474 WeakPolarHBondContact O-CG1 3.33Å; H470-I474 PolarHBondContact O-N 2.9Å; K471-I474 PolarHBondContact O-N 2.95Å; I474-R477 PolarHBondContact O-N 3.49Å; I474-L478 HydrophobicContact CG2-CD1 3.78Å; I474-L478 HydrophobicContact CG2-CG 4.24Å; I474-L478 WeakPolarHBondContact O-CB 3.36Å; I474-L478 VanDerWaalsContact O-CG 3.31Å; I474-L478 WeakPolarHBondContact O-CG 3.15Å; I474-L478 PolarHBondContact O-N 3.33Å
475	E	97	Very high	95.4	Very high	110 Å²	110	105.5 Å²	105.5	51%	0.514	49%	0.491	S	S	.	.	H	α-helix	trans	-59.1	-50.5	178.5	-76.7	173.3	-174.8	0	0	111.2	K471 R477 L478 Y479	K471-E475 WeakPolarHBondContact O-CB 3.5Å; K471-E475 WeakPolarHBondContact O-CG 3.2Å; K471-E475 PolarHBondContact O-N 2.93Å; E475-R477 VanDerWaalsContact C-N 3.32Å; E475-R477 PolarHBondContact O-N 3.34Å; E475-L478 PolarHBondContact O-N 3.19Å; E475-L478 VanDerWaalsContact O-N 3.14Å; E475-Y479 HydrophobicContact CB-CD2 4.41Å; E475-Y479 HydrophobicContact CB-CE2 4.35Å; E475-Y479 WeakPolarHBondContact O-CD2 3.16Å; E475-Y479 PolarHBondContact O-N 3.22Å
476	T	96.4	Very high	95.3	Very high	60 Å²	60	105.5 Å²	105.5	37%	0.368	50%	0.497	S	S	.	.	H	α-helix	trans	-63.5	-34.7	178.2	55.7	0	0	0	0	112.9	A472 D473 R480	A472-T476 WeakPolarHBondContact O-CB 3.33Å; A472-T476 VanDerWaalsContact O-CG2 3.3Å; A472-T476 WeakPolarHBondContact O-CG2 3.42Å; A472-T476 PolarHBondContact O-N 3.37Å; A472-T476 PolarHBondContact O-OG1 2.92Å; D473-T476 WeakPolarHBondContact CA-OG1 3.4Å; D473-T476 PolarHBondContact O-OG1 3.1Å; D473-T476 VanDerWaalsContact O-OG1 3.1Å; T476-R480 WeakPolarHBondContact O-CB 3.41Å; T476-R480 VanDerWaalsContact O-CG 3.27Å; T476-R480 WeakPolarHBondContact O-CG 3.5Å; T476-R480 PolarHBondContact O-N 3.28Å
477	R	94.8	Very high	95.1	Very high	140 Å²	140	104.8 Å²	104.8	53%	0.528	49%	0.49	S	S	.	.	H	α-helix	trans	-66.1	-43.1	171.2	-72.1	171.2	-167.7	-145.2	13.5	112	D473 I474 E475 R480 Q481	D473-R477 WeakPolarHBondContact O-CB 3.42Å; D473-R477 WeakPolarHBondContact O-CG 3.33Å; D473-R477 PolarHBondContact O-N 2.93Å; D473-R477 IonicContact OD1-CZ 2.67Å; D473-R477 IonicContact OD1-NE 3.17Å; D473-R477 PolarHBondContact OD1-NE 3.44Å; D473-R477 IonicContact OD1-NH2 2.64Å; D473-R477 PolarHBondContact OD1-NH2 2.88Å; D473-R477 IonicContact OD2-CZ 2.69Å; D473-R477 IonicContact OD2-NE 2.76Å; D473-R477 PolarHBondContact OD2-NE 2.89Å; D473-R477 IonicContact OD2-NH2 3.89Å; D473-R477 PolarHBondContact OD2-NH2 2.85Å; I474-R477 PolarHBondContact O-N 3.49Å; E475-R477 VanDerWaalsContact C-N 3.32Å; E475-R477 PolarHBondContact O-N 3.34Å; R477-R480 PolarHBondContact O-N 3.14Å; R477-Q481 WeakPolarHBondContact O-CB 3.31Å; R477-Q481 WeakPolarHBondContact O-CG 3.26Å; R477-Q481 PolarHBondContact O-N 2.83Å
478	L	95.9	Very high	94.9	Very high	80 Å²	80	107.5 Å²	107.5	42%	0.419	50%	0.497	S	S	.	.	H	α-helix	trans	-64.5	-40.1	176	-74.1	172.9	0	0	0	111.7	I474 E475 Q481 K482	I474-L478 HydrophobicContact CG2-CD1 3.78Å; I474-L478 HydrophobicContact CG2-CG 4.24Å; I474-L478 WeakPolarHBondContact O-CB 3.36Å; I474-L478 VanDerWaalsContact O-CG 3.31Å; I474-L478 WeakPolarHBondContact O-CG 3.15Å; I474-L478 PolarHBondContact O-N 3.33Å; E475-L478 PolarHBondContact O-N 3.19Å; E475-L478 VanDerWaalsContact O-N 3.14Å; L478-Q481 PolarHBondContact O-N 3Å; L478-K482 WeakPolarHBondContact O-CB 3.27Å; L478-K482 VanDerWaalsContact O-CG 3.26Å; L478-K482 WeakPolarHBondContact O-CG 3.47Å; L478-K482 PolarHBondContact O-N 2.95Å
479	Y	95.5	Very high	94.8	Very high	153 Å²	153	107.8 Å²	107.8	60%	0.6	50%	0.496	S	S	*	.	H	α-helix	trans	-63.6	-49	174.1	-78.8	-66.2	0	0	0	111.4	E475 Q481 K482 E483	E475-Y479 HydrophobicContact CB-CD2 4.41Å; E475-Y479 HydrophobicContact CB-CE2 4.35Å; E475-Y479 WeakPolarHBondContact O-CD2 3.16Å; E475-Y479 PolarHBondContact O-N 3.22Å; Y479-Q481 VanDerWaalsContact C-N 3.31Å; Y479-Q481 PolarHBondContact O-N 3.15Å; Y479-K482 WeakPolarHBondContact O-CB 3.3Å; Y479-K482 PolarHBondContact O-N 3.36Å; Y479-K482 VanDerWaalsContact O-N 3.15Å; Y479-E483 WeakPolarHBondContact O-CB 3.44Å; Y479-E483 PolarHBondContact O-N 3.05Å
480	R	94	Very high	94.6	Very high	155 Å²	155	103.8 Å²	103.8	59%	0.585	48%	0.484	S	S	*	.	H	α-helix	trans	-59.1	-39.6	174.8	-72.2	171.5	-173.9	140.8	1.8	112.7	T476 R477 H484	T476-R480 WeakPolarHBondContact O-CB 3.41Å; T476-R480 VanDerWaalsContact O-CG 3.27Å; T476-R480 WeakPolarHBondContact O-CG 3.5Å; T476-R480 PolarHBondContact O-N 3.28Å; R477-R480 PolarHBondContact O-N 3.14Å; R480-H484 WeakPolarHBondContact O-CB 3.08Å; R480-H484 PolarHBondContact O-N 3.05Å
481	Q	92	Very high	94.5	Very high	128 Å²	128	104 Å²	104	60%	0.598	48%	0.483	S	S	*	.	H	α-helix	trans	-66.5	-40.6	175.7	-78.3	-179.7	-11.7	0	0	112.1	R477 L478 Y479 L485	R477-Q481 WeakPolarHBondContact O-CB 3.31Å; R477-Q481 WeakPolarHBondContact O-CG 3.26Å; R477-Q481 PolarHBondContact O-N 2.83Å; L478-Q481 PolarHBondContact O-N 3Å; Y479-Q481 VanDerWaalsContact C-N 3.31Å; Y479-Q481 PolarHBondContact O-N 3.15Å; Q481-L485 WeakPolarHBondContact O-CB 3.24Å; Q481-L485 PolarHBondContact O-N 2.91Å
482	K	93.6	Very high	94.3	Very high	118 Å²	118	102.8 Å²	102.8	51%	0.513	48%	0.481	S	S	.	.	H	α-helix	trans	-64.3	-44.2	174.5	-75.9	171.2	-179.2	178.2	0	111.8	L478 Y479 L485 Q486	L478-K482 WeakPolarHBondContact O-CB 3.27Å; L478-K482 VanDerWaalsContact O-CG 3.26Å; L478-K482 WeakPolarHBondContact O-CG 3.47Å; L478-K482 PolarHBondContact O-N 2.95Å; Y479-K482 WeakPolarHBondContact O-CB 3.3Å; Y479-K482 PolarHBondContact O-N 3.36Å; Y479-K482 VanDerWaalsContact O-N 3.15Å; K482-L485 PolarHBondContact O-N 3.44Å; K482-Q486 WeakPolarHBondContact O-CB 3.21Å; K482-Q486 VanDerWaalsContact O-CG 3.31Å; K482-Q486 WeakPolarHBondContact O-CG 3.42Å; K482-Q486 PolarHBondContact O-N 2.86Å
483	E	92.6	Very high	94.3	Very high	114 Å²	114	105.2 Å²	105.2	53%	0.533	49%	0.488	S	S	.	.	H	α-helix	trans	-60.5	-54.1	177.5	-178.4	175.1	-147.5	0	0	111.2	Y479 L485 Q486 E487	Y479-E483 WeakPolarHBondContact O-CB 3.44Å; Y479-E483 PolarHBondContact O-N 3.05Å; E483-L485 VanDerWaalsContact C-N 3.26Å; E483-L485 PolarHBondContact O-N 3Å; E483-Q486 CarbonylContact O-C 3.55Å; E483-Q486 WeakPolarHBondContact O-CB 3.45Å; E483-Q486 PolarHBondContact O-N 2.81Å; E483-E487 PolarHBondContact O-N 2.88Å
484	H	93	Very high	94	Very high	91 Å²	91	105.9 Å²	105.9	42%	0.421	49%	0.493	S	S	.	.	H	α-helix	trans	-62.1	-30.6	175.7	167.1	-104	0	0	0	113.2	R480 R488	R480-H484 WeakPolarHBondContact O-CB 3.08Å; R480-H484 PolarHBondContact O-N 3.05Å; H484-R488 PolarHBondContact CE1-NE 3.48Å; H484-R488 PolarHBondContact CE1-NH2 3.06Å; H484-R488 PolarHBondContact NE2-NE 2.84Å; H484-R488 PolarHBondContact NE2-NH2 2.8Å; H484-R488 VanDerWaalsContact NE2-NH2 3.19Å; H484-R488 WeakPolarHBondContact O-CG 3.31Å; H484-R488 PolarHBondContact O-N 3.48Å; H484-R488 VanDerWaalsContact O-N 3.12Å
485	L	92	Very high	94	Very high	88 Å²	88	106.8 Å²	106.8	46%	0.461	50%	0.496	S	S	.	.	H	α-helix	trans	-72.4	-39.2	172.6	-177.2	63.8	0	0	0	111.8	Q481 K482 E483 R488 F489	Q481-L485 WeakPolarHBondContact O-CB 3.24Å; Q481-L485 PolarHBondContact O-N 2.91Å; K482-L485 PolarHBondContact O-N 3.44Å; E483-L485 VanDerWaalsContact C-N 3.26Å; E483-L485 PolarHBondContact O-N 3Å; L485-R488 PolarHBondContact O-N 2.87Å; L485-F489 HydrophobicContact CD1-CD2 4.1Å; L485-F489 HydrophobicContact CD1-CE2 3.67Å; L485-F489 HydrophobicContact CD1-CZ 4.15Å; L485-F489 HydrophobicContact CD2-CE2 3.89Å; L485-F489 HydrophobicContact CG-CD2 3.81Å; L485-F489 HydrophobicContact CG-CE2 3.49Å; L485-F489 VanDerWaalsContact CG-CE2 3.49Å; L485-F489 HydrophobicContact CG-CZ 4.42Å; L485-F489 WeakPolarHBondContact O-CD2 3.34Å; L485-F489 PolarHBondContact O-N 3.26Å
486	Q	94.4	Very high	93.8	Very high	140 Å²	140	106 Å²	106	65%	0.654	50%	0.495	S	S	*	.	H	α-helix	trans	-65	-41.2	173.6	-77.2	174.5	-37.4	0	0	111.7	K482 E483 R488 F489 G490	K482-Q486 WeakPolarHBondContact O-CB 3.21Å; K482-Q486 VanDerWaalsContact O-CG 3.31Å; K482-Q486 WeakPolarHBondContact O-CG 3.42Å; K482-Q486 PolarHBondContact O-N 2.86Å; E483-Q486 CarbonylContact O-C 3.55Å; E483-Q486 WeakPolarHBondContact O-CB 3.45Å; E483-Q486 PolarHBondContact O-N 2.81Å; Q486-R488 VanDerWaalsContact C-N 3.34Å; Q486-R488 PolarHBondContact O-N 3.32Å; Q486-F489 PolarHBondContact O-N 3.29Å; Q486-G490 PolarHBondContact O-N 2.86Å
487	E	93.3	Very high	93.6	Very high	100 Å²	100	108.8 Å²	108.8	47%	0.467	50%	0.503	S	S	.	.	H	α-helix	trans	-59.5	-43.5	171.6	-73	-173.9	-174.7	0	0	112.1	E483 G490 K491	E483-E487 PolarHBondContact O-N 2.88Å; E487-G490 PolarHBondContact O-N 3.29Å; E487-K491 WeakPolarHBondContact O-CG 3.01Å; E487-K491 PolarHBondContact O-N 3.31Å; E487-K491 IonicContact OE2-NZ 3.3Å
488	R	93.1	Very high	93.4	Very high	151 Å²	151	108.1 Å²	108.1	57%	0.57	51%	0.506	S	S	*	.	H	α-helix	trans	-65.3	-41.3	176.4	-77.5	-179.1	-178.8	-149.7	-0.6	112.1	H484 L485 Q486 G490 K491 L492	H484-R488 PolarHBondContact CE1-NE 3.48Å; H484-R488 PolarHBondContact CE1-NH2 3.06Å; H484-R488 PolarHBondContact NE2-NE 2.84Å; H484-R488 PolarHBondContact NE2-NH2 2.8Å; H484-R488 VanDerWaalsContact NE2-NH2 3.19Å; H484-R488 WeakPolarHBondContact O-CG 3.31Å; H484-R488 PolarHBondContact O-N 3.48Å; H484-R488 VanDerWaalsContact O-N 3.12Å; L485-R488 PolarHBondContact O-N 2.87Å; Q486-R488 VanDerWaalsContact C-N 3.34Å; Q486-R488 PolarHBondContact O-N 3.32Å; R488-G490 VanDerWaalsContact C-N 3.33Å; R488-K491 PolarHBondContact O-N 3.31Å; R488-L492 VanDerWaalsContact O-CB 3.24Å; R488-L492 WeakPolarHBondContact O-CB 3.41Å; R488-L492 PolarHBondContact O-N 3.12Å
489	F	93	Very high	93.2	Very high	128 Å²	128	110.9 Å²	110.9	56%	0.561	52%	0.515	S	S	*	.	H	α-helix	trans	-65.2	-37.1	173.5	-78.5	-54	0	0	0	112.1	L485 Q486 L493	L485-F489 HydrophobicContact CD1-CD2 4.1Å; L485-F489 HydrophobicContact CD1-CE2 3.67Å; L485-F489 HydrophobicContact CD1-CZ 4.15Å; L485-F489 HydrophobicContact CD2-CE2 3.89Å; L485-F489 HydrophobicContact CG-CD2 3.81Å; L485-F489 HydrophobicContact CG-CE2 3.49Å; L485-F489 VanDerWaalsContact CG-CE2 3.49Å; L485-F489 HydrophobicContact CG-CZ 4.42Å; L485-F489 WeakPolarHBondContact O-CD2 3.34Å; L485-F489 PolarHBondContact O-N 3.26Å; Q486-F489 PolarHBondContact O-N 3.29Å; F489-L493 WeakPolarHBondContact O-CB 3.46Å; F489-L493 PolarHBondContact O-N 2.89Å
490	G	93.5	Very high	92.9	Very high	35 Å²	35	106 Å²	106	36%	0.361	51%	0.506	S	S	.	.	H	α-helix	trans	-61.2	-51.2	173.6	0	0	0	0	0	112	Q486 E487 R488 L493 T494	Q486-G490 PolarHBondContact O-N 2.86Å; E487-G490 PolarHBondContact O-N 3.29Å; R488-G490 VanDerWaalsContact C-N 3.33Å; G490-L493 PolarHBondContact O-N 3.41Å; G490-T494 PolarHBondContact O-N 2.84Å; G490-T494 PolarHBondContact O-OG1 2.92Å
491	K	93.3	Very high	92.8	Very high	118 Å²	118	101 Å²	101	51%	0.513	50%	0.498	S	S	.	.	H	α-helix	trans	-60.8	-45.7	176.5	-71.6	167.3	-177.3	163.7	0	112.3	E487 R488 L493 T494 E495	E487-K491 WeakPolarHBondContact O-CG 3.01Å; E487-K491 PolarHBondContact O-N 3.31Å; E487-K491 IonicContact OE2-NZ 3.3Å; R488-K491 PolarHBondContact O-N 3.31Å; K491-L493 VanDerWaalsContact C-N 3.3Å; K491-L493 PolarHBondContact O-N 2.95Å; K491-T494 WeakPolarHBondContact CA-OG1 3.38Å; K491-T494 PolarHBondContact O-N 3.24Å; K491-T494 PolarHBondContact O-OG1 3.33Å; K491-E495 WeakPolarHBondContact O-CB 3.26Å; K491-E495 VanDerWaalsContact O-CG 3.26Å; K491-E495 WeakPolarHBondContact O-CG 3.46Å; K491-E495 PolarHBondContact O-N 2.82Å
492	L	93.1	Very high	92.7	Very high	82 Å²	82	97.2 Å²	97.2	43%	0.429	49%	0.489	S	S	.	.	H	α-helix	trans	-64.7	-35.2	177.2	-175.5	65.4	0	0	0	111.8	R488 I496	R488-L492 VanDerWaalsContact O-CB 3.24Å; R488-L492 WeakPolarHBondContact O-CB 3.41Å; R488-L492 PolarHBondContact O-N 3.12Å; L492-I496 HydrophobicContact CD1-CD1 4.29Å; L492-I496 HydrophobicContact CG-CD1 3.95Å; L492-I496 WeakPolarHBondContact O-CB 3.47Å; L492-I496 WeakPolarHBondContact O-CD1 3.19Å; L492-I496 WeakPolarHBondContact O-CG1 3.36Å; L492-I496 PolarHBondContact O-N 2.84Å
493	L	95.2	Very high	92.5	Very high	96 Å²	96	97 Å²	97	50%	0.503	49%	0.492	S	S	.	.	H	α-helix	trans	-69	-41.2	175.8	-176.3	64.8	0	0	0	111.5	F489 G490 K491 I496 Q497	F489-L493 WeakPolarHBondContact O-CB 3.46Å; F489-L493 PolarHBondContact O-N 2.89Å; G490-L493 PolarHBondContact O-N 3.41Å; K491-L493 VanDerWaalsContact C-N 3.3Å; K491-L493 PolarHBondContact O-N 2.95Å; L493-I496 PolarHBondContact O-N 2.8Å; L493-Q497 WeakPolarHBondContact O-CB 3.25Å; L493-Q497 VanDerWaalsContact O-CG 3.29Å; L493-Q497 WeakPolarHBondContact O-CG 3.29Å; L493-Q497 PolarHBondContact O-N 3.16Å
494	T	92.2	Very high	92.4	Very high	65 Å²	65	95.9 Å²	95.9	40%	0.399	49%	0.493	S	S	.	.	H	α-helix	trans	-66.3	-43	173.9	52	0	0	0	0	111.3	G490 K491 I496 Q497 E498	G490-T494 PolarHBondContact O-N 2.84Å; G490-T494 PolarHBondContact O-OG1 2.92Å; K491-T494 WeakPolarHBondContact CA-OG1 3.38Å; K491-T494 PolarHBondContact O-N 3.24Å; K491-T494 PolarHBondContact O-OG1 3.33Å; T494-I496 PolarHBondContact O-N 3.44Å; T494-Q497 PolarHBondContact O-N 2.87Å; T494-Q497 VanDerWaalsContact O-N 3.16Å; T494-E498 WeakPolarHBondContact O-CB 3.39Å; T494-E498 VanDerWaalsContact O-CG 3.29Å; T494-E498 WeakPolarHBondContact O-CG 3.45Å; T494-E498 PolarHBondContact O-N 2.86Å
495	E	95.1	Very high	92	Very high	91 Å²	91	96.3 Å²	96.3	43%	0.425	50%	0.498	S	S	.	.	H	α-helix	trans	-57.4	-46.4	173.3	-74.2	166.4	-159.5	0	0	111.2	K491 Q497 E498 F499	K491-E495 WeakPolarHBondContact O-CB 3.26Å; K491-E495 VanDerWaalsContact O-CG 3.26Å; K491-E495 WeakPolarHBondContact O-CG 3.46Å; K491-E495 PolarHBondContact O-N 2.82Å; E495-Q497 PolarHBondContact O-N 3.44Å; E495-E498 PolarHBondContact O-N 3.34Å; E495-F499 HydrophobicContact CB-CD2 4.47Å; E495-F499 HydrophobicContact CB-CE2 4.36Å; E495-F499 WeakPolarHBondContact O-CB 3.4Å; E495-F499 WeakPolarHBondContact O-CD2 3.45Å; E495-F499 WeakPolarHBondContact O-CG 3.21Å; E495-F499 PolarHBondContact O-N 3.47Å
496	I	92.7	Very high	91.8	Very high	94 Å²	94	93.8 Å²	93.8	48%	0.482	49%	0.488	S	S	.	.	H	α-helix	trans	-64.2	-38.5	176.6	-71.8	166.8	0	0	0	111.7	L492 L493 T494 A500	L492-I496 HydrophobicContact CD1-CD1 4.29Å; L492-I496 HydrophobicContact CG-CD1 3.95Å; L492-I496 WeakPolarHBondContact O-CB 3.47Å; L492-I496 WeakPolarHBondContact O-CD1 3.19Å; L492-I496 WeakPolarHBondContact O-CG1 3.36Å; L492-I496 PolarHBondContact O-N 2.84Å; L493-I496 PolarHBondContact O-N 2.8Å; T494-I496 PolarHBondContact O-N 3.44Å; I496-A500 VanDerWaalsContact O-CB 3.23Å; I496-A500 WeakPolarHBondContact O-CB 3.19Å; I496-A500 PolarHBondContact O-N 2.91Å
497	Q	93.3	Very high	91.5	Very high	117 Å²	117	92.5 Å²	92.5	55%	0.547	48%	0.482	S	S	.	.	H	α-helix	trans	-67.4	-41	175.7	-76.2	176.2	-9.1	0	0	111.9	L493 T494 E495 A500 A501	L493-Q497 WeakPolarHBondContact O-CB 3.25Å; L493-Q497 VanDerWaalsContact O-CG 3.29Å; L493-Q497 WeakPolarHBondContact O-CG 3.29Å; L493-Q497 PolarHBondContact O-N 3.16Å; T494-Q497 PolarHBondContact O-N 2.87Å; T494-Q497 VanDerWaalsContact O-N 3.16Å; E495-Q497 PolarHBondContact O-N 3.44Å; Q497-A500 PolarHBondContact O-N 2.92Å; Q497-A501 WeakPolarHBondContact O-CB 3.43Å; Q497-A501 PolarHBondContact O-N 3.35Å
498	E	90.3	Very high	91.2	Very high	127 Å²	127	91.6 Å²	91.6	59%	0.593	48%	0.478	S	S	*	.	H	α-helix	trans	-63.7	-45.3	174.2	-74	169.2	-160.7	0	0	111.2	T494 E495 A501 A502	T494-E498 WeakPolarHBondContact O-CB 3.39Å; T494-E498 VanDerWaalsContact O-CG 3.29Å; T494-E498 WeakPolarHBondContact O-CG 3.45Å; T494-E498 PolarHBondContact O-N 2.86Å; E495-E498 PolarHBondContact O-N 3.34Å; E498-A501 PolarHBondContact O-N 3.43Å; E498-A502 VanDerWaalsContact O-CB 3.25Å; E498-A502 WeakPolarHBondContact O-CB 3.45Å; E498-A502 PolarHBondContact O-N 3.39Å
499	F	91	Very high	90.7	Very high	138 Å²	138	90.2 Å²	90.2	61%	0.605	47%	0.473	S	S	*	.	H	α-helix	trans	-64	-41.1	174	-75.6	-57.4	0	0	0	112.2	E495 A502 I503	E495-F499 HydrophobicContact CB-CD2 4.47Å; E495-F499 HydrophobicContact CB-CE2 4.36Å; E495-F499 WeakPolarHBondContact O-CB 3.4Å; E495-F499 WeakPolarHBondContact O-CD2 3.45Å; E495-F499 WeakPolarHBondContact O-CG 3.21Å; E495-F499 PolarHBondContact O-N 3.47Å; F499-A502 PolarHBondContact O-N 2.86Å; F499-I503 WeakPolarHBondContact O-CB 3.28Å; F499-I503 WeakPolarHBondContact O-CD1 3.48Å; F499-I503 WeakPolarHBondContact O-CG1 3.27Å; F499-I503 PolarHBondContact O-N 3.39Å
500	A	90.8	Very high	90.5	Very high	49 Å²	49	88.7 Å²	88.7	41%	0.405	47%	0.467	S	S	.	.	H	α-helix	trans	-63.8	-44.6	176.8	0	0	0	0	0	111.6	I496 Q497 I503 V504	I496-A500 VanDerWaalsContact O-CB 3.23Å; I496-A500 WeakPolarHBondContact O-CB 3.19Å; I496-A500 PolarHBondContact O-N 2.91Å; Q497-A500 PolarHBondContact O-N 2.92Å; A500-I503 PolarHBondContact O-N 2.71Å; A500-V504 WeakPolarHBondContact O-CG2 3.29Å; A500-V504 PolarHBondContact O-N 2.82Å
501	A	90.4	Very high	90.3	Very high	50 Å²	50	90 Å²	90	41%	0.413	47%	0.465	S	S	.	.	H	α-helix	trans	-61.5	-46.9	174	0	0	0	0	0	111.4	Q497 E498 I503 V504 D505	Q497-A501 WeakPolarHBondContact O-CB 3.43Å; Q497-A501 PolarHBondContact O-N 3.35Å; E498-A501 PolarHBondContact O-N 3.43Å; A501-I503 VanDerWaalsContact C-N 3.28Å; A501-I503 PolarHBondContact O-N 3.21Å; A501-V504 PolarHBondContact O-N 2.82Å; A501-D505 WeakPolarHBondContact O-CB 3.23Å; A501-D505 PolarHBondContact O-N 3.08Å
502	A	89.7	Confident	90	Very high	50 Å²	50	88.3 Å²	88.3	41%	0.413	46%	0.459	S	S	.	.	H	α-helix	trans	-62.1	-33.1	178.1	0	0	0	0	0	113.2	E498 F499 S506	E498-A502 VanDerWaalsContact O-CB 3.25Å; E498-A502 WeakPolarHBondContact O-CB 3.45Å; E498-A502 PolarHBondContact O-N 3.39Å; F499-A502 PolarHBondContact O-N 2.86Å; A502-S506 VanDerWaalsContact O-CB 3.29Å; A502-S506 WeakPolarHBondContact O-CB 3.47Å; A502-S506 PolarHBondContact O-N 3.31Å
503	I	90.1	Very high	89.8	Confident	113 Å²	113	85 Å²	85	58%	0.579	44%	0.442	S	S	*	.	H	α-helix	trans	-68.8	-47.6	173.3	-72	163.8	0	0	0	110.6	F499 A500 A501 D505 S506 E507	F499-I503 WeakPolarHBondContact O-CB 3.28Å; F499-I503 WeakPolarHBondContact O-CD1 3.48Å; F499-I503 WeakPolarHBondContact O-CG1 3.27Å; F499-I503 PolarHBondContact O-N 3.39Å; A500-I503 PolarHBondContact O-N 2.71Å; A501-I503 VanDerWaalsContact C-N 3.28Å; A501-I503 PolarHBondContact O-N 3.21Å; I503-D505 PolarHBondContact O-N 3.01Å; I503-S506 CarbonylContact O-C 3.59Å; I503-S506 WeakPolarHBondContact O-CA 3.29Å; I503-S506 WeakPolarHBondContact O-CB 3.45Å; I503-S506 PolarHBondContact O-N 3.5Å; I503-S506 VanDerWaalsContact O-N 3.08Å; I503-E507 PolarHBondContact O-N 3.31Å
504	V	90.4	Very high	89.5	Confident	91 Å²	91	85.5 Å²	85.5	55%	0.552	44%	0.437	S	S	*	.	H	α-helix	trans	-61.1	-45.5	177.6	171.7	0	0	0	0	111.1	A500 A501 S506 E507 E508	A500-V504 WeakPolarHBondContact O-CG2 3.29Å; A500-V504 PolarHBondContact O-N 2.82Å; A501-V504 PolarHBondContact O-N 2.82Å; V504-S506 PolarHBondContact O-N 2.86Å; V504-E507 PolarHBondContact O-N 3.36Å; V504-E508 PolarHBondContact O-N 3.46Å
505	D	85	Confident	89.4	Confident	99 Å²	99	89 Å²	89	53%	0.529	44%	0.443	S	S	.	.	H	α-helix	trans	-62.2	-31.5	174.6	-73.6	-12	0	0	0	112	A501 I503 R509	A501-D505 WeakPolarHBondContact O-CB 3.23Å; A501-D505 PolarHBondContact O-N 3.08Å; I503-D505 PolarHBondContact O-N 3.01Å; D505-R509 WeakPolarHBondContact O-CB 3.41Å; D505-R509 VanDerWaalsContact O-CG 3.3Å; D505-R509 WeakPolarHBondContact O-CG 3.43Å; D505-R509 PolarHBondContact O-N 3.02Å; D505-R509 VanDerWaalsContact O-N 3.13Å; D505-R509 PolarHBondContact O-NE 3.17Å
506	S	86.9	Confident	89.1	Confident	36 Å²	36	84.9 Å²	84.9	25%	0.252	42%	0.424	S	S	.	.	H	α-helix	trans	-75.5	-38.7	174.7	-154	0	0	0	0	112.8	A502 I503 V504 R509 E510	A502-S506 VanDerWaalsContact O-CB 3.29Å; A502-S506 WeakPolarHBondContact O-CB 3.47Å; A502-S506 PolarHBondContact O-N 3.31Å; I503-S506 CarbonylContact O-C 3.59Å; I503-S506 WeakPolarHBondContact O-CA 3.29Å; I503-S506 WeakPolarHBondContact O-CB 3.45Å; I503-S506 PolarHBondContact O-N 3.5Å; I503-S506 VanDerWaalsContact O-N 3.08Å; V504-S506 PolarHBondContact O-N 2.86Å; S506-R509 PolarHBondContact O-N 3.18Å; S506-R509 PolarHBondContact OG-NH1 3.27Å; S506-E510 VanDerWaalsContact O-CB 3.27Å; S506-E510 WeakPolarHBondContact O-CB 3.47Å; S506-E510 VanDerWaalsContact O-CG 3.28Å; S506-E510 WeakPolarHBondContact O-CG 3.46Å; S506-E510 PolarHBondContact O-N 3.05Å
507	E	88.9	Confident	89	Confident	112 Å²	112	84.7 Å²	84.7	52%	0.523	42%	0.42	S	S	.	.	H	α-helix	trans	-63.2	-42.9	176.1	-175	174.9	-171.9	0	0	111.3	I503 V504 E510 M511	I503-E507 PolarHBondContact O-N 3.31Å; V504-E507 PolarHBondContact O-N 3.36Å; E507-E510 PolarHBondContact O-N 3.22Å; E507-M511 WeakPolarHBondContact O-CB 3.22Å; E507-M511 PolarHBondContact O-N 2.93Å
508	E	87	Confident	88.9	Confident	82 Å²	82	83.9 Å²	83.9	38%	0.383	42%	0.416	S	S	.	.	H	α-helix	trans	-66.9	-47.2	176.3	-179.8	54.7	-149	0	0	111.4	V504 E510 M511 Q512	V504-E508 PolarHBondContact O-N 3.46Å; E508-E510 VanDerWaalsContact C-N 3.29Å; E508-E510 PolarHBondContact O-N 3.19Å; E508-M511 PolarHBondContact O-N 2.89Å; E508-M511 VanDerWaalsContact O-N 3.1Å; E508-Q512 WeakPolarHBondContact O-CG 3.37Å; E508-Q512 PolarHBondContact O-N 2.78Å; E508-Q512 WeakPolarHBondContact OE1-CG 3.36Å; E508-Q512 PolarHBondContact OE1-NE2 3.33Å
509	R	83.2	Confident	89	Confident	122 Å²	122	78 Å²	78	46%	0.46	39%	0.389	S	S	.	.	H	α-helix	trans	-56.4	-43.8	173.2	-80.6	-175.9	-75.4	96.2	-2.1	111.7	D505 S506 Q512 N513	D505-R509 WeakPolarHBondContact O-CB 3.41Å; D505-R509 VanDerWaalsContact O-CG 3.3Å; D505-R509 WeakPolarHBondContact O-CG 3.43Å; D505-R509 PolarHBondContact O-N 3.02Å; D505-R509 VanDerWaalsContact O-N 3.13Å; D505-R509 PolarHBondContact O-NE 3.17Å; S506-R509 PolarHBondContact O-N 3.18Å; S506-R509 PolarHBondContact OG-NH1 3.27Å; R509-Q512 PolarHBondContact O-N 3.17Å; R509-N513 WeakPolarHBondContact O-CB 3.41Å; R509-N513 PolarHBondContact O-N 3.48Å
510	E	88.6	Confident	89.1	Confident	95 Å²	95	74.3 Å²	74.3	44%	0.444	37%	0.371	S	S	.	.	H	α-helix	trans	-65.5	-37.8	175.5	-80.3	-175.9	-153.8	0	0	112.9	S506 E507 E508 N513 R514	S506-E510 VanDerWaalsContact O-CB 3.27Å; S506-E510 WeakPolarHBondContact O-CB 3.47Å; S506-E510 VanDerWaalsContact O-CG 3.28Å; S506-E510 WeakPolarHBondContact O-CG 3.46Å; S506-E510 PolarHBondContact O-N 3.05Å; E507-E510 PolarHBondContact O-N 3.22Å; E508-E510 VanDerWaalsContact C-N 3.29Å; E508-E510 PolarHBondContact O-N 3.19Å; E510-N513 PolarHBondContact O-N 3.35Å; E510-R514 WeakPolarHBondContact O-CB 3.48Å; E510-R514 VanDerWaalsContact O-CG 3.31Å; E510-R514 WeakPolarHBondContact O-CG 3.2Å; E510-R514 PolarHBondContact O-N 3.1Å; E510-R514 IonicContact OE2-CZ 2.72Å; E510-R514 IonicContact OE2-NH1 3.18Å; E510-R514 PolarHBondContact OE2-NH1 3.39Å; E510-R514 IonicContact OE2-NH2 3Å
511	M	89.2	Confident	89.2	Confident	63 Å²	63	78.2 Å²	78.2	31%	0.31	38%	0.379	S	S	.	.	H	α-helix	trans	-65.1	-44.2	177.2	-166.9	-176.6	-56.1	0	0	110.8	E507 E508 N513 R514 R515	E507-M511 WeakPolarHBondContact O-CB 3.22Å; E507-M511 PolarHBondContact O-N 2.93Å; E508-M511 PolarHBondContact O-N 2.89Å; E508-M511 VanDerWaalsContact O-N 3.1Å; M511-N513 VanDerWaalsContact C-N 3.34Å; M511-R514 PolarHBondContact O-N 2.99Å; M511-R515 WeakPolarHBondContact O-CG 3.46Å; M511-R515 PolarHBondContact O-N 2.81Å; M511-R515 PolarHBondContact SD-NH2 3.46Å
512	Q	86.5	Confident	89.3	Confident	82 Å²	82	77 Å²	77	38%	0.383	37%	0.366	S	S	.	.	H	α-helix	trans	-62.3	-42.1	173.2	-64.9	176.9	14.7	0	0	111.4	E508 R509 R515 A516 T708	E508-Q512 WeakPolarHBondContact O-CG 3.37Å; E508-Q512 PolarHBondContact O-N 2.78Å; E508-Q512 WeakPolarHBondContact OE1-CG 3.36Å; E508-Q512 PolarHBondContact OE1-NE2 3.33Å; R509-Q512 PolarHBondContact O-N 3.17Å; Q512-R515 PolarHBondContact O-N 2.89Å; Q512-A516 WeakPolarHBondContact O-CB 3.36Å; Q512-A516 PolarHBondContact O-N 2.81Å; Q512-T708 HydrophobicContact CB-CG2 3.64Å
513	N	88.5	Confident	89.4	Confident	14 Å²	14	74.6 Å²	74.6	8%	0.075	35%	0.347	C	S	.	.	H	α-helix	trans	-63.7	-41	177	-166.8	-77.5	0	0	0	112.6	R509 E510 M511 A516 K517 T708 M709	R509-N513 WeakPolarHBondContact O-CB 3.41Å; R509-N513 PolarHBondContact O-N 3.48Å; E510-N513 PolarHBondContact O-N 3.35Å; M511-N513 VanDerWaalsContact C-N 3.34Å; N513-A516 PolarHBondContact O-N 3.41Å; N513-K517 WeakPolarHBondContact O-CB 3.37Å; N513-K517 WeakPolarHBondContact O-CG 3.42Å; N513-K517 PolarHBondContact O-N 3.13Å; N513-K517 WeakPolarHBondContact OD1-CD 3.31Å; N513-K517 WeakPolarHBondContact OD1-CE 3.4Å; N513-K517 PolarHBondContact OD1-NZ 2.81Å; N513-T708 WeakPolarHBondContact CA-OG1 3.38Å; N513-T708 PolarHBondContact ND2-OG1 2.93Å; N513-M709 WeakPolarHBondContact ND2-CG 3.32Å; N513-M709 PolarHBondContact ND2-SD 2.73Å
514	R	90.6	Very high	89.5	Confident	106 Å²	106	74.7 Å²	74.7	40%	0.4	34%	0.34	S	S	.	.	H	α-helix	trans	-60.8	-49	172.3	-77.1	-177.4	-76.9	-99.1	1.2	110.8	E510 M511 A516 K517 E518	E510-R514 WeakPolarHBondContact O-CB 3.48Å; E510-R514 VanDerWaalsContact O-CG 3.31Å; E510-R514 WeakPolarHBondContact O-CG 3.2Å; E510-R514 PolarHBondContact O-N 3.1Å; E510-R514 IonicContact OE2-CZ 2.72Å; E510-R514 IonicContact OE2-NH1 3.18Å; E510-R514 PolarHBondContact OE2-NH1 3.39Å; E510-R514 IonicContact OE2-NH2 3Å; M511-R514 PolarHBondContact O-N 2.99Å; R514-A516 PolarHBondContact O-N 3.21Å; R514-K517 WeakPolarHBondContact O-CB 3.08Å; R514-K517 PolarHBondContact O-N 3.09Å; R514-E518 WeakPolarHBondContact O-CG 3.38Å; R514-E518 PolarHBondContact O-N 2.9Å
515	R	88.8	Confident	89.6	Confident	138 Å²	138	76.7 Å²	76.7	52%	0.521	34%	0.343	S	S	.	.	H	α-helix	trans	-59.1	-44.3	175.7	-70.8	174.2	-177.2	159.6	4	112.5	M511 Q512 E518 L519	M511-R515 WeakPolarHBondContact O-CG 3.46Å; M511-R515 PolarHBondContact O-N 2.81Å; M511-R515 PolarHBondContact SD-NH2 3.46Å; Q512-R515 PolarHBondContact O-N 2.89Å; R515-E518 PolarHBondContact O-N 3.01Å; R515-L519 WeakPolarHBondContact O-CB 3.3Å; R515-L519 PolarHBondContact O-N 3.45Å
516	A	88.6	Confident	89.8	Confident	5 Å²	5	72.1 Å²	72.1	4%	0.041	32%	0.318	C	S	.	.	H	α-helix	trans	-64.8	-40.9	177.7	0	0	0	0	0	112.3	Q512 N513 R514 L519 W520 F705	Q512-A516 WeakPolarHBondContact O-CB 3.36Å; Q512-A516 PolarHBondContact O-N 2.81Å; N513-A516 PolarHBondContact O-N 3.41Å; R514-A516 PolarHBondContact O-N 3.21Å; A516-L519 PolarHBondContact O-N 3.3Å; A516-W520 WeakPolarHBondContact O-CB 3.49Å; A516-W520 PolarHBondContact O-N 3.1Å; A516-F705 HydrophobicContact CB-CB 4.12Å
517	K	91.3	Very high	90.1	Very high	90 Å²	90	73.7 Å²	73.7	39%	0.391	32%	0.319	S	S	.	.	H	α-helix	trans	-61.1	-46.7	171.9	-80.4	166.5	168.4	149.6	0	112.1	N513 R514 L519 W520 F521 F705	N513-K517 WeakPolarHBondContact O-CB 3.37Å; N513-K517 WeakPolarHBondContact O-CG 3.42Å; N513-K517 PolarHBondContact O-N 3.13Å; N513-K517 WeakPolarHBondContact OD1-CD 3.31Å; N513-K517 WeakPolarHBondContact OD1-CE 3.4Å; N513-K517 PolarHBondContact OD1-NZ 2.81Å; R514-K517 WeakPolarHBondContact O-CB 3.08Å; R514-K517 PolarHBondContact O-N 3.09Å; K517-L519 VanDerWaalsContact C-N 3.34Å; K517-L519 PolarHBondContact O-N 3.46Å; K517-W520 WeakPolarHBondContact O-CB 3.23Å; K517-W520 PolarHBondContact O-N 3.4Å; K517-F521 HydrophobicContact CB-CE2 4.44Å; K517-F521 WeakPolarHBondContact O-CD2 3.43Å; K517-F521 PolarHBondContact O-N 2.99Å; K517-F705 HydrophobicContact CD-CE2 4.28Å; K517-F705 HydrophobicContact CG-CD2 3.99Å; K517-F705 HydrophobicContact CG-CE2 3.95Å
518	E	91.9	Very high	90.2	Very high	99 Å²	99	70.9 Å²	70.9	46%	0.463	31%	0.311	S	S	.	.	H	α-helix	trans	-61.7	-41.6	177.4	-73	177.1	-153	0	0	111.8	R514 R515 W520 F521 T522 Y557	R514-E518 WeakPolarHBondContact O-CG 3.38Å; R514-E518 PolarHBondContact O-N 2.9Å; R515-E518 PolarHBondContact O-N 3.01Å; E518-W520 VanDerWaalsContact C-N 3.33Å; E518-W520 PolarHBondContact O-N 2.88Å; E518-F521 PolarHBondContact O-N 3.18Å; E518-T522 WeakPolarHBondContact O-CB 3.09Å; E518-T522 PolarHBondContact O-N 2.98Å; E518-T522 PolarHBondContact O-OG1 3.3Å; E518-Y557 WeakPolarHBondContact CB-OH 3.45Å; E518-Y557 PolarHBondContact O-OH 3.3Å
519	L	91.1	Very high	90.3	Very high	4 Å²	4	67.5 Å²	67.5	2%	0.021	30%	0.298	C	S	.	.	H	α-helix	trans	-62	-41.3	173.1	178.4	63	0	0	0	111.3	R515 A516 K517 T522 S523 L553 Y557 A701	R515-L519 WeakPolarHBondContact O-CB 3.3Å; R515-L519 PolarHBondContact O-N 3.45Å; A516-L519 PolarHBondContact O-N 3.3Å; K517-L519 VanDerWaalsContact C-N 3.34Å; K517-L519 PolarHBondContact O-N 3.46Å; L519-T522 PolarHBondContact O-N 3.47Å; L519-S523 VanDerWaalsContact O-CB 3.28Å; L519-S523 WeakPolarHBondContact O-CB 3.46Å; L519-S523 PolarHBondContact O-N 2.83Å; L519-S523 PolarHBondContact O-OG 2.9Å; L519-L553 HydrophobicContact CD1-CD2 4.39Å; L519-Y557 HydrophobicContact CB-CD1 4.23Å; L519-Y557 HydrophobicContact CB-CE1 3.79Å; L519-Y557 HydrophobicContact CB-CE2 4.46Å; L519-Y557 HydrophobicContact CD1-CD1 4.03Å; L519-Y557 HydrophobicContact CD1-CD2 3.65Å; L519-Y557 HydrophobicContact CD1-CE1 4.23Å; L519-Y557 HydrophobicContact CD1-CE2 3.86Å; L519-Y557 HydrophobicContact CD1-CG 3.75Å; L519-Y557 PolarHBondContact N-OH 2.88Å; L519-Y557 VanDerWaalsContact N-OH 3.17Å; L519-A701 HydrophobicContact CB-CB 4.4Å; L519-A701 HydrophobicContact CD2-CB 4.1Å; L519-A701 HydrophobicContact CG-CB 3.89Å
520	W	92.7	Very high	90.6	Very high	61 Å²	61	61.9 Å²	61.9	23%	0.231	28%	0.278	C	S	.	.	H	α-helix	trans	-64.5	-45.2	177	-176.8	85.6	0	0	0	112.5	A516 K517 E518 S523 R524 A701 D702	A516-W520 WeakPolarHBondContact O-CB 3.49Å; A516-W520 PolarHBondContact O-N 3.1Å; K517-W520 WeakPolarHBondContact O-CB 3.23Å; K517-W520 PolarHBondContact O-N 3.4Å; E518-W520 VanDerWaalsContact C-N 3.33Å; E518-W520 PolarHBondContact O-N 2.88Å; W520-S523 WeakPolarHBondContact CA-OG 3.39Å; W520-S523 PolarHBondContact O-OG 3.19Å; W520-R524 WeakPolarHBondContact O-CB 3.4Å; W520-R524 PolarHBondContact O-N 3.43Å; W520-A701 HydrophobicContact CB-CB 3.8Å; W520-A701 HydrophobicContact CG-CB 4.43Å; W520-D702 VanDerWaalsContact CD1-OD1 3.23Å; W520-D702 PolarHBondContact NE1-OD1 3.08Å
521	F	93.4	Very high	90.6	Very high	130 Å²	130	59.8 Å²	59.8	57%	0.57	27%	0.269	S	S	*	.	H	α-helix	trans	-62.2	-46.1	174.1	-75.1	-64.7	0	0	0	111.4	K517 E518 R524 E525	K517-F521 HydrophobicContact CB-CE2 4.44Å; K517-F521 WeakPolarHBondContact O-CD2 3.43Å; K517-F521 PolarHBondContact O-N 2.99Å; E518-F521 PolarHBondContact O-N 3.18Å; F521-R524 PolarHBondContact O-N 3.15Å; F521-E525 WeakPolarHBondContact O-CB 3.4Å; F521-E525 PolarHBondContact O-N 2.89Å
522	T	92	Very high	90.5	Very high	25 Å²	25	62 Å²	62	15%	0.153	28%	0.282	C	S	.	.	H	α-helix	trans	-64.2	-45	-179.1	-48.5	0	0	0	0	111.6	E518 L519 E525 F526 L553	E518-T522 WeakPolarHBondContact O-CB 3.09Å; E518-T522 PolarHBondContact O-N 2.98Å; E518-T522 PolarHBondContact O-OG1 3.3Å; L519-T522 PolarHBondContact O-N 3.47Å; T522-E525 PolarHBondContact O-N 3.28Å; T522-F526 WeakPolarHBondContact O-CB 3.44Å; T522-F526 PolarHBondContact O-N 3.42Å; T522-L553 HydrophobicContact CG2-CD2 3.62Å; T522-L553 HydrophobicContact CG2-CG 4.26Å
523	S	91.7	Very high	90.4	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-70	-34.6	178	56.7	0	0	0	0	112.5	L519 W520 F526 R527	L519-S523 VanDerWaalsContact O-CB 3.28Å; L519-S523 WeakPolarHBondContact O-CB 3.46Å; L519-S523 PolarHBondContact O-N 2.83Å; L519-S523 PolarHBondContact O-OG 2.9Å; W520-S523 WeakPolarHBondContact CA-OG 3.39Å; W520-S523 PolarHBondContact O-OG 3.19Å; S523-F526 PolarHBondContact O-N 2.96Å; S523-R527 WeakPolarHBondContact O-CB 3.43Å; S523-R527 PolarHBondContact O-N 3.43Å
524	R	93.6	Very high	90.2	Very high	115 Å²	115	66 Å²	66	43%	0.434	30%	0.298	S	S	.	.	H	α-helix	trans	-66.7	-42.9	172.3	-178.5	175.2	177.8	162.4	-0.1	111.7	W520 F521 R527 C528 V698	W520-R524 WeakPolarHBondContact O-CB 3.4Å; W520-R524 PolarHBondContact O-N 3.43Å; F521-R524 PolarHBondContact O-N 3.15Å; R524-R527 PolarHBondContact O-N 3.5Å; R524-C528 WeakPolarHBondContact O-CB 3.4Å; R524-C528 PolarHBondContact O-N 3.18Å; R524-C528 PolarHBondContact O-SG 2.86Å; R524-V698 HydrophobicContact CB-CG2 4.48Å
525	E	91.2	Very high	89.7	Confident	132 Å²	132	65.9 Å²	65.9	62%	0.617	32%	0.319	S	S	*	.	H	α-helix	trans	-61.1	-46.7	173.7	-173.9	-177.7	170.1	0	0	110.8	F521 T522 R527 C528 G529	F521-E525 WeakPolarHBondContact O-CB 3.4Å; F521-E525 PolarHBondContact O-N 2.89Å; T522-E525 PolarHBondContact O-N 3.28Å; E525-R527 PolarHBondContact O-N 3.45Å; E525-C528 PolarHBondContact O-N 3.31Å; E525-G529 PolarHBondContact O-N 3.42Å
526	F	90.7	Very high	89.4	Confident	3 Å²	3	60.8 Å²	60.8	1%	0.013	31%	0.31	C	S	.	.	H	α-helix	trans	-56.1	-50.6	175.1	-179.6	-112.1	0	0	0	111.8	T522 S523 C528 G529 V530 L546 D549 I550 L553 I570 A694 L697	T522-F526 WeakPolarHBondContact O-CB 3.44Å; T522-F526 PolarHBondContact O-N 3.42Å; S523-F526 PolarHBondContact O-N 2.96Å; F526-C528 PolarHBondContact O-N 2.75Å; F526-G529 WeakPolarHBondContact O-CA 3.47Å; F526-G529 PolarHBondContact O-N 3.42Å; F526-G529 VanDerWaalsContact O-N 3.08Å; F526-V530 HydrophobicContact CE1-CG2 4.44Å; F526-V530 HydrophobicContact CE2-CG2 4.42Å; F526-V530 HydrophobicContact CZ-CG2 4.27Å; F526-V530 WeakPolarHBondContact O-CG2 3.11Å; F526-V530 PolarHBondContact O-N 2.91Å; F526-L546 HydrophobicContact CE2-CB 4.27Å; F526-L546 HydrophobicContact CE2-CD1 4.31Å; F526-L546 HydrophobicContact CE2-CD2 3.96Å; F526-L546 HydrophobicContact CE2-CG 4.4Å; F526-L546 HydrophobicContact CZ-CD1 4.25Å; F526-D549 HydrophobicContact CD2-CB 3.71Å; F526-D549 HydrophobicContact CE2-CB 4.09Å; F526-I550 HydrophobicContact CE2-CG1 4.32Å; F526-I550 HydrophobicContact CZ-CG1 4.44Å; F526-L553 HydrophobicContact CG-CD1 4.4Å; F526-I570 HydrophobicContact CE1-CD1 4.41Å; F526-I570 HydrophobicContact CZ-CD1 4.07Å; F526-A694 HydrophobicContact CD1-CB 3.58Å; F526-A694 HydrophobicContact CE1-CB 3.72Å; F526-L697 HydrophobicContact CD1-CD1 4.4Å; F526-L697 HydrophobicContact CE1-CD1 4.49Å
527	R	92.6	Very high	89	Confident	70 Å²	70	69.9 Å²	69.9	26%	0.264	35%	0.349	S	S	.	.	H	α-helix	trans	-58.6	-44	176.6	-170.6	-178.5	67.1	-166.7	-0.4	112.4	S523 R524 E525 G529 V530 L531 F691 A694	S523-R527 WeakPolarHBondContact O-CB 3.43Å; S523-R527 PolarHBondContact O-N 3.43Å; R524-R527 PolarHBondContact O-N 3.5Å; E525-R527 PolarHBondContact O-N 3.45Å; R527-G529 VanDerWaalsContact C-N 3.31Å; R527-V530 PolarHBondContact O-N 2.87Å; R527-L531 WeakPolarHBondContact O-CB 3.43Å; R527-L531 PolarHBondContact O-N 3.17Å; R527-F691 HydrophobicContact CG-CD2 4.29Å; R527-F691 HydrophobicContact CG-CE2 3.87Å; R527-A694 HydrophobicContact CB-CB 3.87Å; R527-A694 HydrophobicContact CG-CB 4.09Å
528	C	90.5	Very high	88.7	Confident	52 Å²	52	70.9 Å²	70.9	35%	0.351	36%	0.358	S	S	.	.	H	α-helix	trans	-66.4	-33.8	175.8	-70.9	0	0	0	0	112.3	R524 E525 F526 N532	R524-C528 WeakPolarHBondContact O-CB 3.4Å; R524-C528 PolarHBondContact O-N 3.18Å; R524-C528 PolarHBondContact O-SG 2.86Å; E525-C528 PolarHBondContact O-N 3.31Å; F526-C528 PolarHBondContact O-N 2.75Å; C528-N532 WeakPolarHBondContact O-CB 3.41Å; C528-N532 PolarHBondContact O-N 2.67Å; C528-N532 PolarHBondContact O-ND2 3.44Å
529	G	88.9	Confident	88.2	Confident	12 Å²	12	68.7 Å²	68.7	12%	0.124	35%	0.348	C	S	.	.	H	α-helix	trans	-67.8	-36.8	174.5	0	0	0	0	0	113.6	E525 F526 R527 G533	E525-G529 PolarHBondContact O-N 3.42Å; F526-G529 WeakPolarHBondContact O-CA 3.47Å; F526-G529 PolarHBondContact O-N 3.42Å; F526-G529 VanDerWaalsContact O-N 3.08Å; R527-G529 VanDerWaalsContact C-N 3.31Å; G529-G533 VanDerWaalsContact O-CA 3.25Å; G529-G533 WeakPolarHBondContact O-CA 3.37Å; G529-G533 PolarHBondContact O-N 2.87Å
530	V	89.4	Confident	87.8	Confident	4 Å²	4	75.4 Å²	75.4	2%	0.024	38%	0.38	C	S	.	.	H	α-helix	trans	-68.5	-45.6	172.2	175	0	0	0	0	110.9	F526 R527 L546 V579 F687 F691	F526-V530 HydrophobicContact CE1-CG2 4.44Å; F526-V530 HydrophobicContact CE2-CG2 4.42Å; F526-V530 HydrophobicContact CZ-CG2 4.27Å; F526-V530 WeakPolarHBondContact O-CG2 3.11Å; F526-V530 PolarHBondContact O-N 2.91Å; R527-V530 PolarHBondContact O-N 2.87Å; V530-L546 HydrophobicContact CG2-CD1 4.26Å; V530-L546 HydrophobicContact CG2-CD2 4.02Å; V530-V579 HydrophobicContact CG1-CG1 4.49Å; V530-F687 HydrophobicContact CG1-CD2 4.2Å; V530-F687 HydrophobicContact CG1-CE2 4.21Å; V530-F691 HydrophobicContact CG1-CB 4.36Å
531	L	89.6	Confident	87.3	Confident	50 Å²	50	75.1 Å²	75.1	26%	0.262	39%	0.387	S	S	.	.	H	α-helix	trans	-62.8	-50.6	-178	-170.2	71.1	0	0	0	112.7	R527 S581 E582 F687 F691	R527-L531 WeakPolarHBondContact O-CB 3.43Å; R527-L531 PolarHBondContact O-N 3.17Å; L531-S581 WeakPolarHBondContact O-CB 3.4Å; L531-E582 HydrophobicContact CD1-CB 4.17Å; L531-E582 VanDerWaalsContact CD1-OE2 3.32Å; L531-E582 WeakPolarHBondContact CD1-OE2 3.33Å; L531-E582 PolarHBondContact O-N 3.43Å; L531-E582 VanDerWaalsContact O-N 3.16Å; L531-F687 HydrophobicContact CD1-CZ 4.35Å; L531-F691 HydrophobicContact CD1-CD2 4.49Å; L531-F691 HydrophobicContact CD1-CE2 3.94Å
532	N	86.6	Confident	86.9	Confident	109 Å²	109	71.6 Å²	71.6	58%	0.583	37%	0.37	S	S	*	.	H	α-helix	trans	-92.6	-19.2	-171.7	-62.8	-26.6	0	0	0	113.7	C528	C528-N532 WeakPolarHBondContact O-CB 3.41Å; C528-N532 PolarHBondContact O-N 2.67Å; C528-N532 PolarHBondContact O-ND2 3.44Å
533	G	84.9	Confident	86.5	Confident	17 Å²	17	72.8 Å²	72.8	18%	0.175	37%	0.371	C	S	.	.			trans	64.6	-155	-171.2	0	0	0	0	0	113.3	G529	G529-G533 VanDerWaalsContact O-CA 3.25Å; G529-G533 WeakPolarHBondContact O-CA 3.37Å; G529-G533 PolarHBondContact O-N 2.87Å
534	R	84	Confident	85.8	Confident	165 Å²	165	75 Å²	75	62%	0.623	38%	0.381	S	S	*	.			trans	-101.8	152.9	175.9	-160.7	-179.3	-159.1	-175.1	3.7	110.5	G536 R542	R534-G536 PolarHBondContact O-N 3.48Å; R534-R542 PolarHBondContact N-O 2.85Å; R534-R542 WeakPolarHBondContact O-CA 3.37Å; R534-R542 WeakPolarHBondContact O-CB 3.47Å; R534-R542 VanDerWaalsContact O-CG 3.24Å; R534-R542 WeakPolarHBondContact O-CG 3.41Å
535	A	80.9	Confident	85.3	Confident	102 Å²	102	72.3 Å²	72.3	84%	0.843	38%	0.378	S	S	*	.			trans	-63.2	125.5	164.9	0	0	0	0	0	110.6
536	G	81.2	Confident	85	Confident	31 Å²	31	66.1 Å²	66.1	32%	0.32	35%	0.349	S	S	.	.			trans	-171.8	151.3	-176.5	0	0	0	0	0	111.9	R534 S541 R542	R534-G536 PolarHBondContact O-N 3.48Å; G536-S541 WeakPolarHBondContact CA-OG 3.26Å; G536-R542 WeakPolarHBondContact O-CD 3.32Å; G536-R542 WeakPolarHBondContact O-CG 3.45Å; G536-R542 PolarHBondContact O-NH1 2.96Å
537	K	81.6	Confident	84.9	Confident	197 Å²	197	67.2 Å²	67.2	86%	0.857	36%	0.359	S	S	*	.	S	Bend	trans	-75.3	-45.9	-178	-67.9	-177.7	179	179.2	0	111.6	S541 R542	K537-S541 PolarHBondContact N-OG 2.93Å; K537-R542 VanDerWaalsContact C-NH1 3.31Å; K537-R542 PolarHBondContact O-NH1 3.38Å
538	D	84.4	Confident	84.7	Confident	111 Å²	111	71.9 Å²	71.9	59%	0.594	38%	0.382	S	S	*	.	S	Bend	trans	-95.9	149.8	-177.3	-53.8	-59.8	0	0	0	111.3	E540 S541 R542	D538-E540 PolarHBondContact O-N 3.02Å; D538-S541 PolarHBondContact N-OG 3.34Å; D538-S541 PolarHBondContact O-N 3.39Å; D538-S541 PolarHBondContact O-OG 2.82Å; D538-R542 PolarHBondContact O-N 3.47Å; D538-R542 VanDerWaalsContact O-N 3.16Å
539	M	81.9	Confident	84.5	Confident	52 Å²	52	71.1 Å²	71.1	26%	0.256	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-34.8	-178.8	-69	176	-65.6	0	0	112.3	R542 Y580 T587	M539-R542 VanDerWaalsContact CG-NH2 3.31Å; M539-R542 PolarHBondContact O-N 3.44Å; M539-Y580 HydrophobicContact CB-CE1 4.1Å; M539-T587 HydrophobicContact SD-CG2 4.29Å
540	E	82.6	Confident	84.5	Confident	146 Å²	146	71.3 Å²	71.3	68%	0.682	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-39	175.9	-66.4	176	-178.4	0	0	111.8	D538 R542 R543	D538-E540 PolarHBondContact O-N 3.02Å; E540-R542 PolarHBondContact O-N 2.86Å; E540-R543 WeakPolarHBondContact O-CB 3.35Å; E540-R543 PolarHBondContact O-N 2.9Å; E540-R543 VanDerWaalsContact O-N 3.13Å
541	S	81.6	Confident	84.6	Confident	54 Å²	54	75.6 Å²	75.6	38%	0.378	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-19.2	176.2	75.5	0	0	0	0	114	G536 K537 D538	G536-S541 WeakPolarHBondContact CA-OG 3.26Å; K537-S541 PolarHBondContact N-OG 2.93Å; D538-S541 PolarHBondContact N-OG 3.34Å; D538-S541 PolarHBondContact O-N 3.39Å; D538-S541 PolarHBondContact O-OG 2.82Å
542	R	85.8	Confident	84.6	Confident	56 Å²	56	77.2 Å²	77.2	21%	0.211	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-14.4	175.2	-69.4	-163	-76.4	-80.8	1.7	114.1	R534 G536 K537 D538 M539 E540 K544 D584	R534-R542 PolarHBondContact N-O 2.85Å; R534-R542 WeakPolarHBondContact O-CA 3.37Å; R534-R542 WeakPolarHBondContact O-CB 3.47Å; R534-R542 VanDerWaalsContact O-CG 3.24Å; R534-R542 WeakPolarHBondContact O-CG 3.41Å; G536-R542 WeakPolarHBondContact O-CD 3.32Å; G536-R542 WeakPolarHBondContact O-CG 3.45Å; G536-R542 PolarHBondContact O-NH1 2.96Å; K537-R542 VanDerWaalsContact C-NH1 3.31Å; K537-R542 PolarHBondContact O-NH1 3.38Å; D538-R542 PolarHBondContact O-N 3.47Å; D538-R542 VanDerWaalsContact O-N 3.16Å; M539-R542 VanDerWaalsContact CG-NH2 3.31Å; M539-R542 PolarHBondContact O-N 3.44Å; E540-R542 PolarHBondContact O-N 2.86Å; R542-K544 PolarHBondContact O-N 3.44Å; R542-D584 IonicContact CZ-OD1 3.92Å; R542-D584 IonicContact NE-OD1 2.74Å; R542-D584 PolarHBondContact NE-OD1 3.44Å; R542-D584 IonicContact NE-OD2 2.83Å; R542-D584 PolarHBondContact NE-OD2 3.18Å; R542-D584 IonicContact NH2-OD1 2.65Å; R542-D584 PolarHBondContact NH2-OD1 2.92Å
543	R	83.4	Confident	84.8	Confident	50 Å²	50	72.1 Å²	72.1	19%	0.189	37%	0.372	C	S	.	.			trans	-63.5	118.8	173.5	-64.2	178.1	120.3	168.2	-4.9	108.8	E540 P545 N577 G578 Y580 D683	E540-R543 WeakPolarHBondContact O-CB 3.35Å; E540-R543 PolarHBondContact O-N 2.9Å; E540-R543 VanDerWaalsContact O-N 3.13Å; R543-P545 WeakPolarHBondContact O-CD 3.43Å; R543-N577 WeakPolarHBondContact CB-O 3.48Å; R543-G578 PolarHBondContact NE-O 3.2Å; R543-Y580 HydrophobicContact CG-CD1 3.94Å; R543-Y580 HydrophobicContact CG-CE1 4.05Å; R543-Y580 HydrophobicContact CG-CG 4.5Å; R543-Y580 VanDerWaalsContact CZ-CZ 3.41Å; R543-Y580 PolarHBondContact NH1-OH 2.93Å; R543-D683 IonicContact CZ-OD1 2.71Å; R543-D683 IonicContact NH2-OD1 2.66Å; R543-D683 PolarHBondContact NH2-OD1 2.87Å
544	K	76.8	Confident	85.1	Confident	47 Å²	47	78.7 Å²	78.7	20%	0.204	39%	0.392	C	S	.	.	B	Isolated β-bridge	trans	-85.2	114.1	173.9	-169.8	-171.2	-178.7	-164.8	0	107.8	R542 L546 D549 G578	R542-K544 PolarHBondContact O-N 3.44Å; K544-L546 PolarHBondContact O-N 2.83Å; K544-D549 WeakPolarHBondContact CE-OD2 3.41Å; K544-D549 IonicContact NZ-OD1 2.76Å; K544-D549 PolarHBondContact NZ-OD1 2.91Å; K544-D549 VanDerWaalsContact NZ-OD1 3.1Å; K544-D549 IonicContact NZ-OD2 3.47Å; K544-D549 PolarHBondContact NZ-OD2 3.48Å; K544-G578 WeakPolarHBondContact O-CA 3.44Å
545	P	82.7	Confident	85.4	Confident	58 Å²	58	76.9 Å²	76.9	38%	0.377	40%	0.395	S	S	.	.			trans	-65.8	119.8	173.2	26.7	-33.3	0	0	0	109.1	R543 A547	R543-P545 WeakPolarHBondContact O-CD 3.43Å; P545-A547 VanDerWaalsContact C-N 3.34Å; P545-A547 PolarHBondContact O-N 3.4Å
546	L	86.1	Confident	85.7	Confident	2 Å²	2	77.1 Å²	77.1	1%	0.01	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-14.9	-169	-59	179.9	0	0	0	113.2	F526 V530 K544 K548 D549 I550 V575 V579 T690	F526-L546 HydrophobicContact CE2-CB 4.27Å; F526-L546 HydrophobicContact CE2-CD1 4.31Å; F526-L546 HydrophobicContact CE2-CD2 3.96Å; F526-L546 HydrophobicContact CE2-CG 4.4Å; F526-L546 HydrophobicContact CZ-CD1 4.25Å; V530-L546 HydrophobicContact CG2-CD1 4.26Å; V530-L546 HydrophobicContact CG2-CD2 4.02Å; K544-L546 PolarHBondContact O-N 2.83Å; L546-K548 PolarHBondContact O-N 3.19Å; L546-D549 PolarHBondContact O-N 3.16Å; L546-I550 HydrophobicContact CB-CD1 3.78Å; L546-I550 HydrophobicContact CB-CG1 4.42Å; L546-I550 PolarHBondContact O-N 3.03Å; L546-V575 PolarHBondContact N-O 3.14Å; L546-V575 VanDerWaalsContact N-O 3.16Å; L546-V579 HydrophobicContact CD1-CG2 3.82Å; L546-T690 HydrophobicContact CD1-CG2 4.12Å
547	A	87.7	Confident	86	Confident	26 Å²	26	76.6 Å²	76.6	22%	0.215	37%	0.365	C	S	.	.	H	α-helix	trans	-45.9	-40.8	-178.9	0	0	0	0	0	114.5	P545 I551 V575	P545-A547 VanDerWaalsContact C-N 3.34Å; P545-A547 PolarHBondContact O-N 3.4Å; A547-I551 WeakPolarHBondContact O-CB 3.28Å; A547-I551 WeakPolarHBondContact O-CD1 3.25Å; A547-I551 WeakPolarHBondContact O-CG1 3.41Å; A547-I551 PolarHBondContact O-N 3.1Å; A547-V575 HydrophobicContact CB-CG1 3.85Å; A547-V575 PolarHBondContact N-O 3.26Å; A547-V575 VanDerWaalsContact N-O 3.13Å
548	K	87.4	Confident	86	Confident	169 Å²	169	69.2 Å²	69.2	74%	0.735	35%	0.345	S	S	*	.	H	α-helix	trans	-67.7	-44.7	-179.8	-65.7	-168.7	-177.1	-168.1	0	112.8	L546 H552	L546-K548 PolarHBondContact O-N 3.19Å; K548-H552 WeakPolarHBondContact O-CB 3.35Å; K548-H552 PolarHBondContact O-N 3.4Å
549	D	87.6	Confident	86	Confident	36 Å²	36	68.4 Å²	68.4	19%	0.193	35%	0.354	C	S	.	.	H	α-helix	trans	-69.1	-39.4	-179.9	-55.5	-12.5	0	0	0	110.1	F526 K544 L546 H552 L553	F526-D549 HydrophobicContact CD2-CB 3.71Å; F526-D549 HydrophobicContact CE2-CB 4.09Å; K544-D549 WeakPolarHBondContact CE-OD2 3.41Å; K544-D549 IonicContact NZ-OD1 2.76Å; K544-D549 PolarHBondContact NZ-OD1 2.91Å; K544-D549 VanDerWaalsContact NZ-OD1 3.1Å; K544-D549 IonicContact NZ-OD2 3.47Å; K544-D549 PolarHBondContact NZ-OD2 3.48Å; L546-D549 PolarHBondContact O-N 3.16Å; D549-H552 WeakPolarHBondContact O-CB 3.41Å; D549-H552 PolarHBondContact O-N 3.38Å; D549-L553 WeakPolarHBondContact O-CG 3.46Å; D549-L553 PolarHBondContact O-N 2.93Å
550	I	89.3	Confident	86.3	Confident	15 Å²	15	68.9 Å²	68.9	8%	0.077	36%	0.357	C	S	.	.	H	α-helix	trans	-64.6	-45.8	177.1	-74.2	169.2	0	0	0	111.7	F526 L546 H552 L553 R554 V567 I570 V575	F526-I550 HydrophobicContact CE2-CG1 4.32Å; F526-I550 HydrophobicContact CZ-CG1 4.44Å; L546-I550 HydrophobicContact CB-CD1 3.78Å; L546-I550 HydrophobicContact CB-CG1 4.42Å; L546-I550 PolarHBondContact O-N 3.03Å; I550-H552 VanDerWaalsContact C-N 3.28Å; I550-H552 PolarHBondContact O-N 2.94Å; I550-L553 PolarHBondContact O-N 3.08Å; I550-R554 WeakPolarHBondContact O-CB 3.49Å; I550-R554 PolarHBondContact O-N 3.48Å; I550-V567 HydrophobicContact CG2-CG1 3.61Å; I550-I570 HydrophobicContact CD1-CD1 3.97Å; I550-I570 HydrophobicContact CD1-CG2 4.15Å; I550-I570 HydrophobicContact CG1-CD1 4.34Å; I550-V575 HydrophobicContact CD1-CB 4.42Å; I550-V575 HydrophobicContact CD1-CG1 4.16Å; I550-V575 HydrophobicContact CD1-CG2 3.8Å
551	I	90	Very high	86.6	Confident	95 Å²	95	67 Å²	67	49%	0.487	36%	0.358	S	S	.	.	H	α-helix	trans	-62.3	-37.9	173.9	-69.1	163.7	0	0	0	110.5	A547 N555	A547-I551 WeakPolarHBondContact O-CB 3.28Å; A547-I551 WeakPolarHBondContact O-CD1 3.25Å; A547-I551 WeakPolarHBondContact O-CG1 3.41Å; A547-I551 PolarHBondContact O-N 3.1Å; I551-N555 VanDerWaalsContact O-CB 3.26Å; I551-N555 WeakPolarHBondContact O-CB 3.38Å; I551-N555 PolarHBondContact O-N 2.72Å; I551-N555 PolarHBondContact O-ND2 2.91Å; I551-N555 PolarHBondContact O-OD1 2.83Å
552	H	90.2	Very high	87.1	Confident	84 Å²	84	68.8 Å²	68.8	39%	0.389	36%	0.359	S	S	.	.	H	α-helix	trans	-63.5	-45.9	175.6	-167.5	75.2	0	0	0	112.3	K548 D549 I550 N555 K556	K548-H552 WeakPolarHBondContact O-CB 3.35Å; K548-H552 PolarHBondContact O-N 3.4Å; D549-H552 WeakPolarHBondContact O-CB 3.41Å; D549-H552 PolarHBondContact O-N 3.38Å; I550-H552 VanDerWaalsContact C-N 3.28Å; I550-H552 PolarHBondContact O-N 2.94Å; H552-N555 PolarHBondContact O-N 3Å; H552-K556 VanDerWaalsContact CE1-CE 3.41Å; H552-K556 WeakPolarHBondContact CE1-CE 3.48Å; H552-K556 WeakPolarHBondContact NE2-CD 3.46Å; H552-K556 VanDerWaalsContact NE2-CE 3.26Å; H552-K556 WeakPolarHBondContact NE2-CE 3.33Å; H552-K556 PolarHBondContact NE2-NZ 3.34Å; H552-K556 PolarHBondContact O-N 3.01Å; H552-K556 VanDerWaalsContact O-N 3.1Å
553	L	91.3	Very high	87.4	Confident	1 Å²	1	66.1 Å²	66.1	1%	0.005	35%	0.349	C	S	.	.	H	α-helix	trans	-61.8	-47	176.1	-74.9	168.3	0	0	0	111.4	L519 T522 F526 D549 I550 N555 K556 Y557 V567 L697	L519-L553 HydrophobicContact CD1-CD2 4.39Å; T522-L553 HydrophobicContact CG2-CD2 3.62Å; T522-L553 HydrophobicContact CG2-CG 4.26Å; F526-L553 HydrophobicContact CG-CD1 4.4Å; D549-L553 WeakPolarHBondContact O-CG 3.46Å; D549-L553 PolarHBondContact O-N 2.93Å; I550-L553 PolarHBondContact O-N 3.08Å; L553-N555 PolarHBondContact O-N 2.81Å; L553-K556 PolarHBondContact O-N 2.78Å; L553-Y557 HydrophobicContact CD2-CD2 3.95Å; L553-Y557 HydrophobicContact CD2-CE2 4.18Å; L553-Y557 WeakPolarHBondContact O-CA 3.24Å; L553-Y557 WeakPolarHBondContact O-CB 3.36Å; L553-Y557 PolarHBondContact O-N 2.82Å; L553-V567 HydrophobicContact CB-CG2 4.49Å; L553-L697 HydrophobicContact CD1-CD1 4.14Å
554	R	90.5	Very high	87.7	Confident	155 Å²	155	65.4 Å²	65.4	59%	0.585	35%	0.353	S	S	*	.	H	α-helix	trans	-62.1	-42.6	178.1	-174.7	173.7	-179.6	151.6	2.3	112.4	I550 G558 D568	I550-R554 WeakPolarHBondContact O-CB 3.49Å; I550-R554 PolarHBondContact O-N 3.48Å; R554-G558 VanDerWaalsContact O-CA 3.27Å; R554-G558 WeakPolarHBondContact O-CA 3.48Å; R554-G558 PolarHBondContact O-N 3.48Å; R554-D568 IonicContact NH1-OD1 2.94Å
555	N	90.8	Very high	88.4	Confident	128 Å²	128	66.1 Å²	66.1	68%	0.684	37%	0.368	S	S	*	.	H	α-helix	trans	-72	-30.9	-178.5	-70.7	-5.3	0	0	0	113.3	I551 H552 L553	I551-N555 VanDerWaalsContact O-CB 3.26Å; I551-N555 WeakPolarHBondContact O-CB 3.38Å; I551-N555 PolarHBondContact O-N 2.72Å; I551-N555 PolarHBondContact O-ND2 2.91Å; I551-N555 PolarHBondContact O-OD1 2.83Å; H552-N555 PolarHBondContact O-N 3Å; L553-N555 PolarHBondContact O-N 2.81Å
556	K	87.8	Confident	88.9	Confident	107 Å²	107	64.2 Å²	64.2	47%	0.465	36%	0.355	S	S	.	.	H	α-helix	trans	-89.2	-39	178.3	-80.1	-172.6	169.2	176.6	0	114.1	H552 L553	H552-K556 VanDerWaalsContact CE1-CE 3.41Å; H552-K556 WeakPolarHBondContact CE1-CE 3.48Å; H552-K556 WeakPolarHBondContact NE2-CD 3.46Å; H552-K556 VanDerWaalsContact NE2-CE 3.26Å; H552-K556 WeakPolarHBondContact NE2-CE 3.33Å; H552-K556 PolarHBondContact NE2-NZ 3.34Å; H552-K556 PolarHBondContact O-N 3.01Å; H552-K556 VanDerWaalsContact O-N 3.1Å; L553-K556 PolarHBondContact O-N 2.78Å
557	Y	87.4	Confident	89	Confident	20 Å²	20	64.6 Å²	64.6	8%	0.078	36%	0.357	C	S	.	.	H	α-helix	trans	-124.4	9.8	-166.6	-50.5	-72.6	0	0	0	113.4	E518 L519 L553 A559 D560	E518-Y557 WeakPolarHBondContact CB-OH 3.45Å; E518-Y557 PolarHBondContact O-OH 3.3Å; L519-Y557 HydrophobicContact CB-CD1 4.23Å; L519-Y557 HydrophobicContact CB-CE1 3.79Å; L519-Y557 HydrophobicContact CB-CE2 4.46Å; L519-Y557 HydrophobicContact CD1-CD1 4.03Å; L519-Y557 HydrophobicContact CD1-CD2 3.65Å; L519-Y557 HydrophobicContact CD1-CE1 4.23Å; L519-Y557 HydrophobicContact CD1-CE2 3.86Å; L519-Y557 HydrophobicContact CD1-CG 3.75Å; L519-Y557 PolarHBondContact N-OH 2.88Å; L519-Y557 VanDerWaalsContact N-OH 3.17Å; L553-Y557 HydrophobicContact CD2-CD2 3.95Å; L553-Y557 HydrophobicContact CD2-CE2 4.18Å; L553-Y557 WeakPolarHBondContact O-CA 3.24Å; L553-Y557 WeakPolarHBondContact O-CB 3.36Å; L553-Y557 PolarHBondContact O-N 2.82Å; Y557-A559 PolarHBondContact O-N 2.61Å; Y557-D560 PolarHBondContact O-N 3.1Å
558	G	80.1	Confident	89.1	Confident	41 Å²	41	68.7 Å²	68.7	42%	0.423	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-2.4	177.1	0	0	0	0	0	115.5	R554	R554-G558 VanDerWaalsContact O-CA 3.27Å; R554-G558 WeakPolarHBondContact O-CA 3.48Å; R554-G558 PolarHBondContact O-N 3.48Å
559	A	84.1	Confident	89.3	Confident	95 Å²	95	64 Å²	64	79%	0.785	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-26.6	167.9	0	0	0	0	0	112.8	Y557 P561	Y557-A559 PolarHBondContact O-N 2.61Å; A559-P561 WeakPolarHBondContact O-CD 3.33Å
560	D	88	Confident	89.5	Confident	62 Å²	62	62.8 Å²	62.8	33%	0.332	36%	0.357	S	S	.	.	S	Bend	trans	-83	114.2	179	-75.1	-19.4	0	0	0	110	Y557 F562 V563 A564 H700	Y557-D560 PolarHBondContact O-N 3.1Å; D560-F562 PolarHBondContact O-N 2.84Å; D560-F562 VanDerWaalsContact O-N 3.14Å; D560-V563 HydrophobicContact CB-CB 3.96Å; D560-V563 HydrophobicContact CB-CG2 3.72Å; D560-V563 PolarHBondContact O-N 3.24Å; D560-A564 PolarHBondContact O-N 3.1Å; D560-H700 IonicContact OD2-CE1 3.68Å
561	P	89.9	Confident	89.5	Confident	106 Å²	106	63.2 Å²	63.2	69%	0.688	36%	0.361	S	S	*	.	H	α-helix	trans	-60.7	-30.5	-176.7	-24.2	34.9	0	0	0	113.1	A559 A565	A559-P561 WeakPolarHBondContact O-CD 3.33Å; P561-A565 VanDerWaalsContact O-CB 3.31Å; P561-A565 WeakPolarHBondContact O-CB 3.47Å; P561-A565 PolarHBondContact O-N 3.03Å
562	F	91.5	Very high	89.4	Confident	91 Å²	91	63.7 Å²	63.7	40%	0.399	37%	0.365	S	S	.	.	H	α-helix	trans	-70	-39.1	176.9	-174	-100	0	0	0	112.5	D560 L566 H700	D560-F562 PolarHBondContact O-N 2.84Å; D560-F562 VanDerWaalsContact O-N 3.14Å; F562-L566 HydrophobicContact CD1-CD1 3.81Å; F562-L566 HydrophobicContact CD1-CG 4.41Å; F562-L566 HydrophobicContact CE1-CD1 3.24Å; F562-L566 HydrophobicContact CE1-CG 4.05Å; F562-L566 HydrophobicContact CZ-CD1 3.68Å; F562-L566 HydrophobicContact CZ-CG 4.16Å; F562-L566 WeakPolarHBondContact O-CB 3.47Å; F562-L566 WeakPolarHBondContact O-CG 3.26Å; F562-L566 PolarHBondContact O-N 3.43Å; F562-H700 HydrophobicContact CD1-CB 3.86Å; F562-H700 AromaticContact CD1-CD2 3.34Å; F562-H700 WeakPolarHBondContact CD1-CD2 3.13Å; F562-H700 AromaticContact CD1-CG 3.52Å; F562-H700 AromaticContact CD1-NE2 3.87Å; F562-H700 HydrophobicContact CE1-CB 3.6Å; F562-H700 AromaticContact CE1-CD2 3.83Å; F562-H700 AromaticContact CE1-CG 3.81Å; F562-H700 AromaticContact CG-CD2 4Å
563	V	91.7	Very high	89.2	Confident	1 Å²	1	63.7 Å²	63.7	1%	0.006	37%	0.365	C	S	.	.	H	α-helix	trans	-70.1	-41	176.8	178.3	0	0	0	0	110.2	D560 L566 V567 L697	D560-V563 HydrophobicContact CB-CB 3.96Å; D560-V563 HydrophobicContact CB-CG2 3.72Å; D560-V563 PolarHBondContact O-N 3.24Å; V563-L566 PolarHBondContact O-N 2.83Å; V563-V567 WeakPolarHBondContact O-CB 3.4Å; V563-V567 WeakPolarHBondContact O-CG2 3.25Å; V563-V567 PolarHBondContact O-N 2.58Å; V563-L697 HydrophobicContact CB-CD2 4.31Å; V563-L697 HydrophobicContact CG1-CD2 3.93Å; V563-L697 HydrophobicContact CG2-CD2 4.11Å
564	A	91.2	Very high	89	Confident	34 Å²	34	63.7 Å²	63.7	28%	0.281	37%	0.365	S	S	.	.	H	α-helix	trans	-59.1	-52.7	173.4	0	0	0	0	0	111.5	D560 L566 V567 D568	D560-A564 PolarHBondContact O-N 3.1Å; A564-L566 VanDerWaalsContact C-N 3.33Å; A564-L566 PolarHBondContact O-N 3.18Å; A564-V567 PolarHBondContact O-N 2.97Å; A564-V567 VanDerWaalsContact O-N 3.14Å; A564-D568 PolarHBondContact O-N 2.63Å
565	A	91.9	Very high	88.9	Confident	63 Å²	63	57.1 Å²	57.1	52%	0.521	34%	0.342	S	S	.	.	H	α-helix	trans	-61.4	-36.3	179.2	0	0	0	0	0	113.4	P561 S569	P561-A565 VanDerWaalsContact O-CB 3.31Å; P561-A565 WeakPolarHBondContact O-CB 3.47Å; P561-A565 PolarHBondContact O-N 3.03Å; A565-S569 WeakPolarHBondContact O-CB 3.46Å; A565-S569 PolarHBondContact O-N 3.32Å; A565-S569 VanDerWaalsContact O-N 3.1Å
566	L	91.7	Very high	88.7	Confident	17 Å²	17	59 Å²	59	9%	0.089	34%	0.341	C	S	.	.	H	α-helix	trans	-69.1	-40.2	173.8	-79.8	-179.2	0	0	0	112.7	F562 V563 A564 S569 L696 L697	F562-L566 HydrophobicContact CD1-CD1 3.81Å; F562-L566 HydrophobicContact CD1-CG 4.41Å; F562-L566 HydrophobicContact CE1-CD1 3.24Å; F562-L566 HydrophobicContact CE1-CG 4.05Å; F562-L566 HydrophobicContact CZ-CD1 3.68Å; F562-L566 HydrophobicContact CZ-CG 4.16Å; F562-L566 WeakPolarHBondContact O-CB 3.47Å; F562-L566 WeakPolarHBondContact O-CG 3.26Å; F562-L566 PolarHBondContact O-N 3.43Å; V563-L566 PolarHBondContact O-N 2.83Å; A564-L566 VanDerWaalsContact C-N 3.33Å; A564-L566 PolarHBondContact O-N 3.18Å; L566-S569 PolarHBondContact O-N 3.02Å; L566-S569 PolarHBondContact O-OG 2.86Å; L566-L696 HydrophobicContact CD1-CB 3.76Å; L566-L696 HydrophobicContact CD2-CB 4.09Å; L566-L696 HydrophobicContact CD2-CD1 3.86Å; L566-L697 HydrophobicContact CB-CD2 4.19Å; L566-L697 HydrophobicContact CB-CG 4.48Å; L566-L697 HydrophobicContact CD1-CD2 3.74Å; L566-L697 HydrophobicContact CD1-CG 3.89Å
567	V	89.8	Confident	88.6	Confident	11 Å²	11	58.7 Å²	58.7	7%	0.067	34%	0.344	C	S	.	.	H	α-helix	trans	-63.6	-44.5	175.7	161.2	0	0	0	0	111	I550 L553 V563 A564 S569 I570	I550-V567 HydrophobicContact CG2-CG1 3.61Å; L553-V567 HydrophobicContact CB-CG2 4.49Å; V563-V567 WeakPolarHBondContact O-CB 3.4Å; V563-V567 WeakPolarHBondContact O-CG2 3.25Å; V563-V567 PolarHBondContact O-N 2.58Å; A564-V567 PolarHBondContact O-N 2.97Å; A564-V567 VanDerWaalsContact O-N 3.14Å; V567-S569 PolarHBondContact O-N 3.11Å; V567-I570 WeakPolarHBondContact O-CB 3.4Å; V567-I570 PolarHBondContact O-N 3.05Å
568	D	89.5	Confident	88.6	Confident	111 Å²	111	57.8 Å²	57.8	59%	0.594	34%	0.341	S	S	*	.	H	α-helix	trans	-71.4	-14.7	179	-64.6	-23.5	0	0	0	112.8	R554 A564 I570	R554-D568 IonicContact NH1-OD1 2.94Å; A564-D568 PolarHBondContact O-N 2.63Å; D568-I570 VanDerWaalsContact C-N 3.34Å
569	S	91.3	Very high	89	Confident	70 Å²	70	56.2 Å²	56.2	49%	0.49	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-8.7	173.7	76.6	0	0	0	0	114.5	A565 L566 V567	A565-S569 WeakPolarHBondContact O-CB 3.46Å; A565-S569 PolarHBondContact O-N 3.32Å; A565-S569 VanDerWaalsContact O-N 3.1Å; L566-S569 PolarHBondContact O-N 3.02Å; L566-S569 PolarHBondContact O-OG 2.86Å; V567-S569 PolarHBondContact O-N 3.11Å
570	I	91.1	Very high	89.3	Confident	11 Å²	11	52.7 Å²	52.7	6%	0.056	29%	0.29	C	S	.	.	S	Bend	trans	-79.9	126.4	179.7	-65.6	173	0	0	0	109.3	F526 I550 V567 D568 D572 A574 V575 T690 A693	F526-I570 HydrophobicContact CE1-CD1 4.41Å; F526-I570 HydrophobicContact CZ-CD1 4.07Å; I550-I570 HydrophobicContact CD1-CD1 3.97Å; I550-I570 HydrophobicContact CD1-CG2 4.15Å; I550-I570 HydrophobicContact CG1-CD1 4.34Å; V567-I570 WeakPolarHBondContact O-CB 3.4Å; V567-I570 PolarHBondContact O-N 3.05Å; D568-I570 VanDerWaalsContact C-N 3.34Å; I570-D572 PolarHBondContact O-N 3.38Å; I570-A574 HydrophobicContact CG2-CB 4.45Å; I570-V575 HydrophobicContact CG2-CG2 3.76Å; I570-T690 HydrophobicContact CG2-CG2 3.77Å; I570-A693 HydrophobicContact CD1-CB 4.36Å; I570-A693 HydrophobicContact CG1-CB 4.05Å
571	P	89.6	Confident	89.5	Confident	24 Å²	24	49.9 Å²	49.9	16%	0.156	28%	0.276	C	S	.	.			trans	-65.3	135	-177.8	25.7	-34.8	0	0	0	112.1	E573 A574 V575 Y686	P571-E573 PolarHBondContact O-N 2.98Å; P571-E573 VanDerWaalsContact O-N 3.13Å; P571-A574 HydrophobicContact CG-CB 3.99Å; P571-A574 WeakPolarHBondContact O-CA 3.48Å; P571-A574 WeakPolarHBondContact O-CB 3.07Å; P571-A574 PolarHBondContact O-N 3.14Å; P571-V575 PolarHBondContact O-N 3.03Å; P571-Y686 HydrophobicContact CB-CD1 3.98Å; P571-Y686 HydrophobicContact CB-CE1 3.74Å; P571-Y686 HydrophobicContact CG-CD1 3.53Å; P571-Y686 HydrophobicContact CG-CE1 3.85Å; P571-Y686 HydrophobicContact CG-CG 4.34Å
572	D	87.3	Confident	89.5	Confident	106 Å²	106	46.3 Å²	46.3	57%	0.567	25%	0.25	S	C	*	.	H	α-helix	trans	-52.5	-38.6	-176.8	-80.8	-45.2	0	0	0	113.1	I570 A574 V575 Y576	I570-D572 PolarHBondContact O-N 3.38Å; D572-A574 PolarHBondContact O-N 3.02Å; D572-V575 WeakPolarHBondContact O-CB 3.37Å; D572-V575 PolarHBondContact O-N 3.38Å; D572-Y576 HydrophobicContact CB-CD2 4.27Å; D572-Y576 HydrophobicContact CB-CE2 4.14Å; D572-Y576 WeakPolarHBondContact O-CD2 3.13Å; D572-Y576 PolarHBondContact O-N 2.75Å
573	E	86.1	Confident	89.4	Confident	83 Å²	83	46.4 Å²	46.4	39%	0.388	26%	0.258	S	S	.	.	H	α-helix	trans	-62.5	-30.3	179	-62.6	114.5	129	0	0	112.9	P571 N577 K682 Y686	P571-E573 PolarHBondContact O-N 2.98Å; P571-E573 VanDerWaalsContact O-N 3.13Å; E573-N577 VanDerWaalsContact O-CB 3.26Å; E573-N577 WeakPolarHBondContact O-CB 3.13Å; E573-N577 PolarHBondContact O-N 3.49Å; E573-N577 PolarHBondContact O-ND2 3.21Å; E573-K682 IonicContact OE1-NZ 2.83Å; E573-K682 PolarHBondContact OE1-NZ 3.34Å; E573-K682 VanDerWaalsContact OE1-NZ 3.16Å; E573-Y686 HydrophobicContact CB-CE2 4Å; E573-Y686 PolarHBondContact OE1-OH 3.1Å; E573-Y686 PolarHBondContact OE2-OH 2.85Å
574	A	87.5	Confident	89.4	Confident	2 Å²	2	46.5 Å²	46.5	2%	0.017	26%	0.258	C	S	.	.	H	α-helix	trans	-76.3	-31.7	172.6	0	0	0	0	0	112.5	I570 P571 D572 G578 V579 T690	I570-A574 HydrophobicContact CG2-CB 4.45Å; P571-A574 HydrophobicContact CG-CB 3.99Å; P571-A574 WeakPolarHBondContact O-CA 3.48Å; P571-A574 WeakPolarHBondContact O-CB 3.07Å; P571-A574 PolarHBondContact O-N 3.14Å; D572-A574 PolarHBondContact O-N 3.02Å; A574-G578 VanDerWaalsContact O-CA 3.24Å; A574-G578 WeakPolarHBondContact O-CA 3.39Å; A574-G578 PolarHBondContact O-N 3.25Å; A574-V579 HydrophobicContact CB-CG2 3.69Å; A574-T690 HydrophobicContact CB-CG2 3.64Å
575	V	88.4	Confident	89.5	Confident	17 Å²	17	44.9 Å²	44.9	10%	0.103	24%	0.244	C	C	.	.	H	α-helix	trans	-64.2	-50.2	175.6	-177.1	0	0	0	0	111	L546 A547 I550 I570 P571 D572	L546-V575 PolarHBondContact N-O 3.14Å; L546-V575 VanDerWaalsContact N-O 3.16Å; A547-V575 HydrophobicContact CB-CG1 3.85Å; A547-V575 PolarHBondContact N-O 3.26Å; A547-V575 VanDerWaalsContact N-O 3.13Å; I550-V575 HydrophobicContact CD1-CB 4.42Å; I550-V575 HydrophobicContact CD1-CG1 4.16Å; I550-V575 HydrophobicContact CD1-CG2 3.8Å; I570-V575 HydrophobicContact CG2-CG2 3.76Å; P571-V575 PolarHBondContact O-N 3.03Å; D572-V575 WeakPolarHBondContact O-CB 3.37Å; D572-V575 PolarHBondContact O-N 3.38Å
576	Y	87.7	Confident	89.6	Confident	166 Å²	166	43.9 Å²	43.9	65%	0.651	23%	0.228	S	C	*	.	H	α-helix	trans	-83.5	-50.6	-174.5	-65.4	-70.7	0	0	0	113.6	D572	D572-Y576 HydrophobicContact CB-CD2 4.27Å; D572-Y576 HydrophobicContact CB-CE2 4.14Å; D572-Y576 WeakPolarHBondContact O-CD2 3.13Å; D572-Y576 PolarHBondContact O-N 2.75Å
577	N	84.3	Confident	89.6	Confident	101 Å²	101	45.6 Å²	45.6	54%	0.54	24%	0.24	S	C	.	.	H	α-helix	trans	-84.5	-17.6	-175.5	-54.9	-63.1	0	0	0	112.9	R543 E573	R543-N577 WeakPolarHBondContact CB-O 3.48Å; E573-N577 VanDerWaalsContact O-CB 3.26Å; E573-N577 WeakPolarHBondContact O-CB 3.13Å; E573-N577 PolarHBondContact O-N 3.49Å; E573-N577 PolarHBondContact O-ND2 3.21Å
578	G	87.1	Confident	89.7	Confident	2 Å²	2	47.5 Å²	47.5	2%	0.021	25%	0.246	C	C	.	.			trans	75.2	164.7	-170.5	0	0	0	0	0	113.3	R543 K544 A574	R543-G578 PolarHBondContact NE-O 3.2Å; K544-G578 WeakPolarHBondContact O-CA 3.44Å; A574-G578 VanDerWaalsContact O-CA 3.24Å; A574-G578 WeakPolarHBondContact O-CA 3.39Å; A574-G578 PolarHBondContact O-N 3.25Å
579	V	90	Very high	89.9	Confident	8 Å²	8	42.3 Å²	42.3	5%	0.048	22%	0.218	C	C	.	.	B	Isolated β-bridge	trans	-98.6	147.8	-175.3	-176.5	0	0	0	0	109.6	V530 L546 A574 F687 T690	V530-V579 HydrophobicContact CG1-CG1 4.49Å; L546-V579 HydrophobicContact CD1-CG2 3.82Å; A574-V579 HydrophobicContact CB-CG2 3.69Å; V579-F687 VanDerWaalsContact CG1-CA 3.5Å; V579-F687 HydrophobicContact CG1-CB 3.61Å; V579-F687 HydrophobicContact CG1-CD2 3.71Å; V579-F687 HydrophobicContact CG1-CG 4.15Å; V579-T690 HydrophobicContact CG2-CG2 3.85Å
580	Y	90.5	Very high	90	Very high	20 Å²	20	45.6 Å²	45.6	8%	0.078	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-71	136.7	169.8	-76.5	-65.8	0	0	0	110.1	M539 R543 D584 L585 D683 F687	M539-Y580 HydrophobicContact CB-CE1 4.1Å; R543-Y580 HydrophobicContact CG-CD1 3.94Å; R543-Y580 HydrophobicContact CG-CE1 4.05Å; R543-Y580 HydrophobicContact CG-CG 4.5Å; R543-Y580 VanDerWaalsContact CZ-CZ 3.41Å; R543-Y580 PolarHBondContact NH1-OH 2.93Å; Y580-D584 HydrophobicContact CD1-CB 4.05Å; Y580-L585 HydrophobicContact CD2-CD2 4.35Å; Y580-L585 HydrophobicContact CG-CD2 4.44Å; Y580-D683 HydrophobicContact CD2-CB 4.01Å; Y580-D683 HydrophobicContact CE2-CB 4.26Å; Y580-F687 WeakPolarHBondContact O-CD2 3.42Å
581	S	90.9	Very high	90	Very high	4 Å²	4	50.9 Å²	50.9	3%	0.028	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-61.6	159.6	172.1	73.8	0	0	0	0	111.1	L531 V583 D584 L585	L531-S581 WeakPolarHBondContact O-CB 3.4Å; S581-V583 PolarHBondContact O-N 3.45Å; S581-D584 WeakPolarHBondContact O-CB 3.39Å; S581-D584 PolarHBondContact O-N 3.18Å; S581-D584 WeakPolarHBondContact OG-CB 3.49Å; S581-D584 PolarHBondContact OG-N 3.49Å; S581-D584 VanDerWaalsContact OG-N 3.14Å; S581-D584 PolarHBondContact OG-OD2 2.65Å; S581-L585 PolarHBondContact O-N 2.83Å
582	E	90.6	Very high	90.1	Very high	31 Å²	31	50.7 Å²	50.7	15%	0.145	24%	0.243	C	C	.	.	H	α-helix	trans	-56.3	-40.2	177.6	-160.3	-158.7	149.6	0	0	112	L531 D584 L585 K586 D657 F659 F687	L531-E582 HydrophobicContact CD1-CB 4.17Å; L531-E582 VanDerWaalsContact CD1-OE2 3.32Å; L531-E582 WeakPolarHBondContact CD1-OE2 3.33Å; L531-E582 PolarHBondContact O-N 3.43Å; L531-E582 VanDerWaalsContact O-N 3.16Å; E582-D584 VanDerWaalsContact C-N 3.35Å; E582-L585 PolarHBondContact O-N 3.33Å; E582-K586 WeakPolarHBondContact O-CG 3.33Å; E582-K586 PolarHBondContact O-N 2.96Å; E582-K586 WeakPolarHBondContact OE1-CE 3.46Å; E582-K586 IonicContact OE1-NZ 3.29Å; E582-K586 PolarHBondContact OE1-NZ 3.05Å; E582-D657 WeakPolarHBondContact OE1-CB 3.48Å; E582-D657 VanDerWaalsContact OE1-CG 3.28Å; E582-F659 HydrophobicContact CG-CD2 4.47Å; E582-F659 HydrophobicContact CG-CE2 3.34Å; E582-F659 HydrophobicContact CG-CZ 3.56Å; E582-F687 HydrophobicContact CB-CE2 4.42Å; E582-F687 HydrophobicContact CB-CZ 4.01Å; E582-F687 HydrophobicContact CG-CZ 4.12Å
583	V	90.2	Very high	90.3	Very high	93 Å²	93	45.8 Å²	45.8	56%	0.564	22%	0.217	S	C	*	.	H	α-helix	trans	-67	-36.1	177.7	-176.5	0	0	0	0	111.4	S581 T587	S581-V583 PolarHBondContact O-N 3.45Å; V583-T587 WeakPolarHBondContact O-CB 3.36Å; V583-T587 PolarHBondContact O-N 3.04Å; V583-T587 PolarHBondContact O-OG1 3.03Å
584	D	91.8	Very high	90.4	Very high	2 Å²	2	50.6 Å²	50.6	1%	0.011	23%	0.232	C	C	.	.	H	α-helix	trans	-70.4	-40.8	175.7	-68.9	-44.5	0	0	0	111.7	R542 Y580 S581 E582 T587 R588	R542-D584 IonicContact CZ-OD1 3.92Å; R542-D584 IonicContact NE-OD1 2.74Å; R542-D584 PolarHBondContact NE-OD1 3.44Å; R542-D584 IonicContact NE-OD2 2.83Å; R542-D584 PolarHBondContact NE-OD2 3.18Å; R542-D584 IonicContact NH2-OD1 2.65Å; R542-D584 PolarHBondContact NH2-OD1 2.92Å; Y580-D584 HydrophobicContact CD1-CB 4.05Å; S581-D584 WeakPolarHBondContact O-CB 3.39Å; S581-D584 PolarHBondContact O-N 3.18Å; S581-D584 WeakPolarHBondContact OG-CB 3.49Å; S581-D584 PolarHBondContact OG-N 3.49Å; S581-D584 VanDerWaalsContact OG-N 3.14Å; S581-D584 PolarHBondContact OG-OD2 2.65Å; E582-D584 VanDerWaalsContact C-N 3.35Å; D584-T587 PolarHBondContact O-N 2.98Å; D584-R588 WeakPolarHBondContact O-CB 3.08Å; D584-R588 PolarHBondContact O-N 3.47Å
585	L	92.7	Very high	90.4	Very high	0 Å²	0	54 Å²	54	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-62.1	-43.9	174.6	-70.9	174.7	0	0	0	111.8	Y580 S581 E582 T587 R588 F589 F659 W680 T684 F687	Y580-L585 HydrophobicContact CD2-CD2 4.35Å; Y580-L585 HydrophobicContact CG-CD2 4.44Å; S581-L585 PolarHBondContact O-N 2.83Å; E582-L585 PolarHBondContact O-N 3.33Å; L585-T587 VanDerWaalsContact C-N 3.34Å; L585-T587 PolarHBondContact O-N 2.99Å; L585-R588 PolarHBondContact O-N 3.22Å; L585-F589 VanDerWaalsContact O-CB 3.3Å; L585-F589 WeakPolarHBondContact O-CB 3.38Å; L585-F589 PolarHBondContact O-N 3.13Å; L585-F659 HydrophobicContact CB-CE1 3.76Å; L585-F659 HydrophobicContact CB-CZ 4.34Å; L585-F659 HydrophobicContact CD1-CE1 4.36Å; L585-W680 PolarHBondContact O-NE1 2.67Å; L585-T684 HydrophobicContact CD1-CG2 4.47Å; L585-F687 HydrophobicContact CD1-CB 3.58Å; L585-F687 HydrophobicContact CD1-CD1 3.64Å; L585-F687 HydrophobicContact CD1-CD2 4.05Å; L585-F687 HydrophobicContact CD1-CE1 4.32Å; L585-F687 HydrophobicContact CD1-CG 3.48Å; L585-F687 VanDerWaalsContact CD1-CG 3.48Å
586	K	93.2	Very high	90.4	Very high	42 Å²	42	53.1 Å²	53.1	18%	0.183	25%	0.247	C	C	.	.	H	α-helix	trans	-60.5	-42	172	-69.4	172.8	-171.2	173.9	0	112	E582 F589 K590 V654 D657 F659	E582-K586 WeakPolarHBondContact O-CG 3.33Å; E582-K586 PolarHBondContact O-N 2.96Å; E582-K586 WeakPolarHBondContact OE1-CE 3.46Å; E582-K586 IonicContact OE1-NZ 3.29Å; E582-K586 PolarHBondContact OE1-NZ 3.05Å; K586-F589 PolarHBondContact O-N 2.85Å; K586-K590 WeakPolarHBondContact O-CG 3.45Å; K586-K590 PolarHBondContact O-N 3.18Å; K586-V654 HydrophobicContact CB-CG1 4.34Å; K586-V654 HydrophobicContact CG-CG1 3.87Å; K586-D657 WeakPolarHBondContact CE-OD1 3.49Å; K586-D657 IonicContact NZ-OD1 3.21Å; K586-D657 PolarHBondContact NZ-OD1 2.74Å; K586-D657 IonicContact NZ-OD2 2.95Å; K586-D657 PolarHBondContact NZ-OD2 3.11Å; K586-F659 HydrophobicContact CD-CZ 4.5Å; K586-F659 HydrophobicContact CG-CE1 4.37Å; K586-F659 HydrophobicContact CG-CZ 3.9Å
587	T	91.9	Very high	90.3	Very high	53 Å²	53	47 Å²	47	33%	0.325	22%	0.223	S	C	.	.	H	α-helix	trans	-68.5	-41.1	-179.4	-61.6	0	0	0	0	111.9	M539 V583 D584 L585 K590 K591	M539-T587 HydrophobicContact SD-CG2 4.29Å; V583-T587 WeakPolarHBondContact O-CB 3.36Å; V583-T587 PolarHBondContact O-N 3.04Å; V583-T587 PolarHBondContact O-OG1 3.03Å; D584-T587 PolarHBondContact O-N 2.98Å; L585-T587 VanDerWaalsContact C-N 3.34Å; L585-T587 PolarHBondContact O-N 2.99Å; T587-K590 PolarHBondContact O-N 3.22Å; T587-K591 PolarHBondContact O-N 3.05Å
588	R	92.2	Very high	90.2	Very high	51 Å²	51	47.1 Å²	47.1	19%	0.192	22%	0.218	C	C	.	.	H	α-helix	trans	-68.6	-40.7	174.1	-176.3	172.7	169.2	-163.3	-2.5	111.6	D584 L585 K590 K591 L592 A679 D683	D584-R588 WeakPolarHBondContact O-CB 3.08Å; D584-R588 PolarHBondContact O-N 3.47Å; L585-R588 PolarHBondContact O-N 3.22Å; R588-K590 VanDerWaalsContact C-N 3.34Å; R588-K590 PolarHBondContact O-N 3.23Å; R588-K591 WeakPolarHBondContact O-CB 3.34Å; R588-K591 PolarHBondContact O-N 3.03Å; R588-K591 VanDerWaalsContact O-N 3.08Å; R588-L592 WeakPolarHBondContact O-CB 3.34Å; R588-L592 PolarHBondContact O-N 3.24Å; R588-A679 VanDerWaalsContact NH2-C 3.35Å; R588-A679 PolarHBondContact NH2-O 3.03Å; R588-D683 IonicContact CZ-OD2 3.13Å; R588-D683 VanDerWaalsContact NH1-CG 3.27Å; R588-D683 IonicContact NH1-OD2 2.68Å; R588-D683 PolarHBondContact NH1-OD2 2.68Å; R588-D683 IonicContact NH2-OD2 3.35Å; R588-D683 PolarHBondContact NH2-OD2 3.16Å
589	F	94.1	Very high	89.9	Confident	3 Å²	3	48 Å²	48	1%	0.013	22%	0.223	C	C	.	.	H	α-helix	trans	-59.2	-43.4	174.3	-175.3	-88.3	0	0	0	111.7	L585 K586 K591 L592 D593 L647 A650 K651 V654 M666 W680	L585-F589 VanDerWaalsContact O-CB 3.3Å; L585-F589 WeakPolarHBondContact O-CB 3.38Å; L585-F589 PolarHBondContact O-N 3.13Å; K586-F589 PolarHBondContact O-N 2.85Å; F589-K591 PolarHBondContact O-N 2.97Å; F589-L592 HydrophobicContact CD2-CD2 4.44Å; F589-L592 CarbonylContact O-C 3.58Å; F589-L592 WeakPolarHBondContact O-CB 3.42Å; F589-L592 PolarHBondContact O-N 2.87Å; F589-L592 VanDerWaalsContact O-N 3.09Å; F589-D593 HydrophobicContact CD1-CB 4.39Å; F589-D593 HydrophobicContact CE1-CB 3.96Å; F589-D593 HydrophobicContact CZ-CB 4.47Å; F589-D593 WeakPolarHBondContact O-CB 3.16Å; F589-D593 PolarHBondContact O-N 3.49Å; F589-L647 HydrophobicContact CZ-CD1 4.12Å; F589-A650 HydrophobicContact CE2-CB 4.31Å; F589-A650 HydrophobicContact CZ-CB 3.98Å; F589-K651 VanDerWaalsContact CE1-CA 3.47Å; F589-K651 HydrophobicContact CE1-CB 3.76Å; F589-K651 HydrophobicContact CE1-CG 4.19Å; F589-K651 HydrophobicContact CZ-CB 4.29Å; F589-V654 HydrophobicContact CB-CG1 3.92Å; F589-V654 HydrophobicContact CD1-CB 4.09Å; F589-V654 HydrophobicContact CD1-CG1 3.99Å; F589-V654 HydrophobicContact CD1-CG2 4.17Å; F589-V654 HydrophobicContact CD2-CG2 3.89Å; F589-V654 HydrophobicContact CE1-CB 4.45Å; F589-V654 HydrophobicContact CE1-CG2 4.4Å; F589-V654 HydrophobicContact CE2-CG2 4.09Å; F589-V654 HydrophobicContact CG-CB 4.22Å; F589-V654 HydrophobicContact CG-CG1 3.91Å; F589-V654 HydrophobicContact CG-CG2 3.92Å; F589-V654 HydrophobicContact CZ-CG2 4.35Å; F589-M666 HydrophobicContact CE2-CE 4.08Å; F589-M666 HydrophobicContact CE2-CG 4.15Å; F589-M666 HydrophobicContact CE2-SD 3.8Å; F589-M666 HydrophobicContact CZ-SD 4.28Å; F589-W680 HydrophobicContact CB-CZ2 4.06Å; F589-W680 HydrophobicContact CD2-CD2 4.08Å; F589-W680 AromaticContact CD2-CE2 3.69Å; F589-W680 HydrophobicContact CD2-CE3 4.25Å; F589-W680 AromaticContact CD2-CH2 3.75Å; F589-W680 HydrophobicContact CD2-CH2 3.75Å; F589-W680 AromaticContact CD2-CZ2 3.52Å; F589-W680 HydrophobicContact CD2-CZ2 3.52Å; F589-W680 HydrophobicContact CD2-CZ3 4.11Å; F589-W680 HydrophobicContact CE2-CH2 4.2Å; F589-W680 HydrophobicContact CE2-CZ2 4.4Å; F589-W680 HydrophobicContact CE2-CZ3 4.37Å; F589-W680 HydrophobicContact CG-CZ2 4.13Å
590	K	92.1	Very high	89.4	Confident	138 Å²	138	47.7 Å²	47.7	60%	0.6	22%	0.221	S	C	*	.	H	α-helix	trans	-60	-29.7	174.9	-74	170.9	-177.2	175.1	0	113.6	K586 T587 R588 R594	K586-K590 WeakPolarHBondContact O-CG 3.45Å; K586-K590 PolarHBondContact O-N 3.18Å; T587-K590 PolarHBondContact O-N 3.22Å; R588-K590 VanDerWaalsContact C-N 3.34Å; R588-K590 PolarHBondContact O-N 3.23Å; K590-R594 WeakPolarHBondContact O-CG 3.34Å
591	K	91.3	Very high	88.6	Confident	122 Å²	122	48 Å²	48	53%	0.53	22%	0.224	S	C	.	.	H	α-helix	trans	-76.4	-44.8	171.9	-66.3	178.8	179.9	-179	0	110.8	T587 R588 F589 R594 V595	T587-K591 PolarHBondContact O-N 3.05Å; R588-K591 WeakPolarHBondContact O-CB 3.34Å; R588-K591 PolarHBondContact O-N 3.03Å; R588-K591 VanDerWaalsContact O-N 3.08Å; F589-K591 PolarHBondContact O-N 2.97Å; K591-R594 PolarHBondContact O-N 3.44Å; K591-V595 WeakPolarHBondContact O-CG2 3.33Å; K591-V595 PolarHBondContact O-N 3.16Å
592	L	93	Very high	87.5	Confident	20 Å²	20	49.7 Å²	49.7	11%	0.105	23%	0.232	C	C	.	.	H	α-helix	trans	-59	-52	177.8	-179.1	68.2	0	0	0	112	R588 F589 R594 V595 C596 M666 L676 A677 W680	R588-L592 WeakPolarHBondContact O-CB 3.34Å; R588-L592 PolarHBondContact O-N 3.24Å; F589-L592 HydrophobicContact CD2-CD2 4.44Å; F589-L592 CarbonylContact O-C 3.58Å; F589-L592 WeakPolarHBondContact O-CB 3.42Å; F589-L592 PolarHBondContact O-N 2.87Å; F589-L592 VanDerWaalsContact O-N 3.09Å; L592-R594 PolarHBondContact O-N 3.47Å; L592-V595 CarbonylContact O-C 3.58Å; L592-V595 WeakPolarHBondContact O-CA 3.44Å; L592-V595 PolarHBondContact O-N 3.49Å; L592-C596 WeakPolarHBondContact CD1-SG 3.37Å; L592-C596 WeakPolarHBondContact O-CB 3.34Å; L592-C596 PolarHBondContact O-N 3.42Å; L592-C596 PolarHBondContact O-SG 2.99Å; L592-M666 HydrophobicContact CD2-CE 3.82Å; L592-L676 HydrophobicContact CD1-CB 4.13Å; L592-A677 HydrophobicContact CD2-CB 4.48Å; L592-W680 HydrophobicContact CD2-CB 3.62Å; L592-W680 HydrophobicContact CD2-CD2 4.08Å; L592-W680 HydrophobicContact CD2-CE3 4.3Å; L592-W680 HydrophobicContact CD2-CG 3.79Å
593	D	90.4	Very high	86.6	Confident	4 Å²	4	52.3 Å²	52.3	2%	0.021	24%	0.244	C	C	.	.	H	α-helix	trans	-48.2	-44.9	176.2	171	64.3	0	0	0	112.1	F589 V595 R597 L647 K651	F589-D593 HydrophobicContact CD1-CB 4.39Å; F589-D593 HydrophobicContact CE1-CB 3.96Å; F589-D593 HydrophobicContact CZ-CB 4.47Å; F589-D593 WeakPolarHBondContact O-CB 3.16Å; F589-D593 PolarHBondContact O-N 3.49Å; D593-V595 PolarHBondContact O-N 3.13Å; D593-R597 WeakPolarHBondContact O-CB 3.4Å; D593-R597 VanDerWaalsContact O-CG 3.25Å; D593-R597 WeakPolarHBondContact O-CG 3.37Å; D593-R597 PolarHBondContact O-N 2.94Å; D593-R597 IonicContact OD1-CZ 3.68Å; D593-R597 VanDerWaalsContact OD1-CZ 3.3Å; D593-R597 IonicContact OD1-NE 3.54Å; D593-R597 PolarHBondContact OD1-NE 2.93Å; D593-R597 IonicContact OD1-NH2 3.03Å; D593-R597 PolarHBondContact OD1-NH2 3.19Å; D593-R597 IonicContact OD2-NE 2.61Å; D593-R597 PolarHBondContact OD2-NE 3.43Å; D593-L647 WeakPolarHBondContact OD1-CG 3.34Å; D593-K651 IonicContact OD1-NZ 3.07Å; D593-K651 WeakPolarHBondContact OD2-CD 3.35Å; D593-K651 VanDerWaalsContact OD2-CE 3.23Å; D593-K651 WeakPolarHBondContact OD2-CE 3.34Å; D593-K651 IonicContact OD2-NZ 2.67Å; D593-K651 PolarHBondContact OD2-NZ 2.76Å
594	R	88.2	Confident	85.5	Confident	184 Å²	184	52.3 Å²	52.3	69%	0.694	24%	0.238	S	C	*	.	H	α-helix	trans	-67.1	-32.5	177	-69.4	174.8	176.1	-174.1	-1.6	114	K590 K591 L592 K598	K590-R594 WeakPolarHBondContact O-CG 3.34Å; K591-R594 PolarHBondContact O-N 3.44Å; L592-R594 PolarHBondContact O-N 3.47Å; R594-K598 WeakPolarHBondContact O-CG 3.45Å
595	V	88.7	Confident	84	Confident	72 Å²	72	54.1 Å²	54.1	44%	0.436	25%	0.253	S	S	.	.	H	α-helix	trans	-81.5	-44.7	177.3	-175.2	0	0	0	0	110	K591 L592 D593 R597 K598 T599 L676	K591-V595 WeakPolarHBondContact O-CG2 3.33Å; K591-V595 PolarHBondContact O-N 3.16Å; L592-V595 CarbonylContact O-C 3.58Å; L592-V595 WeakPolarHBondContact O-CA 3.44Å; L592-V595 PolarHBondContact O-N 3.49Å; D593-V595 PolarHBondContact O-N 3.13Å; V595-R597 PolarHBondContact O-N 3.23Å; V595-K598 WeakPolarHBondContact O-CB 3.36Å; V595-K598 PolarHBondContact O-N 3.26Å; V595-K598 VanDerWaalsContact O-N 3.12Å; V595-T599 PolarHBondContact O-N 2.89Å; V595-T599 PolarHBondContact O-OG1 2.92Å; V595-L676 HydrophobicContact CG1-CD1 3.66Å
596	C	88.1	Confident	82.3	Confident	0 Å²	0	57 Å²	57	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-59.6	-42.7	176.9	-70.9	0	0	0	0	112.3	L592 K598 T599 V600 L647 P673	L592-C596 WeakPolarHBondContact CD1-SG 3.37Å; L592-C596 WeakPolarHBondContact O-CB 3.34Å; L592-C596 PolarHBondContact O-N 3.42Å; L592-C596 PolarHBondContact O-SG 2.99Å; C596-K598 VanDerWaalsContact C-N 3.33Å; C596-K598 PolarHBondContact O-N 3.1Å; C596-T599 WeakPolarHBondContact CA-OG1 3.27Å; C596-T599 PolarHBondContact O-N 3.31Å; C596-T599 PolarHBondContact O-OG1 2.88Å; C596-V600 VanDerWaalsContact O-CG2 3.31Å; C596-V600 WeakPolarHBondContact O-CG2 3.16Å; C596-V600 PolarHBondContact O-N 2.95Å; C596-L647 HydrophobicContact CB-CD1 4.45Å; C596-L647 HydrophobicContact CB-CD2 3.68Å; C596-P673 HydrophobicContact CB-CB 4.35Å
597	R	85.6	Confident	80.7	Confident	37 Å²	37	58.1 Å²	58.1	14%	0.14	31%	0.306	C	S	.	.	H	α-helix	trans	-56.5	-46.3	172.6	-76.5	175.3	-166.3	-79.2	-29	111.7	D593 V595 V600 I601 D624 L644 L647	D593-R597 WeakPolarHBondContact O-CB 3.4Å; D593-R597 VanDerWaalsContact O-CG 3.25Å; D593-R597 WeakPolarHBondContact O-CG 3.37Å; D593-R597 PolarHBondContact O-N 2.94Å; D593-R597 IonicContact OD1-CZ 3.68Å; D593-R597 VanDerWaalsContact OD1-CZ 3.3Å; D593-R597 IonicContact OD1-NE 3.54Å; D593-R597 PolarHBondContact OD1-NE 2.93Å; D593-R597 IonicContact OD1-NH2 3.03Å; D593-R597 PolarHBondContact OD1-NH2 3.19Å; D593-R597 IonicContact OD2-NE 2.61Å; D593-R597 PolarHBondContact OD2-NE 3.43Å; V595-R597 PolarHBondContact O-N 3.23Å; R597-V600 PolarHBondContact O-N 2.88Å; R597-I601 WeakPolarHBondContact O-CD1 3.15Å; R597-I601 WeakPolarHBondContact O-CG1 3.4Å; R597-I601 PolarHBondContact O-N 2.72Å; R597-D624 IonicContact NE-OD1 3.16Å; R597-D624 IonicContact NH1-OD1 3.97Å; R597-L644 HydrophobicContact CG-CD2 4.3Å; R597-L647 HydrophobicContact CG-CD2 3.62Å
598	K	81.3	Confident	79.5	Confident	104 Å²	104	57.3 Å²	57.3	45%	0.452	31%	0.309	S	S	.	.	H	α-helix	trans	-61.3	-47.2	176.3	-69.5	177.3	178.3	-162.5	0	111.2	R594 V595 C596 V600 I601 M602	R594-K598 WeakPolarHBondContact O-CG 3.45Å; V595-K598 WeakPolarHBondContact O-CB 3.36Å; V595-K598 PolarHBondContact O-N 3.26Å; V595-K598 VanDerWaalsContact O-N 3.12Å; C596-K598 VanDerWaalsContact C-N 3.33Å; C596-K598 PolarHBondContact O-N 3.1Å; K598-V600 PolarHBondContact O-N 3.27Å; K598-I601 PolarHBondContact O-N 3.46Å; K598-M602 HydrophobicContact CB-SD 4.36Å; K598-M602 WeakPolarHBondContact O-CG 3.23Å; K598-M602 PolarHBondContact O-N 3.23Å; K598-M602 VanDerWaalsContact O-SD 3.4Å
599	T	81.9	Confident	78.6	Confident	20 Å²	20	61.5 Å²	61.5	12%	0.123	33%	0.333	C	S	.	.	H	α-helix	trans	-68.4	-31.7	-179	53.8	0	0	0	0	114.1	V595 C596 M602 E603 L676	V595-T599 PolarHBondContact O-N 2.89Å; V595-T599 PolarHBondContact O-OG1 2.92Å; C596-T599 WeakPolarHBondContact CA-OG1 3.27Å; C596-T599 PolarHBondContact O-N 3.31Å; C596-T599 PolarHBondContact O-OG1 2.88Å; T599-M602 HydrophobicContact CG2-SD 4.31Å; T599-M602 PolarHBondContact O-N 3.23Å; T599-E603 WeakPolarHBondContact O-CB 3.37Å; T599-E603 PolarHBondContact O-N 3.22Å; T599-L676 HydrophobicContact CG2-CD1 3.63Å
600	V	79.8	Confident	77.4	Confident	1 Å²	1	68.6 Å²	68.6	1%	0.006	37%	0.371	C	S	.	.	H	α-helix	trans	-62.6	-48.5	172.9	170.4	0	0	0	0	110	C596 R597 K598 M602 E603 E604 K643 L644 P673	C596-V600 VanDerWaalsContact O-CG2 3.31Å; C596-V600 WeakPolarHBondContact O-CG2 3.16Å; C596-V600 PolarHBondContact O-N 2.95Å; R597-V600 PolarHBondContact O-N 2.88Å; K598-V600 PolarHBondContact O-N 3.27Å; V600-M602 VanDerWaalsContact C-N 3.27Å; V600-M602 PolarHBondContact O-N 3.05Å; V600-E603 WeakPolarHBondContact O-CB 3.3Å; V600-E603 PolarHBondContact O-N 2.9Å; V600-E603 VanDerWaalsContact O-N 3.16Å; V600-E604 PolarHBondContact O-N 2.96Å; V600-E604 VanDerWaalsContact O-N 3.11Å; V600-K643 HydrophobicContact CG1-CB 4.01Å; V600-K643 HydrophobicContact CG1-CD 4.39Å; V600-K643 HydrophobicContact CG2-CB 4.17Å; V600-K643 HydrophobicContact CG2-CD 4.33Å; V600-L644 HydrophobicContact CB-CD2 4.03Å; V600-L644 HydrophobicContact CG1-CD2 3.78Å; V600-L644 HydrophobicContact CG1-CG 3.91Å; V600-P673 HydrophobicContact CG2-CB 3.98Å; V600-P673 HydrophobicContact CG2-CG 3.83Å
601	I	72.3	Confident	76.2	Confident	26 Å²	26	62.8 Å²	62.8	13%	0.133	35%	0.35	C	S	.	.	H	α-helix	trans	-62.4	-34.8	176.3	-60.9	164.1	0	0	0	111.2	R597 K598 A605 W618	R597-I601 WeakPolarHBondContact O-CD1 3.15Å; R597-I601 WeakPolarHBondContact O-CG1 3.4Å; R597-I601 PolarHBondContact O-N 2.72Å; K598-I601 PolarHBondContact O-N 3.46Å; I601-A605 VanDerWaalsContact O-CB 3.24Å; I601-A605 WeakPolarHBondContact O-CB 3.32Å; I601-A605 PolarHBondContact O-N 3.08Å; I601-W618 HydrophobicContact CG2-CE3 4.3Å
602	M	68.6	Low	74.9	Confident	41 Å²	41	62.8 Å²	62.8	20%	0.202	35%	0.347	C	S	.	.	H	α-helix	trans	-70.9	-31.4	176.5	-67.3	158.2	61.7	0	0	113.4	K598 T599 V600 Y612 S615	K598-M602 HydrophobicContact CB-SD 4.36Å; K598-M602 WeakPolarHBondContact O-CG 3.23Å; K598-M602 PolarHBondContact O-N 3.23Å; K598-M602 VanDerWaalsContact O-SD 3.4Å; T599-M602 HydrophobicContact CG2-SD 4.31Å; T599-M602 PolarHBondContact O-N 3.23Å; V600-M602 VanDerWaalsContact C-N 3.27Å; V600-M602 PolarHBondContact O-N 3.05Å; M602-Y612 HydrophobicContact CE-CD1 3.66Å; M602-Y612 HydrophobicContact CE-CE1 3.19Å; M602-Y612 HydrophobicContact CE-CE2 4.22Å; M602-Y612 HydrophobicContact CE-CG 4.34Å; M602-Y612 VanDerWaalsContact CE-CZ 3.5Å; M602-S615 WeakPolarHBondContact CG-OG 3.41Å
603	E	71.8	Confident	73.9	Confident	86 Å²	86	70 Å²	70	40%	0.402	37%	0.373	S	S	.	.	H	α-helix	trans	-69.4	-43.2	174.9	-165.3	-179.5	177.5	0	0	110.3	T599 V600 G606 K643	T599-E603 WeakPolarHBondContact O-CB 3.37Å; T599-E603 PolarHBondContact O-N 3.22Å; V600-E603 WeakPolarHBondContact O-CB 3.3Å; V600-E603 PolarHBondContact O-N 2.9Å; V600-E603 VanDerWaalsContact O-N 3.16Å; E603-G606 PolarHBondContact O-N 3.36Å; E603-K643 IonicContact OE1-NZ 3.68Å; E603-K643 PolarHBondContact OE1-NZ 3.43Å; E603-K643 IonicContact OE2-NZ 3.88Å; E603-K643 PolarHBondContact OE2-NZ 2.95Å
604	E	66.7	Low	72.9	Confident	92 Å²	92	72.5 Å²	72.5	43%	0.43	39%	0.394	S	S	.	.	H	α-helix	trans	-66.5	-34.4	173.4	-66.4	179.6	152.8	0	0	112.9	V600 G606 S640	V600-E604 PolarHBondContact O-N 2.96Å; V600-E604 VanDerWaalsContact O-N 3.11Å; E604-G606 PolarHBondContact O-N 3.23Å; E604-G606 VanDerWaalsContact O-N 3.08Å; E604-S640 WeakPolarHBondContact OE1-CB 3.34Å; E604-S640 PolarHBondContact OE1-OG 2.84Å
605	A	59.1	Low	71.7	Confident	40 Å²	40	64 Å²	64	33%	0.331	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	8.5	179.1	0	0	0	0	0	114.9	I601	I601-A605 VanDerWaalsContact O-CB 3.24Å; I601-A605 WeakPolarHBondContact O-CB 3.32Å; I601-A605 PolarHBondContact O-N 3.08Å
606	G	58.3	Low	70.6	Confident	60 Å²	60	64.9 Å²	64.9	62%	0.619	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.6	46.1	163.4	0	0	0	0	0	115.7	E603 E604 G608	E603-G606 PolarHBondContact O-N 3.36Å; E604-G606 PolarHBondContact O-N 3.23Å; E604-G606 VanDerWaalsContact O-N 3.08Å; G606-G608 PolarHBondContact O-N 3.49Å
607	G	59.3	Low	69.9	Low	66 Å²	66	70.6 Å²	70.6	68%	0.68	40%	0.395	S	S	*	.	S	Bend	trans	64.8	-15.8	155.2	0	0	0	0	0	119.7
608	G	67.7	Low	69.1	Low	36 Å²	36	75.9 Å²	75.9	37%	0.371	42%	0.415	S	S	.	.	S	Bend	trans	-86	155.9	-177.3	0	0	0	0	0	113.6	G606 L610 G611 Y612	G606-G608 PolarHBondContact O-N 3.49Å; G608-L610 PolarHBondContact O-N 3.02Å; G608-G611 CarbonylContact O-C 3.54Å; G608-G611 WeakPolarHBondContact O-CA 3.43Å; G608-G611 PolarHBondContact O-N 3.43Å; G608-Y612 PolarHBondContact O-N 3.46Å
609	I	72.7	Confident	68.3	Low	139 Å²	139	72.3 Å²	72.3	71%	0.713	40%	0.403	S	S	*	.	H	α-helix	trans	-58.9	-33.4	178.5	-59.4	163.9	0	0	0	111.7	Y612 W613	I609-Y612 WeakPolarHBondContact O-CB 3.37Å; I609-Y612 PolarHBondContact O-N 3.47Å; I609-W613 PolarHBondContact O-N 2.83Å; I609-W613 VanDerWaalsContact O-N 3.14Å
610	L	67.8	Low	67.7	Low	153 Å²	153	79.5 Å²	79.5	80%	0.801	44%	0.437	S	S	*	.	H	α-helix	trans	-69.2	-35.8	172.6	-75.4	161.6	0	0	0	112.3	G608 Y612 W613 A614	G608-L610 PolarHBondContact O-N 3.02Å; L610-Y612 VanDerWaalsContact C-N 3.35Å; L610-W613 PolarHBondContact O-N 3.25Å; L610-A614 WeakPolarHBondContact O-CB 3.42Å; L610-A614 PolarHBondContact O-N 2.91Å
611	G	67.6	Low	67.2	Low	15 Å²	15	87.3 Å²	87.3	16%	0.155	47%	0.472	C	S	.	.	H	α-helix	trans	-64.9	-36.8	170.9	0	0	0	0	0	112.3	G608 A614 S615	G608-G611 CarbonylContact O-C 3.54Å; G608-G611 WeakPolarHBondContact O-CA 3.43Å; G608-G611 PolarHBondContact O-N 3.43Å; G611-A614 PolarHBondContact O-N 2.8Å; G611-S615 VanDerWaalsContact O-CB 3.28Å; G611-S615 WeakPolarHBondContact O-CB 3.4Å; G611-S615 PolarHBondContact O-N 2.88Å; G611-S615 PolarHBondContact O-OG 3.28Å
612	Y	64.5	Low	66.5	Low	122 Å²	122	90.8 Å²	90.8	48%	0.478	49%	0.488	S	S	.	.	H	α-helix	trans	-59.2	-44	170	-92.8	-112.6	0	0	0	112.2	M602 G608 I609 L610 S615 L616	M602-Y612 HydrophobicContact CE-CD1 3.66Å; M602-Y612 HydrophobicContact CE-CE1 3.19Å; M602-Y612 HydrophobicContact CE-CE2 4.22Å; M602-Y612 HydrophobicContact CE-CG 4.34Å; M602-Y612 VanDerWaalsContact CE-CZ 3.5Å; G608-Y612 PolarHBondContact O-N 3.46Å; I609-Y612 WeakPolarHBondContact O-CB 3.37Å; I609-Y612 PolarHBondContact O-N 3.47Å; L610-Y612 VanDerWaalsContact C-N 3.35Å; Y612-S615 PolarHBondContact O-OG 3.29Å; Y612-L616 WeakPolarHBondContact O-CB 3.35Å; Y612-L616 WeakPolarHBondContact O-CD1 3.4Å; Y612-L616 VanDerWaalsContact O-CG 3.28Å; Y612-L616 WeakPolarHBondContact O-CG 3.25Å; Y612-L616 PolarHBondContact O-N 3.26Å
613	W	71.5	Confident	66.1	Low	172 Å²	172	97.6 Å²	97.6	65%	0.652	52%	0.517	S	S	*	.	H	α-helix	trans	-70.8	-42.3	177	-85.5	97.6	0	0	0	113.1	I609 L610 L616 L617	I609-W613 PolarHBondContact O-N 2.83Å; I609-W613 VanDerWaalsContact O-N 3.14Å; L610-W613 PolarHBondContact O-N 3.25Å; W613-L616 PolarHBondContact O-N 3.03Å; W613-L617 PolarHBondContact O-N 3.39Å
614	A	68.8	Low	65.3	Low	56 Å²	56	98 Å²	98	46%	0.463	52%	0.523	S	S	.	.	H	α-helix	trans	-63.6	-45.8	177.1	0	0	0	0	0	111.6	L610 G611 L616 L617 W618	L610-A614 WeakPolarHBondContact O-CB 3.42Å; L610-A614 PolarHBondContact O-N 2.91Å; G611-A614 PolarHBondContact O-N 2.8Å; A614-L616 PolarHBondContact O-N 3.14Å; A614-L617 PolarHBondContact O-N 2.83Å; A614-W618 WeakPolarHBondContact O-CB 3.49Å; A614-W618 PolarHBondContact O-N 2.84Å
615	S	63.5	Low	64.7	Low	7 Å²	7	98.3 Å²	98.3	5%	0.049	53%	0.532	C	S	.	.	H	α-helix	trans	-66.1	-34.6	176	54.7	0	0	0	0	112.8	M602 G611 Y612 W618 S619	M602-S615 WeakPolarHBondContact CG-OG 3.41Å; G611-S615 VanDerWaalsContact O-CB 3.28Å; G611-S615 WeakPolarHBondContact O-CB 3.4Å; G611-S615 PolarHBondContact O-N 2.88Å; G611-S615 PolarHBondContact O-OG 3.28Å; Y612-S615 PolarHBondContact O-OG 3.29Å; S615-W618 PolarHBondContact O-N 2.99Å; S615-S619 WeakPolarHBondContact O-CB 3.41Å; S615-S619 PolarHBondContact O-N 3.14Å; S615-S619 PolarHBondContact O-OG 3.25Å
616	L	66.4	Low	64.4	Low	89 Å²	89	107.9 Å²	107.9	47%	0.466	56%	0.56	S	S	.	*	H	α-helix	trans	-59.3	-50.2	170.4	-83.4	166.2	0	0	0	111.9	Y612 W613 A614 S619 M620	Y612-L616 WeakPolarHBondContact O-CB 3.35Å; Y612-L616 WeakPolarHBondContact O-CD1 3.4Å; Y612-L616 VanDerWaalsContact O-CG 3.28Å; Y612-L616 WeakPolarHBondContact O-CG 3.25Å; Y612-L616 PolarHBondContact O-N 3.26Å; W613-L616 PolarHBondContact O-N 3.03Å; A614-L616 PolarHBondContact O-N 3.14Å; L616-S619 PolarHBondContact O-N 2.75Å; L616-S619 PolarHBondContact O-OG 3.32Å; L616-M620 PolarHBondContact O-N 2.89Å
617	L	73.5	Confident	64.2	Low	120 Å²	120	112 Å²	112	63%	0.628	56%	0.563	S	S	*	*	H	α-helix	trans	-61.9	-45.7	176.7	-83.9	161.6	0	0	0	112.3	W613 A614 S619 M620 F621	W613-L617 PolarHBondContact O-N 3.39Å; A614-L617 PolarHBondContact O-N 2.83Å; L617-S619 PolarHBondContact O-N 3.08Å; L617-M620 WeakPolarHBondContact O-CB 3.31Å; L617-M620 PolarHBondContact O-N 2.9Å; L617-M620 VanDerWaalsContact O-N 3.17Å; L617-F621 PolarHBondContact O-N 2.95Å
618	W	68.7	Low	63.9	Low	148 Å²	148	120 Å²	120	56%	0.561	57%	0.573	S	S	*	*	H	α-helix	trans	-64.5	-40.9	179.3	-143.5	65.4	0	0	0	111.5	I601 A614 S615 M620 F621 M622	I601-W618 HydrophobicContact CG2-CE3 4.3Å; A614-W618 WeakPolarHBondContact O-CB 3.49Å; A614-W618 PolarHBondContact O-N 2.84Å; S615-W618 PolarHBondContact O-N 2.99Å; W618-M620 PolarHBondContact O-N 3.14Å; W618-F621 PolarHBondContact O-N 3.3Å; W618-M622 HydrophobicContact CD2-CE 4.29Å; W618-M622 HydrophobicContact CD2-SD 3.74Å; W618-M622 HydrophobicContact CE3-CE 4.07Å; W618-M622 HydrophobicContact CE3-CG 4.4Å; W618-M622 HydrophobicContact CE3-SD 3.74Å; W618-M622 HydrophobicContact CG-SD 4.44Å; W618-M622 HydrophobicContact CH2-CE 3.26Å; W618-M622 HydrophobicContact CH2-SD 4.03Å; W618-M622 HydrophobicContact CZ2-CE 3.48Å; W618-M622 VanDerWaalsContact CZ2-CE 3.48Å; W618-M622 HydrophobicContact CZ2-SD 4.01Å; W618-M622 HydrophobicContact CZ3-CE 3.58Å; W618-M622 HydrophobicContact CZ3-CG 4.48Å; W618-M622 HydrophobicContact CZ3-SD 3.89Å; W618-M622 PolarHBondContact O-N 3.34Å
619	S	63.9	Low	63.3	Low	30 Å²	30	119.4 Å²	119.4	21%	0.21	56%	0.562	C	S	.	*	H	α-helix	trans	-65.2	-18.1	175.8	78.6	0	0	0	0	114.4	S615 L616 L617	S615-S619 WeakPolarHBondContact O-CB 3.41Å; S615-S619 PolarHBondContact O-N 3.14Å; S615-S619 PolarHBondContact O-OG 3.25Å; L616-S619 PolarHBondContact O-N 2.75Å; L616-S619 PolarHBondContact O-OG 3.32Å; L617-S619 PolarHBondContact O-N 3.08Å
620	M	69.7	Low	62.5	Low	170 Å²	170	117.2 Å²	117.2	84%	0.837	56%	0.555	S	S	*	*	H	α-helix	trans	-82.2	-25.7	172.8	-173.8	170.7	179.2	0	0	112.3	L616 L617 W618	L616-M620 PolarHBondContact O-N 2.89Å; L617-M620 WeakPolarHBondContact O-CB 3.31Å; L617-M620 PolarHBondContact O-N 2.9Å; L617-M620 VanDerWaalsContact O-N 3.17Å; W618-M620 PolarHBondContact O-N 3.14Å
621	F	68.8	Low	62	Low	166 Å²	166	113.1 Å²	113.1	73%	0.728	54%	0.543	S	S	*	.	H	α-helix	trans	-95.1	-21.5	179.5	-149.3	-95.2	0	0	0	113.2	L617 W618 F623	L617-F621 PolarHBondContact O-N 2.95Å; W618-F621 PolarHBondContact O-N 3.3Å; F621-F623 WeakPolarHBondContact O-CD2 3.24Å; F621-F623 PolarHBondContact O-N 2.96Å; F621-F623 VanDerWaalsContact O-N 3.1Å
622	M	58	Low	61.7	Low	98 Å²	98	119.7 Å²	119.7	48%	0.483	58%	0.575	S	S	.	*			trans	-70.6	103.1	179.8	-118.6	59.8	-169.2	0	0	112.2	W618 D624	W618-M622 HydrophobicContact CD2-CE 4.29Å; W618-M622 HydrophobicContact CD2-SD 3.74Å; W618-M622 HydrophobicContact CE3-CE 4.07Å; W618-M622 HydrophobicContact CE3-CG 4.4Å; W618-M622 HydrophobicContact CE3-SD 3.74Å; W618-M622 HydrophobicContact CG-SD 4.44Å; W618-M622 HydrophobicContact CH2-CE 3.26Å; W618-M622 HydrophobicContact CH2-SD 4.03Å; W618-M622 HydrophobicContact CZ2-CE 3.48Å; W618-M622 VanDerWaalsContact CZ2-CE 3.48Å; W618-M622 HydrophobicContact CZ2-SD 4.01Å; W618-M622 HydrophobicContact CZ3-CE 3.58Å; W618-M622 HydrophobicContact CZ3-CG 4.48Å; W618-M622 HydrophobicContact CZ3-SD 3.89Å; W618-M622 PolarHBondContact O-N 3.34Å; M622-D624 PolarHBondContact O-N 3.45Å
623	F	59.1	Low	61.4	Low	184 Å²	184	118.5 Å²	118.5	81%	0.807	57%	0.574	S	S	*	*			trans	-68.7	120.6	163.4	-74.7	-94.9	0	0	0	109.4	F621 P625	F621-F623 WeakPolarHBondContact O-CD2 3.24Å; F621-F623 PolarHBondContact O-N 2.96Å; F621-F623 VanDerWaalsContact O-N 3.1Å; F623-P625 WeakPolarHBondContact O-CD 3.38Å; F623-P625 VanDerWaalsContact O-N 3.08Å
624	D	56.4	Low	60.9	Low	96 Å²	96	119.2 Å²	119.2	51%	0.513	58%	0.584	S	S	.	*			trans	-51.8	111.5	170.5	-99.8	-25.3	0	0	0	109.4	R597 M622 R626 K651	R597-D624 IonicContact NE-OD1 3.16Å; R597-D624 IonicContact NH1-OD1 3.97Å; M622-D624 PolarHBondContact O-N 3.45Å; D624-R626 PolarHBondContact O-N 3.4Å; D624-K651 IonicContact OD2-NZ 2.82Å
625	P	54.7	Low	60.5	Low	97 Å²	97	119.3 Å²	119.3	63%	0.63	58%	0.576	S	S	*	*			trans	-65.5	123.1	170.4	-15	30.7	0	0	0	107.6	F623 E627	F623-P625 WeakPolarHBondContact O-CD 3.38Å; F623-P625 VanDerWaalsContact O-N 3.08Å; P625-E627 HydrophobicContact CB-CG 4.39Å; P625-E627 PolarHBondContact O-N 3.28Å
626	R	51.9	Low	60.3	Low	241 Å²	241	124.9 Å²	124.9	91%	0.909	61%	0.605	S	S	*	*			trans	-76.4	61.7	168.1	-67.1	-173.5	-176.4	-176.1	2.7	109.6	D624 R628	D624-R626 PolarHBondContact O-N 3.4Å; R626-R628 PolarHBondContact O-N 3.19Å
627	E	53.9	Low	59.9	Low	146 Å²	146	126.3 Å²	126.3	68%	0.682	61%	0.613	S	S	*	*			trans	-60.6	128.1	170	-87.4	176	156.7	0	0	109	P625 V629	P625-E627 HydrophobicContact CB-CG 4.39Å; P625-E627 PolarHBondContact O-N 3.28Å; E627-V629 VanDerWaalsContact C-N 3.25Å; E627-V629 PolarHBondContact O-N 3.01Å
628	R	52.3	Low	59.2	Low	236 Å²	236	128.1 Å²	128.1	89%	0.891	62%	0.623	S	S	*	*			trans	-79.4	81.1	-178	-61.8	-179.9	-171.9	177.3	2.9	107.4	R626 T630	R626-R628 PolarHBondContact O-N 3.19Å; R628-T630 PolarHBondContact O-N 3.25Å
629	V	56.7	Low	58.8	Low	23 Å²	23	126 Å²	126	14%	0.139	62%	0.623	C	S	.	*			trans	-55.9	104.2	178	-176.9	0	0	0	0	109.1	E627 S648 K649	E627-V629 VanDerWaalsContact C-N 3.25Å; E627-V629 PolarHBondContact O-N 3.01Å; V629-S648 WeakPolarHBondContact CG2-OG 3.21Å; V629-K649 HydrophobicContact CG1-CB 4Å; V629-K649 HydrophobicContact CG1-CD 4.29Å; V629-K649 HydrophobicContact CG1-CG 3.84Å
630	T	55.8	Low	58.5	Low	92 Å²	92	127.2 Å²	127.2	56%	0.564	63%	0.631	S	S	*	*			trans	-78.7	135.4	172.2	42.7	0	0	0	0	109	R628 N632 E633	R628-T630 PolarHBondContact O-N 3.25Å; T630-N632 PolarHBondContact O-N 3.22Å; T630-E633 PolarHBondContact O-N 3.36Å
631	A	57.4	Low	58.1	Low	68 Å²	68	123.1 Å²	123.1	56%	0.562	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.5	-31.3	-172.5	0	0	0	0	0	114.1	E633 K649	A631-E633 PolarHBondContact O-N 2.92Å; A631-K649 PolarHBondContact O-NZ 3.47Å
632	N	59.4	Low	58.3	Low	153 Å²	153	115.7 Å²	115.7	82%	0.818	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	5.2	-172.2	-62	1.4	0	0	0	115	T630 E634	T630-N632 PolarHBondContact O-N 3.22Å; N632-E634 PolarHBondContact O-N 3.44Å
633	E	59.2	Low	59.5	Low	97 Å²	97	112.2 Å²	112.2	45%	0.453	57%	0.566	S	S	.	*			trans	-72.7	121.2	178.5	-156.5	169.2	-168.7	0	0	110.4	T630 A631 K649	T630-E633 PolarHBondContact O-N 3.36Å; A631-E633 PolarHBondContact O-N 2.92Å; E633-K649 PolarHBondContact O-NZ 2.78Å
634	E	60.7	Low	60.6	Low	187 Å²	187	105.9 Å²	105.9	87%	0.874	54%	0.54	S	S	*	.			trans	-64.3	140.8	175.1	-67.1	-179.5	161.1	0	0	109.6	N632	N632-E634 PolarHBondContact O-N 3.44Å
635	I	59.6	Low	61.8	Low	57 Å²	57	105.6 Å²	105.6	29%	0.292	53%	0.534	S	S	.	.			trans	-112.7	106.3	-175.9	-54	169.7	0	0	0	107.4	I646 K649 L665	I635-I646 HydrophobicContact CG2-CD1 4.12Å; I635-I646 HydrophobicContact CG2-CG1 3.87Å; I635-K649 HydrophobicContact CD1-CD 3.86Å; I635-K649 HydrophobicContact CG1-CD 4.48Å; I635-L665 HydrophobicContact CD1-CD2 3.6Å
636	D	59.4	Low	63.3	Low	124 Å²	124	101.3 Å²	101.3	66%	0.663	51%	0.506	S	S	*	.			trans	-74.8	142.6	165.2	-78.4	-42.4	0	0	0	109.8
637	L	58.9	Low	65	Low	119 Å²	119	89.8 Å²	89.8	62%	0.623	46%	0.463	S	S	*	.	S	Bend	trans	-97.4	0.4	-168.5	-69.4	170	0	0	0	113.9	L668	L637-L668 HydrophobicContact CD2-CB 4.37Å; L637-L668 HydrophobicContact CD2-CD1 4.05Å; L637-L668 HydrophobicContact CD2-CD2 3.98Å; L637-L668 HydrophobicContact CD2-CG 4.35Å
638	N	57.9	Low	66.5	Low	159 Å²	159	84.3 Å²	84.3	85%	0.85	44%	0.44	S	S	*	.	S	Bend	trans	-105.1	-25.8	-169.3	-83.7	-11.7	0	0	0	115.2
639	D	61.5	Low	68.2	Low	104 Å²	104	74.7 Å²	74.7	56%	0.556	41%	0.405	S	S	*	.			trans	-88.6	136.5	-175	-80.1	-3.5	0	0	0	112.2	T641 D642	D639-T641 VanDerWaalsContact C-N 3.25Å; D639-T641 PolarHBondContact O-N 3.36Å; D639-D642 WeakPolarHBondContact O-CB 3.12Å; D639-D642 PolarHBondContact O-N 3.36Å
640	S	57.5	Low	69.8	Low	55 Å²	55	73.6 Å²	73.6	39%	0.385	40%	0.398	S	S	.	.	H	α-helix	trans	-64.9	-32.8	179.1	69.6	0	0	0	0	112.2	E604 D642 K643	E604-S640 WeakPolarHBondContact OE1-CB 3.34Å; E604-S640 PolarHBondContact OE1-OG 2.84Å; S640-D642 PolarHBondContact O-N 3.24Å; S640-D642 VanDerWaalsContact O-N 3.14Å; S640-K643 VanDerWaalsContact O-CB 3.32Å; S640-K643 WeakPolarHBondContact O-CB 3.49Å; S640-K643 PolarHBondContact O-N 3.01Å
641	T	61.7	Low	71.4	Confident	83 Å²	83	72.7 Å²	72.7	51%	0.509	39%	0.387	S	S	.	.	H	α-helix	trans	-50.6	-34.1	169.2	-41.8	0	0	0	0	112	D639 L644 K645	D639-T641 VanDerWaalsContact C-N 3.25Å; D639-T641 PolarHBondContact O-N 3.36Å; T641-L644 PolarHBondContact O-N 2.86Å; T641-K645 PolarHBondContact O-N 3.36Å
642	D	72.8	Confident	72.9	Confident	11 Å²	11	74.4 Å²	74.4	6%	0.059	38%	0.379	C	S	.	.	H	α-helix	trans	-77.5	-19.2	-179.4	-63.2	-26.1	0	0	0	112.8	D639 S640 L644 K645 I646	D639-D642 WeakPolarHBondContact O-CB 3.12Å; D639-D642 PolarHBondContact O-N 3.36Å; S640-D642 PolarHBondContact O-N 3.24Å; S640-D642 VanDerWaalsContact O-N 3.14Å; D642-L644 VanDerWaalsContact C-N 3.25Å; D642-L644 PolarHBondContact O-N 3.1Å; D642-K645 PolarHBondContact O-N 2.93Å; D642-K645 VanDerWaalsContact OD1-CD 3.23Å; D642-K645 WeakPolarHBondContact OD1-CD 3.47Å; D642-K645 WeakPolarHBondContact OD1-CE 3.43Å; D642-K645 IonicContact OD1-NZ 3.02Å; D642-K645 PolarHBondContact OD1-NZ 2.8Å; D642-I646 WeakPolarHBondContact O-CB 3.4Å; D642-I646 WeakPolarHBondContact O-CG1 3.26Å; D642-I646 PolarHBondContact O-N 3.29Å
643	K	82.1	Confident	74.3	Confident	25 Å²	25	67.6 Å²	67.6	11%	0.109	34%	0.344	C	S	.	.	H	α-helix	trans	-59	-38.8	169.7	-62.2	-167.3	-170.4	-166.6	0	111.4	V600 E603 S640 L647 L669 S670	V600-K643 HydrophobicContact CG1-CB 4.01Å; V600-K643 HydrophobicContact CG1-CD 4.39Å; V600-K643 HydrophobicContact CG2-CB 4.17Å; V600-K643 HydrophobicContact CG2-CD 4.33Å; E603-K643 IonicContact OE1-NZ 3.68Å; E603-K643 PolarHBondContact OE1-NZ 3.43Å; E603-K643 IonicContact OE2-NZ 3.88Å; E603-K643 PolarHBondContact OE2-NZ 2.95Å; S640-K643 VanDerWaalsContact O-CB 3.32Å; S640-K643 WeakPolarHBondContact O-CB 3.49Å; S640-K643 PolarHBondContact O-N 3.01Å; K643-L647 WeakPolarHBondContact O-CB 3.37Å; K643-L647 PolarHBondContact O-N 2.85Å; K643-L647 VanDerWaalsContact O-N 3.11Å; K643-L669 HydrophobicContact CB-CD2 4.41Å; K643-S670 VanDerWaalsContact CE-OG 3.28Å; K643-S670 WeakPolarHBondContact CE-OG 3.42Å; K643-S670 PolarHBondContact NZ-O 3.47Å; K643-S670 PolarHBondContact NZ-OG 2.76Å
644	L	81.8	Confident	75.9	Confident	51 Å²	51	63.2 Å²	63.2	27%	0.267	32%	0.323	S	S	.	.	H	α-helix	trans	-73.5	-35.4	177.2	-66.4	178.9	0	0	0	112.3	R597 V600 T641 D642 L647 S648	R597-L644 HydrophobicContact CG-CD2 4.3Å; V600-L644 HydrophobicContact CB-CD2 4.03Å; V600-L644 HydrophobicContact CG1-CD2 3.78Å; V600-L644 HydrophobicContact CG1-CG 3.91Å; T641-L644 PolarHBondContact O-N 2.86Å; D642-L644 VanDerWaalsContact C-N 3.25Å; D642-L644 PolarHBondContact O-N 3.1Å; L644-L647 PolarHBondContact O-N 3.36Å; L644-S648 PolarHBondContact O-N 3.35Å
645	K	82.8	Confident	77.3	Confident	89 Å²	89	57.6 Å²	57.6	39%	0.387	31%	0.309	S	S	.	.	H	α-helix	trans	-66	-45.7	172	-61	-174.2	-162.9	155.2	0	112	T641 D642 L647 S648 K649	T641-K645 PolarHBondContact O-N 3.36Å; D642-K645 PolarHBondContact O-N 2.93Å; D642-K645 VanDerWaalsContact OD1-CD 3.23Å; D642-K645 WeakPolarHBondContact OD1-CD 3.47Å; D642-K645 WeakPolarHBondContact OD1-CE 3.43Å; D642-K645 IonicContact OD1-NZ 3.02Å; D642-K645 PolarHBondContact OD1-NZ 2.8Å; K645-L647 VanDerWaalsContact C-N 3.26Å; K645-L647 PolarHBondContact O-N 3Å; K645-S648 PolarHBondContact O-N 3.48Å; K645-S648 VanDerWaalsContact O-N 3.15Å; K645-S648 PolarHBondContact O-OG 3.36Å; K645-K649 WeakPolarHBondContact O-CB 3.41Å; K645-K649 PolarHBondContact O-N 3.19Å
646	I	86.4	Confident	78.7	Confident	7 Å²	7	59.6 Å²	59.6	4%	0.036	32%	0.317	C	S	.	.	H	α-helix	trans	-54.7	-45.8	173.7	-72.6	163.9	0	0	0	109.8	I635 D642 K649 A650 L665 L668 L669	I635-I646 HydrophobicContact CG2-CD1 4.12Å; I635-I646 HydrophobicContact CG2-CG1 3.87Å; D642-I646 WeakPolarHBondContact O-CB 3.4Å; D642-I646 WeakPolarHBondContact O-CG1 3.26Å; D642-I646 PolarHBondContact O-N 3.29Å; I646-K649 PolarHBondContact O-N 2.93Å; I646-A650 WeakPolarHBondContact O-CB 3.33Å; I646-A650 PolarHBondContact O-N 2.82Å; I646-L665 HydrophobicContact CG2-CB 4.24Å; I646-L665 WeakPolarHBondContact CG2-O 3.26Å; I646-L668 HydrophobicContact CD1-CB 4.16Å; I646-L669 HydrophobicContact CB-CD2 4.43Å; I646-L669 HydrophobicContact CG2-CD2 3.93Å; I646-L669 HydrophobicContact CG2-CG 4.3Å
647	L	87.9	Confident	80.2	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-70.4	-32.9	179.7	-172.5	58	0	0	0	113.1	F589 D593 C596 R597 K643 L644 K645 K651 M666	F589-L647 HydrophobicContact CZ-CD1 4.12Å; D593-L647 WeakPolarHBondContact OD1-CG 3.34Å; C596-L647 HydrophobicContact CB-CD1 4.45Å; C596-L647 HydrophobicContact CB-CD2 3.68Å; R597-L647 HydrophobicContact CG-CD2 3.62Å; K643-L647 WeakPolarHBondContact O-CB 3.37Å; K643-L647 PolarHBondContact O-N 2.85Å; K643-L647 VanDerWaalsContact O-N 3.11Å; L644-L647 PolarHBondContact O-N 3.36Å; K645-L647 VanDerWaalsContact C-N 3.26Å; K645-L647 PolarHBondContact O-N 3Å; L647-K651 VanDerWaalsContact O-CB 3.26Å; L647-K651 WeakPolarHBondContact O-CB 3.25Å; L647-K651 PolarHBondContact O-N 2.98Å; L647-M666 HydrophobicContact CD1-CE 4.03Å; L647-M666 HydrophobicContact CD1-SD 3.7Å
648	S	85	Confident	81.7	Confident	30 Å²	30	56.1 Å²	56.1	21%	0.21	30%	0.299	C	S	.	.	H	α-helix	trans	-70.4	-37.8	171.6	71.9	0	0	0	0	112.2	V629 L644 K645 K651 Y652	V629-S648 WeakPolarHBondContact CG2-OG 3.21Å; L644-S648 PolarHBondContact O-N 3.35Å; K645-S648 PolarHBondContact O-N 3.48Å; K645-S648 VanDerWaalsContact O-N 3.15Å; K645-S648 PolarHBondContact O-OG 3.36Å; S648-K651 WeakPolarHBondContact O-CB 3.38Å; S648-K651 PolarHBondContact O-N 3.14Å; S648-Y652 PolarHBondContact O-N 2.9Å
649	K	86.9	Confident	83.4	Confident	34 Å²	34	48.9 Å²	48.9	15%	0.148	26%	0.26	C	S	.	.	H	α-helix	trans	-67.4	-41.3	173.6	-161.3	171.4	-169.8	166.3	0	111.7	V629 A631 E633 I635 K645 I646 K651 Y652 C653 L665	V629-K649 HydrophobicContact CG1-CB 4Å; V629-K649 HydrophobicContact CG1-CD 4.29Å; V629-K649 HydrophobicContact CG1-CG 3.84Å; A631-K649 PolarHBondContact O-NZ 3.47Å; E633-K649 PolarHBondContact O-NZ 2.78Å; I635-K649 HydrophobicContact CD1-CD 3.86Å; I635-K649 HydrophobicContact CG1-CD 4.48Å; K645-K649 WeakPolarHBondContact O-CB 3.41Å; K645-K649 PolarHBondContact O-N 3.19Å; I646-K649 PolarHBondContact O-N 2.93Å; K649-K651 PolarHBondContact O-N 3.29Å; K649-Y652 WeakPolarHBondContact O-CB 3.45Å; K649-Y652 PolarHBondContact O-N 3.09Å; K649-C653 PolarHBondContact O-N 2.68Å; K649-C653 PolarHBondContact O-SG 2.87Å; K649-C653 VanDerWaalsContact O-SG 3.36Å; K649-L665 HydrophobicContact CB-CD1 4.02Å; K649-L665 HydrophobicContact CD-CD1 4.27Å; K649-L665 HydrophobicContact CD-CD2 4.19Å; K649-L665 HydrophobicContact CG-CD1 3.78Å
650	A	90.1	Very high	84.8	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-62.3	-41.9	172.6	0	0	0	0	0	111.6	F589 I646 Y652 C653 V654 L665 M666	F589-A650 HydrophobicContact CE2-CB 4.31Å; F589-A650 HydrophobicContact CZ-CB 3.98Å; I646-A650 WeakPolarHBondContact O-CB 3.33Å; I646-A650 PolarHBondContact O-N 2.82Å; A650-Y652 VanDerWaalsContact C-N 3.3Å; A650-Y652 PolarHBondContact O-N 2.86Å; A650-C653 PolarHBondContact O-N 3.13Å; A650-V654 WeakPolarHBondContact O-CG2 3.38Å; A650-V654 PolarHBondContact O-N 3.39Å; A650-L665 HydrophobicContact CB-CB 4.1Å; A650-L665 HydrophobicContact CB-CD1 4.43Å; A650-M666 HydrophobicContact CB-CG 3.97Å; A650-M666 HydrophobicContact CB-SD 3.7Å
651	K	90.5	Very high	86.4	Confident	74 Å²	74	48.6 Å²	48.6	32%	0.322	26%	0.256	S	S	.	.	H	α-helix	trans	-61.7	-36	173.3	-175.1	179.4	-172.5	161.2	0	112.8	F589 D593 D624 L647 S648 K649 A655	F589-K651 VanDerWaalsContact CE1-CA 3.47Å; F589-K651 HydrophobicContact CE1-CB 3.76Å; F589-K651 HydrophobicContact CE1-CG 4.19Å; F589-K651 HydrophobicContact CZ-CB 4.29Å; D593-K651 IonicContact OD1-NZ 3.07Å; D593-K651 WeakPolarHBondContact OD2-CD 3.35Å; D593-K651 VanDerWaalsContact OD2-CE 3.23Å; D593-K651 WeakPolarHBondContact OD2-CE 3.34Å; D593-K651 IonicContact OD2-NZ 2.67Å; D593-K651 PolarHBondContact OD2-NZ 2.76Å; D624-K651 IonicContact OD2-NZ 2.82Å; L647-K651 VanDerWaalsContact O-CB 3.26Å; L647-K651 WeakPolarHBondContact O-CB 3.25Å; L647-K651 PolarHBondContact O-N 2.98Å; S648-K651 WeakPolarHBondContact O-CB 3.38Å; S648-K651 PolarHBondContact O-N 3.14Å; K649-K651 PolarHBondContact O-N 3.29Å; K651-A655 WeakPolarHBondContact O-CB 3.49Å; K651-A655 PolarHBondContact O-N 3.49Å
652	Y	88.6	Confident	87.9	Confident	103 Å²	103	44.6 Å²	44.6	40%	0.404	23%	0.232	S	C	.	.	H	α-helix	trans	-65.4	-50.1	170.9	179.5	-84.3	0	0	0	111.2	S648 K649 A650 V654 A655 H656	S648-Y652 PolarHBondContact O-N 2.9Å; K649-Y652 WeakPolarHBondContact O-CB 3.45Å; K649-Y652 PolarHBondContact O-N 3.09Å; A650-Y652 VanDerWaalsContact C-N 3.3Å; A650-Y652 PolarHBondContact O-N 2.86Å; Y652-V654 PolarHBondContact O-N 3.43Å; Y652-A655 WeakPolarHBondContact O-CB 3.49Å; Y652-A655 PolarHBondContact O-N 2.85Å; Y652-A655 VanDerWaalsContact O-N 3.1Å; Y652-H656 AromaticContact CD1-ND1 3.72Å; Y652-H656 AromaticContact CD2-CE1 3.67Å; Y652-H656 AromaticContact CE1-CE1 3.69Å; Y652-H656 AromaticContact CE1-ND1 3.56Å; Y652-H656 AromaticContact CE2-CE1 3.25Å; Y652-H656 WeakPolarHBondContact CE2-CE1 3.46Å; Y652-H656 AromaticContact CE2-ND1 3.89Å; Y652-H656 AromaticContact CG-ND1 3.93Å; Y652-H656 AromaticContact CZ-CE1 3.25Å; Y652-H656 AromaticContact CZ-ND1 3.65Å; Y652-H656 AromaticContact CZ-NE2 3.74Å; Y652-H656 PolarHBondContact O-N 3.12Å; Y652-H656 PolarHBondContact O-ND1 3.28Å
653	C	89.8	Confident	88.9	Confident	10 Å²	10	44.7 Å²	44.7	7%	0.068	23%	0.232	C	C	.	.	H	α-helix	trans	-60.4	-44.3	178.8	-66.6	0	0	0	0	112.9	K649 A650 A655 H656 D657 D658 A662	K649-C653 PolarHBondContact O-N 2.68Å; K649-C653 PolarHBondContact O-SG 2.87Å; K649-C653 VanDerWaalsContact O-SG 3.36Å; A650-C653 PolarHBondContact O-N 3.13Å; C653-A655 PolarHBondContact O-N 3.48Å; C653-H656 CarbonylContact O-C 3.56Å; C653-H656 PolarHBondContact O-N 3.35Å; C653-D657 PolarHBondContact O-N 2.83Å; C653-D657 VanDerWaalsContact O-N 3.11Å; C653-D658 HydrophobicContact CB-CB 4.15Å; C653-D658 PolarHBondContact O-N 3.1Å; C653-A662 HydrophobicContact CB-CB 3.95Å
654	V	92.3	Very high	89.3	Confident	5 Å²	5	49.8 Å²	49.8	3%	0.03	25%	0.254	C	S	.	.	H	α-helix	trans	-65.5	-23.3	176.4	175.4	0	0	0	0	112.6	K586 F589 A650 Y652 F659 A662 W680	K586-V654 HydrophobicContact CB-CG1 4.34Å; K586-V654 HydrophobicContact CG-CG1 3.87Å; F589-V654 HydrophobicContact CB-CG1 3.92Å; F589-V654 HydrophobicContact CD1-CB 4.09Å; F589-V654 HydrophobicContact CD1-CG1 3.99Å; F589-V654 HydrophobicContact CD1-CG2 4.17Å; F589-V654 HydrophobicContact CD2-CG2 3.89Å; F589-V654 HydrophobicContact CE1-CB 4.45Å; F589-V654 HydrophobicContact CE1-CG2 4.4Å; F589-V654 HydrophobicContact CE2-CG2 4.09Å; F589-V654 HydrophobicContact CG-CB 4.22Å; F589-V654 HydrophobicContact CG-CG1 3.91Å; F589-V654 HydrophobicContact CG-CG2 3.92Å; F589-V654 HydrophobicContact CZ-CG2 4.35Å; A650-V654 WeakPolarHBondContact O-CG2 3.38Å; A650-V654 PolarHBondContact O-N 3.39Å; Y652-V654 PolarHBondContact O-N 3.43Å; V654-F659 HydrophobicContact CG1-CE1 4.23Å; V654-A662 HydrophobicContact CG2-CB 3.42Å; V654-A662 VanDerWaalsContact CG2-CB 3.42Å; V654-W680 HydrophobicContact CG2-CH2 3.88Å; V654-W680 HydrophobicContact CG2-CZ2 3.9Å
655	A	89.4	Confident	89.7	Confident	70 Å²	70	47.9 Å²	47.9	58%	0.579	25%	0.245	S	C	*	.	H	α-helix	trans	-83	-14.3	173.2	0	0	0	0	0	113.9	K651 Y652 C653	K651-A655 WeakPolarHBondContact O-CB 3.49Å; K651-A655 PolarHBondContact O-N 3.49Å; Y652-A655 WeakPolarHBondContact O-CB 3.49Å; Y652-A655 PolarHBondContact O-N 2.85Å; Y652-A655 VanDerWaalsContact O-N 3.1Å; C653-A655 PolarHBondContact O-N 3.48Å
656	H	89.8	Confident	90.1	Very high	98 Å²	98	43.7 Å²	43.7	45%	0.454	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.8	17.1	175.2	-66.1	82.3	0	0	0	112.1	Y652 C653 D658	Y652-H656 AromaticContact CD1-ND1 3.72Å; Y652-H656 AromaticContact CD2-CE1 3.67Å; Y652-H656 AromaticContact CE1-CE1 3.69Å; Y652-H656 AromaticContact CE1-ND1 3.56Å; Y652-H656 AromaticContact CE2-CE1 3.25Å; Y652-H656 WeakPolarHBondContact CE2-CE1 3.46Å; Y652-H656 AromaticContact CE2-ND1 3.89Å; Y652-H656 AromaticContact CG-ND1 3.93Å; Y652-H656 AromaticContact CZ-CE1 3.25Å; Y652-H656 AromaticContact CZ-ND1 3.65Å; Y652-H656 AromaticContact CZ-NE2 3.74Å; Y652-H656 PolarHBondContact O-N 3.12Å; Y652-H656 PolarHBondContact O-ND1 3.28Å; C653-H656 CarbonylContact O-C 3.56Å; C653-H656 PolarHBondContact O-N 3.35Å; H656-D658 PolarHBondContact O-N 2.69Å
657	D	89.5	Confident	90.3	Very high	84 Å²	84	48.1 Å²	48.1	45%	0.449	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.1	7.5	171.5	-45.6	-7.2	0	0	0	113.6	E582 K586 C653 F659	E582-D657 WeakPolarHBondContact OE1-CB 3.48Å; E582-D657 VanDerWaalsContact OE1-CG 3.28Å; K586-D657 WeakPolarHBondContact CE-OD1 3.49Å; K586-D657 IonicContact NZ-OD1 3.21Å; K586-D657 PolarHBondContact NZ-OD1 2.74Å; K586-D657 IonicContact NZ-OD2 2.95Å; K586-D657 PolarHBondContact NZ-OD2 3.11Å; C653-D657 PolarHBondContact O-N 2.83Å; C653-D657 VanDerWaalsContact O-N 3.11Å; D657-F659 VanDerWaalsContact C-N 3.28Å; D657-F659 WeakPolarHBondContact O-CD2 3.45Å; D657-F659 PolarHBondContact O-N 2.65Å
658	D	90.9	Very high	90.3	Very high	87 Å²	87	51.9 Å²	51.9	47%	0.465	27%	0.27	S	S	.	.			trans	-81.1	62.1	177.2	-81.6	-32.8	0	0	0	112.1	C653 H656 L660 T661 A662	C653-D658 HydrophobicContact CB-CB 4.15Å; C653-D658 PolarHBondContact O-N 3.1Å; H656-D658 PolarHBondContact O-N 2.69Å; D658-L660 PolarHBondContact O-N 3.06Å; D658-T661 PolarHBondContact O-N 3.06Å; D658-A662 PolarHBondContact O-N 3.24Å
659	F	93.2	Very high	90.4	Very high	6 Å²	6	50.9 Å²	50.9	3%	0.026	26%	0.262	C	S	.	.	H	α-helix	trans	-57.8	-33.5	179.1	-67.8	-82.8	0	0	0	113.4	E582 L585 K586 V654 D657 A662 V663 W680 T684 F687 L688	E582-F659 HydrophobicContact CG-CD2 4.47Å; E582-F659 HydrophobicContact CG-CE2 3.34Å; E582-F659 HydrophobicContact CG-CZ 3.56Å; L585-F659 HydrophobicContact CB-CE1 3.76Å; L585-F659 HydrophobicContact CB-CZ 4.34Å; L585-F659 HydrophobicContact CD1-CE1 4.36Å; K586-F659 HydrophobicContact CD-CZ 4.5Å; K586-F659 HydrophobicContact CG-CE1 4.37Å; K586-F659 HydrophobicContact CG-CZ 3.9Å; V654-F659 HydrophobicContact CG1-CE1 4.23Å; D657-F659 VanDerWaalsContact C-N 3.28Å; D657-F659 WeakPolarHBondContact O-CD2 3.45Å; D657-F659 PolarHBondContact O-N 2.65Å; F659-A662 PolarHBondContact O-N 3.48Å; F659-V663 WeakPolarHBondContact O-CB 3.46Å; F659-V663 WeakPolarHBondContact O-CG2 3.43Å; F659-V663 PolarHBondContact O-N 3.15Å; F659-W680 HydrophobicContact CD1-CZ2 4.34Å; F659-T684 HydrophobicContact CB-CG2 3.84Å; F659-T684 HydrophobicContact CD1-CG2 3.83Å; F659-T684 HydrophobicContact CG-CG2 4.2Å; F659-F687 HydrophobicContact CD2-CE1 4.19Å; F659-F687 HydrophobicContact CE2-CE1 4.44Å; F659-L688 HydrophobicContact CB-CD1 4.22Å; F659-L688 HydrophobicContact CB-CD2 4.08Å; F659-L688 HydrophobicContact CB-CG 4.32Å
660	L	92.5	Very high	90.3	Very high	96 Å²	96	52.5 Å²	52.5	50%	0.503	28%	0.278	S	S	.	.	H	α-helix	trans	-66.2	-42.7	179.3	-178.1	145.4	0	0	0	111.9	D658 K664 L688	D658-L660 PolarHBondContact O-N 3.06Å; L660-K664 HydrophobicContact CD2-CD 4.11Å; L660-K664 WeakPolarHBondContact O-CG 3.26Å; L660-K664 PolarHBondContact O-N 2.9Å; L660-K664 VanDerWaalsContact O-N 3.14Å; L660-L688 HydrophobicContact CB-CD1 4.22Å
661	T	90.5	Very high	90	Very high	57 Å²	57	54.6 Å²	54.6	35%	0.35	30%	0.299	S	S	.	.	H	α-helix	trans	-70.3	-38.3	174.9	-53.4	0	0	0	0	110.7	D658 K664 L665	D658-T661 PolarHBondContact O-N 3.06Å; T661-K664 PolarHBondContact O-N 3.13Å; T661-L665 HydrophobicContact CG2-CD1 4.21Å; T661-L665 WeakPolarHBondContact O-CG 3.32Å; T661-L665 PolarHBondContact O-N 3.01Å
662	A	92.3	Very high	89.8	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-61.7	-44.3	174.1	0	0	0	0	0	112.9	C653 V654 D658 F659 L665 M666 W680	C653-A662 HydrophobicContact CB-CB 3.95Å; V654-A662 HydrophobicContact CG2-CB 3.42Å; V654-A662 VanDerWaalsContact CG2-CB 3.42Å; D658-A662 PolarHBondContact O-N 3.24Å; F659-A662 PolarHBondContact O-N 3.48Å; A662-L665 PolarHBondContact O-N 2.77Å; A662-M666 WeakPolarHBondContact O-CB 3.25Å; A662-M666 WeakPolarHBondContact O-CG 3.39Å; A662-M666 PolarHBondContact O-N 3.33Å; A662-W680 HydrophobicContact CB-CH2 4.05Å
663	V	93.7	Very high	89.7	Confident	12 Å²	12	50.6 Å²	50.6	7%	0.073	29%	0.285	C	S	.	.	H	α-helix	trans	-62.2	-43	175.9	164.7	0	0	0	0	111	F659 L665 M666 N667 W680 I681 T684 I685 L688	F659-V663 WeakPolarHBondContact O-CB 3.46Å; F659-V663 WeakPolarHBondContact O-CG2 3.43Å; F659-V663 PolarHBondContact O-N 3.15Å; V663-L665 PolarHBondContact O-N 3.49Å; V663-M666 PolarHBondContact O-N 3.11Å; V663-N667 WeakPolarHBondContact O-CB 3.48Å; V663-N667 PolarHBondContact O-N 3.34Å; V663-W680 HydrophobicContact CG2-CH2 4.49Å; V663-W680 HydrophobicContact CG2-CZ3 4.22Å; V663-I681 HydrophobicContact CG1-CG2 4.15Å; V663-T684 HydrophobicContact CG2-CG2 3.53Å; V663-I685 HydrophobicContact CG1-CD1 4.38Å; V663-I685 HydrophobicContact CG1-CG1 4.15Å; V663-L688 HydrophobicContact CG2-CD1 4.46Å
664	K	90.7	Very high	89.7	Confident	132 Å²	132	51.5 Å²	51.5	57%	0.574	29%	0.294	S	S	*	.	H	α-helix	trans	-57	-47.7	173.8	-73.8	173.6	178.7	179.9	0	111.8	L660 T661 N667	L660-K664 HydrophobicContact CD2-CD 4.11Å; L660-K664 WeakPolarHBondContact O-CG 3.26Å; L660-K664 PolarHBondContact O-N 2.9Å; L660-K664 VanDerWaalsContact O-N 3.14Å; T661-K664 PolarHBondContact O-N 3.13Å; K664-N667 PolarHBondContact O-N 3.19Å
665	L	89.9	Confident	89.7	Confident	12 Å²	12	59.2 Å²	59.2	6%	0.063	32%	0.322	C	S	.	.	H	α-helix	trans	-65.1	-43	178.2	-69.7	167.1	0	0	0	112.2	I635 I646 K649 A650 T661 A662 V663 N667 L668	I635-L665 HydrophobicContact CD1-CD2 3.6Å; I646-L665 HydrophobicContact CG2-CB 4.24Å; I646-L665 WeakPolarHBondContact CG2-O 3.26Å; K649-L665 HydrophobicContact CB-CD1 4.02Å; K649-L665 HydrophobicContact CD-CD1 4.27Å; K649-L665 HydrophobicContact CD-CD2 4.19Å; K649-L665 HydrophobicContact CG-CD1 3.78Å; A650-L665 HydrophobicContact CB-CB 4.1Å; A650-L665 HydrophobicContact CB-CD1 4.43Å; T661-L665 HydrophobicContact CG2-CD1 4.21Å; T661-L665 WeakPolarHBondContact O-CG 3.32Å; T661-L665 PolarHBondContact O-N 3.01Å; A662-L665 PolarHBondContact O-N 2.77Å; V663-L665 PolarHBondContact O-N 3.49Å; L665-N667 VanDerWaalsContact C-N 3.28Å; L665-N667 PolarHBondContact O-N 2.93Å; L665-L668 HydrophobicContact CD2-CD1 4.41Å; L665-L668 WeakPolarHBondContact O-CB 3.17Å; L665-L668 PolarHBondContact O-N 3.44Å
666	M	91.2	Very high	89.7	Confident	1 Å²	1	58.9 Å²	58.9	1%	0.005	31%	0.31	C	S	.	.	H	α-helix	trans	-68.7	-26	179.4	-66.6	-64.3	-69	0	0	112.8	F589 L592 L647 A650 A662 V663 L668 L669 A677 W680 I681	F589-M666 HydrophobicContact CE2-CE 4.08Å; F589-M666 HydrophobicContact CE2-CG 4.15Å; F589-M666 HydrophobicContact CE2-SD 3.8Å; F589-M666 HydrophobicContact CZ-SD 4.28Å; L592-M666 HydrophobicContact CD2-CE 3.82Å; L647-M666 HydrophobicContact CD1-CE 4.03Å; L647-M666 HydrophobicContact CD1-SD 3.7Å; A650-M666 HydrophobicContact CB-CG 3.97Å; A650-M666 HydrophobicContact CB-SD 3.7Å; A662-M666 WeakPolarHBondContact O-CB 3.25Å; A662-M666 WeakPolarHBondContact O-CG 3.39Å; A662-M666 PolarHBondContact O-N 3.33Å; V663-M666 PolarHBondContact O-N 3.11Å; M666-L668 VanDerWaalsContact C-N 3.27Å; M666-L668 PolarHBondContact O-N 3.04Å; M666-L669 HydrophobicContact CE-CD1 3.53Å; M666-L669 WeakPolarHBondContact O-CB 3.12Å; M666-L669 PolarHBondContact O-N 3.38Å; M666-L669 HydrophobicContact SD-CD1 3.69Å; M666-A677 HydrophobicContact CE-CB 3.65Å; M666-W680 HydrophobicContact CB-CZ3 4.25Å; M666-W680 HydrophobicContact CG-CE3 4.35Å; M666-W680 HydrophobicContact CG-CZ3 3.78Å; M666-I681 HydrophobicContact CB-CD1 3.95Å; M666-I681 HydrophobicContact CB-CG1 4.04Å
667	N	91.7	Very high	89.9	Confident	99 Å²	99	54.2 Å²	54.2	53%	0.529	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-17.3	170	-80.6	-21.7	0	0	0	113.7	V663 K664 L665 L669	V663-N667 WeakPolarHBondContact O-CB 3.48Å; V663-N667 PolarHBondContact O-N 3.34Å; K664-N667 PolarHBondContact O-N 3.19Å; L665-N667 VanDerWaalsContact C-N 3.28Å; L665-N667 PolarHBondContact O-N 2.93Å; N667-L669 VanDerWaalsContact C-N 3.3Å
668	L	88.6	Confident	90.1	Very high	79 Å²	79	53.2 Å²	53.2	41%	0.414	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-10.1	174.2	-58.4	174.7	0	0	0	112.7	L637 I646 L665 M666	L637-L668 HydrophobicContact CD2-CB 4.37Å; L637-L668 HydrophobicContact CD2-CD1 4.05Å; L637-L668 HydrophobicContact CD2-CD2 3.98Å; L637-L668 HydrophobicContact CD2-CG 4.35Å; I646-L668 HydrophobicContact CD1-CB 4.16Å; L665-L668 HydrophobicContact CD2-CD1 4.41Å; L665-L668 WeakPolarHBondContact O-CB 3.17Å; L665-L668 PolarHBondContact O-N 3.44Å; M666-L668 VanDerWaalsContact C-N 3.27Å; M666-L668 PolarHBondContact O-N 3.04Å
669	L	86.9	Confident	90.1	Very high	10 Å²	10	51.4 Å²	51.4	5%	0.052	29%	0.286	C	S	.	.			trans	-68.6	138.5	174.7	-63.8	173.9	0	0	0	110.2	K643 I646 M666 N667 A674 A677	K643-L669 HydrophobicContact CB-CD2 4.41Å; I646-L669 HydrophobicContact CB-CD2 4.43Å; I646-L669 HydrophobicContact CG2-CD2 3.93Å; I646-L669 HydrophobicContact CG2-CG 4.3Å; M666-L669 HydrophobicContact CE-CD1 3.53Å; M666-L669 WeakPolarHBondContact O-CB 3.12Å; M666-L669 PolarHBondContact O-N 3.38Å; M666-L669 HydrophobicContact SD-CD1 3.69Å; N667-L669 VanDerWaalsContact C-N 3.3Å; L669-A674 HydrophobicContact CB-CB 4.3Å; L669-A674 WeakPolarHBondContact O-CB 3.47Å; L669-A677 HydrophobicContact CD1-CB 4.42Å
670	S	83.3	Confident	90.2	Very high	68 Å²	68	51.2 Å²	51.2	48%	0.476	29%	0.285	S	S	.	.			trans	-118.5	152.4	176.5	59.6	0	0	0	0	111.4	K643 P673	K643-S670 VanDerWaalsContact CE-OG 3.28Å; K643-S670 WeakPolarHBondContact CE-OG 3.42Å; K643-S670 PolarHBondContact NZ-O 3.47Å; K643-S670 PolarHBondContact NZ-OG 2.76Å; S670-P673 WeakPolarHBondContact O-CG 3.21Å
671	G	84.6	Confident	90.3	Very high	44 Å²	44	47.4 Å²	47.4	45%	0.454	27%	0.265	S	S	.	.	S	Bend	trans	85.1	-156	178.6	0	0	0	0	0	114.6	P673 A674 R675	G671-P673 VanDerWaalsContact C-CD 3.42Å; G671-A674 VanDerWaalsContact O-CB 3.24Å; G671-A674 WeakPolarHBondContact O-CB 3.43Å; G671-A674 PolarHBondContact O-N 3.17Å; G671-A674 VanDerWaalsContact O-N 3.08Å; G671-R675 PolarHBondContact O-N 3.19Å
672	E	85.6	Confident	90.4	Very high	92 Å²	92	49.7 Å²	49.7	43%	0.43	27%	0.27	S	S	.	.	H	α-helix	trans	-55.2	-37.4	176.2	-72.6	-64.1	165.4	0	0	115.7	A674 R675 L676	E672-A674 PolarHBondContact O-N 3.48Å; E672-R675 WeakPolarHBondContact O-CB 3.23Å; E672-R675 PolarHBondContact O-N 3.46Å; E672-R675 VanDerWaalsContact O-N 3.13Å; E672-R675 IonicContact OE1-CZ 3.85Å; E672-R675 IonicContact OE1-NH1 2.77Å; E672-R675 PolarHBondContact OE1-NH1 3.4Å; E672-R675 IonicContact OE2-CZ 3.21Å; E672-R675 IonicContact OE2-NE 3.42Å; E672-R675 PolarHBondContact OE2-NE 3.42Å; E672-R675 IonicContact OE2-NH1 2.85Å; E672-R675 PolarHBondContact OE2-NH1 3.01Å; E672-L676 PolarHBondContact O-N 3.26Å
673	P	87.5	Confident	90.4	Very high	0 Å²	0	51 Å²	51	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-62.9	-30	175.1	25.3	-35.6	0	0	0	112.5	C596 V600 S670 G671 A677	C596-P673 HydrophobicContact CB-CB 4.35Å; V600-P673 HydrophobicContact CG2-CB 3.98Å; V600-P673 HydrophobicContact CG2-CG 3.83Å; S670-P673 WeakPolarHBondContact O-CG 3.21Å; G671-P673 VanDerWaalsContact C-CD 3.42Å; P673-A677 VanDerWaalsContact O-CB 3.28Å; P673-A677 WeakPolarHBondContact O-CB 3.4Å; P673-A677 PolarHBondContact O-N 2.84Å
674	A	89.6	Confident	90.4	Very high	29 Å²	29	50.5 Å²	50.5	24%	0.24	27%	0.273	C	S	.	.	H	α-helix	trans	-67.8	-41.3	174.1	0	0	0	0	0	111.5	L669 G671 E672 L676 A677 S678	L669-A674 HydrophobicContact CB-CB 4.3Å; L669-A674 WeakPolarHBondContact O-CB 3.47Å; G671-A674 VanDerWaalsContact O-CB 3.24Å; G671-A674 WeakPolarHBondContact O-CB 3.43Å; G671-A674 PolarHBondContact O-N 3.17Å; G671-A674 VanDerWaalsContact O-N 3.08Å; E672-A674 PolarHBondContact O-N 3.48Å; A674-L676 VanDerWaalsContact C-N 3.34Å; A674-L676 PolarHBondContact O-N 3.23Å; A674-A677 PolarHBondContact O-N 2.84Å; A674-S678 PolarHBondContact O-N 3.12Å
675	R	91.5	Very high	90.6	Very high	167 Å²	167	46.9 Å²	46.9	63%	0.63	26%	0.26	S	S	*	.	H	α-helix	trans	-59.9	-43.9	175.7	-160.4	-178	101.8	-164.4	10.6	111.4	G671 E672 S678	G671-R675 PolarHBondContact O-N 3.19Å; E672-R675 WeakPolarHBondContact O-CB 3.23Å; E672-R675 PolarHBondContact O-N 3.46Å; E672-R675 VanDerWaalsContact O-N 3.13Å; E672-R675 IonicContact OE1-CZ 3.85Å; E672-R675 IonicContact OE1-NH1 2.77Å; E672-R675 PolarHBondContact OE1-NH1 3.4Å; E672-R675 IonicContact OE2-CZ 3.21Å; E672-R675 IonicContact OE2-NE 3.42Å; E672-R675 PolarHBondContact OE2-NE 3.42Å; E672-R675 IonicContact OE2-NH1 2.85Å; E672-R675 PolarHBondContact OE2-NH1 3.01Å; R675-S678 PolarHBondContact O-OG 3.23Å
676	L	91.1	Very high	90.7	Very high	63 Å²	63	48 Å²	48	33%	0.33	26%	0.263	S	S	.	.	H	α-helix	trans	-66.3	-40	174.3	-69.3	174.6	0	0	0	112.8	L592 V595 T599 E672 A674	L592-L676 HydrophobicContact CD1-CB 4.13Å; V595-L676 HydrophobicContact CG1-CD1 3.66Å; T599-L676 HydrophobicContact CG2-CD1 3.63Å; E672-L676 PolarHBondContact O-N 3.26Å; A674-L676 VanDerWaalsContact C-N 3.34Å; A674-L676 PolarHBondContact O-N 3.23Å
677	A	93.2	Very high	90.8	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-67.8	-33.5	178.9	0	0	0	0	0	113	L592 M666 L669 P673 A674 A679 W680 I681	L592-A677 HydrophobicContact CD2-CB 4.48Å; M666-A677 HydrophobicContact CE-CB 3.65Å; L669-A677 HydrophobicContact CD1-CB 4.42Å; P673-A677 VanDerWaalsContact O-CB 3.28Å; P673-A677 WeakPolarHBondContact O-CB 3.4Å; P673-A677 PolarHBondContact O-N 2.84Å; A674-A677 PolarHBondContact O-N 2.84Å; A677-A679 VanDerWaalsContact C-N 3.26Å; A677-A679 PolarHBondContact O-N 3.44Å; A677-A679 VanDerWaalsContact O-N 3.1Å; A677-W680 WeakPolarHBondContact O-CA 3.44Å; A677-W680 PolarHBondContact O-N 3.47Å; A677-I681 HydrophobicContact CB-CD1 3.75Å; A677-I681 HydrophobicContact CB-CG1 4.43Å; A677-I681 WeakPolarHBondContact O-CG1 3.15Å; A677-I681 PolarHBondContact O-N 3.43Å
678	S	93.1	Very high	90.9	Very high	64 Å²	64	45.5 Å²	45.5	45%	0.448	25%	0.25	S	C	.	.	H	α-helix	trans	-48.8	-41.7	-173.9	70.1	0	0	0	0	114.1	A674 R675 I681 K682	A674-S678 PolarHBondContact O-N 3.12Å; R675-S678 PolarHBondContact O-OG 3.23Å; S678-I681 PolarHBondContact O-N 2.88Å; S678-K682 WeakPolarHBondContact O-CB 3.37Å; S678-K682 PolarHBondContact O-N 2.94Å
679	A	92.3	Very high	91	Very high	49 Å²	49	45.8 Å²	45.8	41%	0.405	25%	0.249	S	C	.	.	H	α-helix	trans	-68.1	-41	178.3	0	0	0	0	0	112.4	R588 A677 D683	R588-A679 VanDerWaalsContact NH2-C 3.35Å; R588-A679 PolarHBondContact NH2-O 3.03Å; A677-A679 VanDerWaalsContact C-N 3.26Å; A677-A679 PolarHBondContact O-N 3.44Å; A677-A679 VanDerWaalsContact O-N 3.1Å; A679-D683 WeakPolarHBondContact O-CB 3.31Å; A679-D683 PolarHBondContact O-N 2.91Å; A679-D683 VanDerWaalsContact O-N 3.11Å
680	W	94	Very high	91.3	Very high	2 Å²	2	45.3 Å²	45.3	1%	0.008	25%	0.246	C	C	.	.	H	α-helix	trans	-70.4	-37.3	175.2	177.7	84.6	0	0	0	111.6	L585 F589 L592 V654 F659 A662 V663 M666 A677 D683 T684	L585-W680 PolarHBondContact O-NE1 2.67Å; F589-W680 HydrophobicContact CB-CZ2 4.06Å; F589-W680 HydrophobicContact CD2-CD2 4.08Å; F589-W680 AromaticContact CD2-CE2 3.69Å; F589-W680 HydrophobicContact CD2-CE3 4.25Å; F589-W680 AromaticContact CD2-CH2 3.75Å; F589-W680 HydrophobicContact CD2-CH2 3.75Å; F589-W680 AromaticContact CD2-CZ2 3.52Å; F589-W680 HydrophobicContact CD2-CZ2 3.52Å; F589-W680 HydrophobicContact CD2-CZ3 4.11Å; F589-W680 HydrophobicContact CE2-CH2 4.2Å; F589-W680 HydrophobicContact CE2-CZ2 4.4Å; F589-W680 HydrophobicContact CE2-CZ3 4.37Å; F589-W680 HydrophobicContact CG-CZ2 4.13Å; L592-W680 HydrophobicContact CD2-CB 3.62Å; L592-W680 HydrophobicContact CD2-CD2 4.08Å; L592-W680 HydrophobicContact CD2-CE3 4.3Å; L592-W680 HydrophobicContact CD2-CG 3.79Å; V654-W680 HydrophobicContact CG2-CH2 3.88Å; V654-W680 HydrophobicContact CG2-CZ2 3.9Å; F659-W680 HydrophobicContact CD1-CZ2 4.34Å; A662-W680 HydrophobicContact CB-CH2 4.05Å; V663-W680 HydrophobicContact CG2-CH2 4.49Å; V663-W680 HydrophobicContact CG2-CZ3 4.22Å; M666-W680 HydrophobicContact CB-CZ3 4.25Å; M666-W680 HydrophobicContact CG-CE3 4.35Å; M666-W680 HydrophobicContact CG-CZ3 3.78Å; A677-W680 WeakPolarHBondContact O-CA 3.44Å; A677-W680 PolarHBondContact O-N 3.47Å; W680-D683 PolarHBondContact O-N 3.44Å; W680-T684 VanDerWaalsContact CE2-OG1 3.3Å; W680-T684 HydrophobicContact CH2-CG2 4.32Å; W680-T684 HydrophobicContact CZ2-CG2 4.33Å; W680-T684 VanDerWaalsContact O-CB 3.26Å; W680-T684 WeakPolarHBondContact O-CB 3.35Å; W680-T684 PolarHBondContact O-N 3.1Å; W680-T684 PolarHBondContact O-OG1 2.93Å
681	I	94.7	Very high	91.7	Very high	15 Å²	15	44.6 Å²	44.6	8%	0.077	24%	0.235	C	C	.	.	H	α-helix	trans	-59.4	-52.6	174.2	-70.4	160.9	0	0	0	109.7	V663 M666 A677 S678 D683 T684 I685	V663-I681 HydrophobicContact CG1-CG2 4.15Å; M666-I681 HydrophobicContact CB-CD1 3.95Å; M666-I681 HydrophobicContact CB-CG1 4.04Å; A677-I681 HydrophobicContact CB-CD1 3.75Å; A677-I681 HydrophobicContact CB-CG1 4.43Å; A677-I681 WeakPolarHBondContact O-CG1 3.15Å; A677-I681 PolarHBondContact O-N 3.43Å; S678-I681 PolarHBondContact O-N 2.88Å; I681-D683 PolarHBondContact O-N 3.23Å; I681-T684 PolarHBondContact O-N 2.85Å; I681-T684 VanDerWaalsContact O-N 3.13Å; I681-I685 HydrophobicContact CG2-CD1 3.67Å; I681-I685 HydrophobicContact CG2-CG1 4.41Å; I681-I685 VanDerWaalsContact O-CG1 3.32Å; I681-I685 WeakPolarHBondContact O-CG1 3.17Å; I681-I685 PolarHBondContact O-N 3Å
682	K	93.7	Very high	92.2	Very high	106 Å²	106	48.1 Å²	48.1	46%	0.461	24%	0.24	S	C	.	.	H	α-helix	trans	-56.4	-49.1	178	-174.1	174.9	179.3	-176.4	0	111.8	E573 S678 T684 I685 Y686	E573-K682 IonicContact OE1-NZ 2.83Å; E573-K682 PolarHBondContact OE1-NZ 3.34Å; E573-K682 VanDerWaalsContact OE1-NZ 3.16Å; S678-K682 WeakPolarHBondContact O-CB 3.37Å; S678-K682 PolarHBondContact O-N 2.94Å; K682-T684 VanDerWaalsContact C-N 3.31Å; K682-T684 PolarHBondContact O-N 3.19Å; K682-I685 PolarHBondContact O-N 2.9Å; K682-Y686 HydrophobicContact CD-CE2 4.26Å; K682-Y686 VanDerWaalsContact CE-CE2 3.44Å; K682-Y686 WeakPolarHBondContact CE-OH 3.35Å; K682-Y686 HydrophobicContact CG-CD2 4.38Å; K682-Y686 HydrophobicContact CG-CE2 3.85Å; K682-Y686 PolarHBondContact NZ-OH 2.74Å; K682-Y686 VanDerWaalsContact NZ-OH 3.1Å; K682-Y686 WeakPolarHBondContact O-CD2 3.45Å; K682-Y686 PolarHBondContact O-N 3.43Å; K682-Y686 VanDerWaalsContact O-N 3.12Å
683	D	92.1	Very high	92.5	Very high	28 Å²	28	44 Å²	44	15%	0.15	22%	0.221	C	C	.	.	H	α-helix	trans	-66.1	-29.3	178.2	-77.5	-64.2	0	0	0	113.6	R543 Y580 R588 A679 W680 I681 F687	R543-D683 IonicContact CZ-OD1 2.71Å; R543-D683 IonicContact NH2-OD1 2.66Å; R543-D683 PolarHBondContact NH2-OD1 2.87Å; Y580-D683 HydrophobicContact CD2-CB 4.01Å; Y580-D683 HydrophobicContact CE2-CB 4.26Å; R588-D683 IonicContact CZ-OD2 3.13Å; R588-D683 VanDerWaalsContact NH1-CG 3.27Å; R588-D683 IonicContact NH1-OD2 2.68Å; R588-D683 PolarHBondContact NH1-OD2 2.68Å; R588-D683 IonicContact NH2-OD2 3.35Å; R588-D683 PolarHBondContact NH2-OD2 3.16Å; A679-D683 WeakPolarHBondContact O-CB 3.31Å; A679-D683 PolarHBondContact O-N 2.91Å; A679-D683 VanDerWaalsContact O-N 3.11Å; W680-D683 PolarHBondContact O-N 3.44Å; I681-D683 PolarHBondContact O-N 3.23Å; D683-F687 PolarHBondContact O-N 3.16Å
684	T	93.9	Very high	92.7	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-79.1	-34.4	176.6	-55.1	0	0	0	0	111.8	L585 F659 V663 W680 I681 K682 F687 L688	L585-T684 HydrophobicContact CD1-CG2 4.47Å; F659-T684 HydrophobicContact CB-CG2 3.84Å; F659-T684 HydrophobicContact CD1-CG2 3.83Å; F659-T684 HydrophobicContact CG-CG2 4.2Å; V663-T684 HydrophobicContact CG2-CG2 3.53Å; W680-T684 VanDerWaalsContact CE2-OG1 3.3Å; W680-T684 HydrophobicContact CH2-CG2 4.32Å; W680-T684 HydrophobicContact CZ2-CG2 4.33Å; W680-T684 VanDerWaalsContact O-CB 3.26Å; W680-T684 WeakPolarHBondContact O-CB 3.35Å; W680-T684 PolarHBondContact O-N 3.1Å; W680-T684 PolarHBondContact O-OG1 2.93Å; I681-T684 PolarHBondContact O-N 2.85Å; I681-T684 VanDerWaalsContact O-N 3.13Å; K682-T684 VanDerWaalsContact C-N 3.31Å; K682-T684 PolarHBondContact O-N 3.19Å; T684-F687 PolarHBondContact O-N 2.66Å; T684-L688 HydrophobicContact CG2-CD1 4.32Å; T684-L688 WeakPolarHBondContact O-CG 3.49Å; T684-L688 PolarHBondContact O-N 3.14Å
685	I	93.8	Very high	92.9	Very high	57 Å²	57	47.6 Å²	47.6	29%	0.292	23%	0.233	S	C	.	.	H	α-helix	trans	-60.9	-49	171.8	-72.3	166.6	0	0	0	109.7	V663 I681 K682 F687 L688 E689	V663-I685 HydrophobicContact CG1-CD1 4.38Å; V663-I685 HydrophobicContact CG1-CG1 4.15Å; I681-I685 HydrophobicContact CG2-CD1 3.67Å; I681-I685 HydrophobicContact CG2-CG1 4.41Å; I681-I685 VanDerWaalsContact O-CG1 3.32Å; I681-I685 WeakPolarHBondContact O-CG1 3.17Å; I681-I685 PolarHBondContact O-N 3Å; K682-I685 PolarHBondContact O-N 2.9Å; I685-F687 VanDerWaalsContact C-N 3.28Å; I685-F687 PolarHBondContact O-N 3.38Å; I685-L688 PolarHBondContact O-N 3.32Å; I685-E689 HydrophobicContact CG2-CG 4.21Å; I685-E689 VanDerWaalsContact CG2-OE1 3.25Å; I685-E689 WeakPolarHBondContact CG2-OE1 3.43Å; I685-E689 WeakPolarHBondContact O-CG 3.44Å; I685-E689 PolarHBondContact O-N 2.98Å
686	Y	92.5	Very high	93.1	Very high	34 Å²	34	43 Å²	43	13%	0.133	22%	0.221	C	C	.	.	H	α-helix	trans	-58.6	-36.9	175.1	-66.9	-29.5	0	0	0	113.6	P571 E573 K682 T690	P571-Y686 HydrophobicContact CB-CD1 3.98Å; P571-Y686 HydrophobicContact CB-CE1 3.74Å; P571-Y686 HydrophobicContact CG-CD1 3.53Å; P571-Y686 HydrophobicContact CG-CE1 3.85Å; P571-Y686 HydrophobicContact CG-CG 4.34Å; E573-Y686 HydrophobicContact CB-CE2 4Å; E573-Y686 PolarHBondContact OE1-OH 3.1Å; E573-Y686 PolarHBondContact OE2-OH 2.85Å; K682-Y686 HydrophobicContact CD-CE2 4.26Å; K682-Y686 VanDerWaalsContact CE-CE2 3.44Å; K682-Y686 WeakPolarHBondContact CE-OH 3.35Å; K682-Y686 HydrophobicContact CG-CD2 4.38Å; K682-Y686 HydrophobicContact CG-CE2 3.85Å; K682-Y686 PolarHBondContact NZ-OH 2.74Å; K682-Y686 VanDerWaalsContact NZ-OH 3.1Å; K682-Y686 WeakPolarHBondContact O-CD2 3.45Å; K682-Y686 PolarHBondContact O-N 3.43Å; K682-Y686 VanDerWaalsContact O-N 3.12Å; Y686-T690 WeakPolarHBondContact O-CB 3.28Å; Y686-T690 VanDerWaalsContact O-CG2 3.25Å; Y686-T690 WeakPolarHBondContact O-CG2 3.43Å; Y686-T690 PolarHBondContact O-N 3.47Å; Y686-T690 VanDerWaalsContact O-N 3.08Å; Y686-T690 PolarHBondContact O-OG1 3.3Å
687	F	92.9	Very high	93.2	Very high	7 Å²	7	40 Å²	40	3%	0.031	21%	0.205	C	C	.	.	H	α-helix	trans	-64.8	-45.5	171.9	171.5	-97.8	0	0	0	112.3	V530 L531 V579 Y580 E582 L585 F659 D683 T684 I685 T690 F691	V530-F687 HydrophobicContact CG1-CD2 4.2Å; V530-F687 HydrophobicContact CG1-CE2 4.21Å; L531-F687 HydrophobicContact CD1-CZ 4.35Å; V579-F687 VanDerWaalsContact CG1-CA 3.5Å; V579-F687 HydrophobicContact CG1-CB 3.61Å; V579-F687 HydrophobicContact CG1-CD2 3.71Å; V579-F687 HydrophobicContact CG1-CG 4.15Å; Y580-F687 WeakPolarHBondContact O-CD2 3.42Å; E582-F687 HydrophobicContact CB-CE2 4.42Å; E582-F687 HydrophobicContact CB-CZ 4.01Å; E582-F687 HydrophobicContact CG-CZ 4.12Å; L585-F687 HydrophobicContact CD1-CB 3.58Å; L585-F687 HydrophobicContact CD1-CD1 3.64Å; L585-F687 HydrophobicContact CD1-CD2 4.05Å; L585-F687 HydrophobicContact CD1-CE1 4.32Å; L585-F687 HydrophobicContact CD1-CG 3.48Å; L585-F687 VanDerWaalsContact CD1-CG 3.48Å; F659-F687 HydrophobicContact CD2-CE1 4.19Å; F659-F687 HydrophobicContact CE2-CE1 4.44Å; D683-F687 PolarHBondContact O-N 3.16Å; T684-F687 PolarHBondContact O-N 2.66Å; I685-F687 VanDerWaalsContact C-N 3.28Å; I685-F687 PolarHBondContact O-N 3.38Å; F687-T690 PolarHBondContact O-OG1 3.34Å; F687-T690 VanDerWaalsContact O-OG1 3.14Å; F687-F691 WeakPolarHBondContact O-CB 2.77Å; F687-F691 PolarHBondContact O-N 2.95Å
688	L	93.1	Very high	93.2	Very high	42 Å²	42	40.3 Å²	40.3	22%	0.22	21%	0.207	C	C	.	.	H	α-helix	trans	-63.9	-43.9	178.5	-74.5	169	0	0	0	112.4	F659 L660 V663 T684 I685 Q692	F659-L688 HydrophobicContact CB-CD1 4.22Å; F659-L688 HydrophobicContact CB-CD2 4.08Å; F659-L688 HydrophobicContact CB-CG 4.32Å; L660-L688 HydrophobicContact CB-CD1 4.22Å; V663-L688 HydrophobicContact CG2-CD1 4.46Å; T684-L688 HydrophobicContact CG2-CD1 4.32Å; T684-L688 WeakPolarHBondContact O-CG 3.49Å; T684-L688 PolarHBondContact O-N 3.14Å; I685-L688 PolarHBondContact O-N 3.32Å; L688-Q692 WeakPolarHBondContact O-CB 3.32Å; L688-Q692 PolarHBondContact O-N 2.67Å
689	E	92.3	Very high	93.3	Very high	84 Å²	84	39.7 Å²	39.7	39%	0.393	21%	0.206	S	C	.	.	H	α-helix	trans	-62.4	-50.4	177.8	-71.5	168.9	169.2	0	0	111.5	I685 Q692 A693	I685-E689 HydrophobicContact CG2-CG 4.21Å; I685-E689 VanDerWaalsContact CG2-OE1 3.25Å; I685-E689 WeakPolarHBondContact CG2-OE1 3.43Å; I685-E689 WeakPolarHBondContact O-CG 3.44Å; I685-E689 PolarHBondContact O-N 2.98Å; E689-Q692 PolarHBondContact O-N 3.14Å; E689-A693 WeakPolarHBondContact O-CB 3.41Å; E689-A693 PolarHBondContact O-N 3.35Å
690	T	92.7	Very high	93.3	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-66.8	-37.7	178.7	55.9	0	0	0	0	112.9	L546 I570 A574 V579 Y686 F687 A694	L546-T690 HydrophobicContact CD1-CG2 4.12Å; I570-T690 HydrophobicContact CG2-CG2 3.77Å; A574-T690 HydrophobicContact CB-CG2 3.64Å; V579-T690 HydrophobicContact CG2-CG2 3.85Å; Y686-T690 WeakPolarHBondContact O-CB 3.28Å; Y686-T690 VanDerWaalsContact O-CG2 3.25Å; Y686-T690 WeakPolarHBondContact O-CG2 3.43Å; Y686-T690 PolarHBondContact O-N 3.47Å; Y686-T690 VanDerWaalsContact O-N 3.08Å; Y686-T690 PolarHBondContact O-OG1 3.3Å; F687-T690 PolarHBondContact O-OG1 3.34Å; F687-T690 VanDerWaalsContact O-OG1 3.14Å; T690-A694 WeakPolarHBondContact O-CB 3.38Å; T690-A694 PolarHBondContact O-N 3.06Å
691	F	92.5	Very high	93.2	Very high	53 Å²	53	39.2 Å²	39.2	23%	0.232	20%	0.195	C	C	.	.	H	α-helix	trans	-68.8	-40.6	175.6	-175.5	-96.3	0	0	0	111.9	R527 V530 L531 F687 A694 Q695	R527-F691 HydrophobicContact CG-CD2 4.29Å; R527-F691 HydrophobicContact CG-CE2 3.87Å; V530-F691 HydrophobicContact CG1-CB 4.36Å; L531-F691 HydrophobicContact CD1-CD2 4.49Å; L531-F691 HydrophobicContact CD1-CE2 3.94Å; F687-F691 WeakPolarHBondContact O-CB 2.77Å; F687-F691 PolarHBondContact O-N 2.95Å; F691-A694 PolarHBondContact O-N 3.5Å; F691-Q695 WeakPolarHBondContact O-CB 3.32Å; F691-Q695 PolarHBondContact O-N 2.85Å
692	Q	93.3	Very high	93.1	Very high	118 Å²	118	41.1 Å²	41.1	55%	0.551	21%	0.206	S	C	*	.	H	α-helix	trans	-63.3	-45.8	174.2	-178.9	176.9	-7.4	0	0	111	L688 E689 A694 Q695 L696	L688-Q692 WeakPolarHBondContact O-CB 3.32Å; L688-Q692 PolarHBondContact O-N 2.67Å; E689-Q692 PolarHBondContact O-N 3.14Å; Q692-A694 VanDerWaalsContact C-N 3.33Å; Q692-A694 PolarHBondContact O-N 3.49Å; Q692-Q695 PolarHBondContact O-N 3.33Å; Q692-L696 HydrophobicContact CG-CD1 4.11Å; Q692-L696 HydrophobicContact CG-CG 4.47Å; Q692-L696 WeakPolarHBondContact O-CB 3.39Å; Q692-L696 WeakPolarHBondContact O-CG 3.12Å; Q692-L696 PolarHBondContact O-N 3.46Å
693	A	92.4	Very high	93.1	Very high	5 Å²	5	38.8 Å²	38.8	4%	0.041	21%	0.206	C	C	.	.	H	α-helix	trans	-58.5	-44.7	174.2	0	0	0	0	0	111.5	I570 E689 Q695 L696 L697	I570-A693 HydrophobicContact CD1-CB 4.36Å; I570-A693 HydrophobicContact CG1-CB 4.05Å; E689-A693 WeakPolarHBondContact O-CB 3.41Å; E689-A693 PolarHBondContact O-N 3.35Å; A693-Q695 PolarHBondContact O-N 3.31Å; A693-L696 PolarHBondContact O-N 3.11Å; A693-L697 WeakPolarHBondContact O-CG 3.37Å; A693-L697 PolarHBondContact O-N 2.86Å
694	A	92.5	Very high	93	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-62.8	-38.5	175	0	0	0	0	0	113	F526 R527 T690 F691 Q692 L697 V698	F526-A694 HydrophobicContact CD1-CB 3.58Å; F526-A694 HydrophobicContact CE1-CB 3.72Å; R527-A694 HydrophobicContact CB-CB 3.87Å; R527-A694 HydrophobicContact CG-CB 4.09Å; T690-A694 WeakPolarHBondContact O-CB 3.38Å; T690-A694 PolarHBondContact O-N 3.06Å; F691-A694 PolarHBondContact O-N 3.5Å; Q692-A694 VanDerWaalsContact C-N 3.33Å; Q692-A694 PolarHBondContact O-N 3.49Å; A694-L697 PolarHBondContact O-N 2.94Å; A694-V698 WeakPolarHBondContact O-CG2 3.47Å; A694-V698 PolarHBondContact O-N 3.16Å; A694-V698 VanDerWaalsContact O-N 3.1Å
695	Q	93.7	Very high	92.8	Very high	106 Å²	106	42.2 Å²	42.2	50%	0.495	22%	0.223	S	C	.	.	H	α-helix	trans	-68.3	-39.5	176	-175.2	173.7	2.6	0	0	112	F691 Q692 A693 V698 A699	F691-Q695 WeakPolarHBondContact O-CB 3.32Å; F691-Q695 PolarHBondContact O-N 2.85Å; Q692-Q695 PolarHBondContact O-N 3.33Å; A693-Q695 PolarHBondContact O-N 3.31Å; Q695-V698 PolarHBondContact O-N 3.32Å; Q695-A699 WeakPolarHBondContact O-CB 3.39Å; Q695-A699 PolarHBondContact O-N 2.9Å
696	L	95.1	Very high	92.6	Very high	70 Å²	70	45.6 Å²	45.6	37%	0.366	24%	0.236	S	C	.	.	H	α-helix	trans	-67.1	-37.7	174.9	-69.9	171.6	0	0	0	111.9	L566 Q692 A693 A699 H700	L566-L696 HydrophobicContact CD1-CB 3.76Å; L566-L696 HydrophobicContact CD2-CB 4.09Å; L566-L696 HydrophobicContact CD2-CD1 3.86Å; Q692-L696 HydrophobicContact CG-CD1 4.11Å; Q692-L696 HydrophobicContact CG-CG 4.47Å; Q692-L696 WeakPolarHBondContact O-CB 3.39Å; Q692-L696 WeakPolarHBondContact O-CG 3.12Å; Q692-L696 PolarHBondContact O-N 3.46Å; A693-L696 PolarHBondContact O-N 3.11Å; L696-A699 PolarHBondContact O-N 3.08Å; L696-H700 WeakPolarHBondContact O-CB 3.28Å; L696-H700 PolarHBondContact O-N 3.38Å
697	L	92.8	Very high	92.4	Very high	1 Å²	1	54 Å²	54	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-61.2	-44.9	171.7	-74.1	173	0	0	0	111.9	F526 L553 V563 L566 A693 A694 H700 A701	F526-L697 HydrophobicContact CD1-CD1 4.4Å; F526-L697 HydrophobicContact CE1-CD1 4.49Å; L553-L697 HydrophobicContact CD1-CD1 4.14Å; V563-L697 HydrophobicContact CB-CD2 4.31Å; V563-L697 HydrophobicContact CG1-CD2 3.93Å; V563-L697 HydrophobicContact CG2-CD2 4.11Å; L566-L697 HydrophobicContact CB-CD2 4.19Å; L566-L697 HydrophobicContact CB-CG 4.48Å; L566-L697 HydrophobicContact CD1-CD2 3.74Å; L566-L697 HydrophobicContact CD1-CG 3.89Å; A693-L697 WeakPolarHBondContact O-CG 3.37Å; A693-L697 PolarHBondContact O-N 2.86Å; A694-L697 PolarHBondContact O-N 2.94Å; L697-H700 PolarHBondContact O-N 3.06Å; L697-A701 WeakPolarHBondContact O-CB 3.24Å; L697-A701 PolarHBondContact O-N 3.13Å
698	V	94	Very high	92.1	Very high	5 Å²	5	54.7 Å²	54.7	3%	0.03	27%	0.272	C	S	.	.	H	α-helix	trans	-64.4	-44	175.7	175.6	0	0	0	0	111	R524 A694 Q695 H700 A701 D702	R524-V698 HydrophobicContact CB-CG2 4.48Å; A694-V698 WeakPolarHBondContact O-CG2 3.47Å; A694-V698 PolarHBondContact O-N 3.16Å; A694-V698 VanDerWaalsContact O-N 3.1Å; Q695-V698 PolarHBondContact O-N 3.32Å; V698-H700 VanDerWaalsContact C-N 3.33Å; V698-H700 PolarHBondContact O-N 3.07Å; V698-A701 PolarHBondContact O-N 2.93Å; V698-D702 PolarHBondContact O-N 2.68Å
699	A	94.5	Very high	91.6	Very high	52 Å²	52	57.9 Å²	57.9	43%	0.43	29%	0.287	S	S	.	.	H	α-helix	trans	-64	-37	178.6	0	0	0	0	0	112.6	Q695 L696 A703	Q695-A699 WeakPolarHBondContact O-CB 3.39Å; Q695-A699 PolarHBondContact O-N 2.9Å; L696-A699 PolarHBondContact O-N 3.08Å; A699-A703 WeakPolarHBondContact O-CB 3.47Å; A699-A703 PolarHBondContact O-N 3.28Å
700	H	93.2	Very high	90.9	Very high	41 Å²	41	65.8 Å²	65.8	19%	0.19	32%	0.315	C	S	.	.	H	α-helix	trans	-65.4	-44.6	171.9	179	-100.7	0	0	0	111.5	D560 F562 L696 L697 V698 D702 A703 T704	D560-H700 IonicContact OD2-CE1 3.68Å; F562-H700 HydrophobicContact CD1-CB 3.86Å; F562-H700 AromaticContact CD1-CD2 3.34Å; F562-H700 WeakPolarHBondContact CD1-CD2 3.13Å; F562-H700 AromaticContact CD1-CG 3.52Å; F562-H700 AromaticContact CD1-NE2 3.87Å; F562-H700 HydrophobicContact CE1-CB 3.6Å; F562-H700 AromaticContact CE1-CD2 3.83Å; F562-H700 AromaticContact CE1-CG 3.81Å; F562-H700 AromaticContact CG-CD2 4Å; L696-H700 WeakPolarHBondContact O-CB 3.28Å; L696-H700 PolarHBondContact O-N 3.38Å; L697-H700 PolarHBondContact O-N 3.06Å; V698-H700 VanDerWaalsContact C-N 3.33Å; V698-H700 PolarHBondContact O-N 3.07Å; H700-D702 VanDerWaalsContact C-N 3.35Å; H700-D702 PolarHBondContact O-N 2.62Å; H700-A703 PolarHBondContact O-N 2.85Å; H700-A703 VanDerWaalsContact O-N 3.14Å; H700-T704 WeakPolarHBondContact O-CG2 3.34Å; H700-T704 PolarHBondContact O-N 2.71Å; H700-T704 PolarHBondContact O-OG1 3.45Å
701	A	92.2	Very high	90.8	Very high	0 Å²	0	69.1 Å²	69.1	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-63.1	-38.5	175.9	0	0	0	0	0	112.7	L519 W520 L697 V698 A703 T704 F705	L519-A701 HydrophobicContact CB-CB 4.4Å; L519-A701 HydrophobicContact CD2-CB 4.1Å; L519-A701 HydrophobicContact CG-CB 3.89Å; W520-A701 HydrophobicContact CB-CB 3.8Å; W520-A701 HydrophobicContact CG-CB 4.43Å; L697-A701 WeakPolarHBondContact O-CB 3.24Å; L697-A701 PolarHBondContact O-N 3.13Å; V698-A701 PolarHBondContact O-N 2.93Å; A701-A703 VanDerWaalsContact C-N 3.34Å; A701-T704 PolarHBondContact O-OG1 3.3Å; A701-F705 WeakPolarHBondContact O-CB 3.28Å; A701-F705 PolarHBondContact O-N 2.94Å
702	D	92.7	Very high	90.7	Very high	55 Å²	55	69.9 Å²	69.9	29%	0.294	34%	0.336	S	S	.	.	H	α-helix	trans	-64.4	-37.6	171.9	-81.6	-42.7	0	0	0	111.8	W520 V698 H700 K706	W520-D702 VanDerWaalsContact CD1-OD1 3.23Å; W520-D702 PolarHBondContact NE1-OD1 3.08Å; V698-D702 PolarHBondContact O-N 2.68Å; H700-D702 VanDerWaalsContact C-N 3.35Å; H700-D702 PolarHBondContact O-N 2.62Å; D702-K706 WeakPolarHBondContact O-CB 3.39Å; D702-K706 WeakPolarHBondContact O-CD 3.11Å; D702-K706 VanDerWaalsContact O-CG 3.23Å; D702-K706 WeakPolarHBondContact O-CG 3.41Å; D702-K706 PolarHBondContact O-N 3.46Å
703	A	92.6	Very high	90.6	Very high	57 Å²	57	67.2 Å²	67.2	47%	0.471	32%	0.324	S	S	.	.	H	α-helix	trans	-72.1	-44.3	178.6	0	0	0	0	0	112.4	A699 H700 A701 K706 R707	A699-A703 WeakPolarHBondContact O-CB 3.47Å; A699-A703 PolarHBondContact O-N 3.28Å; H700-A703 PolarHBondContact O-N 2.85Å; H700-A703 VanDerWaalsContact O-N 3.14Å; A701-A703 VanDerWaalsContact C-N 3.34Å; A703-K706 PolarHBondContact O-N 2.87Å; A703-R707 WeakPolarHBondContact O-CB 3.28Å; A703-R707 PolarHBondContact O-N 2.92Å
704	T	90.6	Very high	90.4	Very high	39 Å²	39	70.9 Å²	70.9	24%	0.239	34%	0.34	C	S	.	.	H	α-helix	trans	-66.8	-40.6	174.3	57.1	0	0	0	0	110.9	H700 A701 K706 R707 T708	H700-T704 WeakPolarHBondContact O-CG2 3.34Å; H700-T704 PolarHBondContact O-N 2.71Å; H700-T704 PolarHBondContact O-OG1 3.45Å; A701-T704 PolarHBondContact O-OG1 3.3Å; T704-K706 PolarHBondContact O-N 3.27Å; T704-R707 CarbonylContact O-C 3.38Å; T704-R707 PolarHBondContact O-N 2.89Å; T704-T708 WeakPolarHBondContact O-CG2 3.46Å; T704-T708 PolarHBondContact O-N 2.85Å; T704-T708 PolarHBondContact O-OG1 3.42Å
705	F	89.8	Confident	90.3	Very high	60 Å²	60	75.3 Å²	75.3	26%	0.263	36%	0.362	S	S	.	.	H	α-helix	trans	-57.7	-49.4	173.6	175.1	-114.6	0	0	0	111.7	A516 K517 A701 R707 T708 M709	A516-F705 HydrophobicContact CB-CB 4.12Å; K517-F705 HydrophobicContact CD-CE2 4.28Å; K517-F705 HydrophobicContact CG-CD2 3.99Å; K517-F705 HydrophobicContact CG-CE2 3.95Å; A701-F705 WeakPolarHBondContact O-CB 3.28Å; A701-F705 PolarHBondContact O-N 2.94Å; F705-R707 VanDerWaalsContact C-N 3.33Å; F705-R707 PolarHBondContact O-N 3.24Å; F705-T708 PolarHBondContact O-N 3.48Å; F705-T708 VanDerWaalsContact O-N 3.1Å; F705-T708 PolarHBondContact O-OG1 2.95Å; F705-M709 HydrophobicContact CD2-CG 4.36Å; F705-M709 HydrophobicContact CE1-CG 4.3Å; F705-M709 HydrophobicContact CE2-CG 3.81Å; F705-M709 HydrophobicContact CE2-SD 4.07Å; F705-M709 HydrophobicContact CZ-CG 3.78Å; F705-M709 HydrophobicContact CZ-SD 4.08Å; F705-M709 WeakPolarHBondContact O-CG 3.24Å; F705-M709 PolarHBondContact O-N 2.77Å
706	K	90	Very high	90.1	Very high	129 Å²	129	73.3 Å²	73.3	56%	0.561	35%	0.353	S	S	*	.	H	α-helix	trans	-58.5	-42.8	174.9	-74.8	168.5	-174.5	174.1	0	112.2	D702 A703 T704 T708 M709 Y710	D702-K706 WeakPolarHBondContact O-CB 3.39Å; D702-K706 WeakPolarHBondContact O-CD 3.11Å; D702-K706 VanDerWaalsContact O-CG 3.23Å; D702-K706 WeakPolarHBondContact O-CG 3.41Å; D702-K706 PolarHBondContact O-N 3.46Å; A703-K706 PolarHBondContact O-N 2.87Å; T704-K706 PolarHBondContact O-N 3.27Å; K706-T708 PolarHBondContact O-N 3.14Å; K706-M709 PolarHBondContact O-N 3.36Å; K706-M709 VanDerWaalsContact O-N 3.09Å; K706-Y710 WeakPolarHBondContact O-CD2 3.34Å; K706-Y710 PolarHBondContact O-N 3.21Å; K706-Y710 VanDerWaalsContact O-N 3.17Å
707	R	88.4	Confident	89.7	Confident	209 Å²	209	73.5 Å²	73.5	79%	0.789	35%	0.352	S	S	*	.	H	α-helix	trans	-66.8	-17.9	177	-177.3	173.2	178.8	160.8	3	114.5	A703 T704 F705	A703-R707 WeakPolarHBondContact O-CB 3.28Å; A703-R707 PolarHBondContact O-N 2.92Å; T704-R707 CarbonylContact O-C 3.38Å; T704-R707 PolarHBondContact O-N 2.89Å; F705-R707 VanDerWaalsContact C-N 3.33Å; F705-R707 PolarHBondContact O-N 3.24Å
708	T	86	Confident	89.5	Confident	23 Å²	23	79.1 Å²	79.1	14%	0.141	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-4.2	172.9	61.7	0	0	0	0	113.3	Q512 N513 T704 F705 K706	Q512-T708 HydrophobicContact CB-CG2 3.64Å; N513-T708 WeakPolarHBondContact CA-OG1 3.38Å; N513-T708 PolarHBondContact ND2-OG1 2.93Å; T704-T708 WeakPolarHBondContact O-CG2 3.46Å; T704-T708 PolarHBondContact O-N 2.85Å; T704-T708 PolarHBondContact O-OG1 3.42Å; F705-T708 PolarHBondContact O-N 3.48Å; F705-T708 VanDerWaalsContact O-N 3.1Å; F705-T708 PolarHBondContact O-OG1 2.95Å; K706-T708 PolarHBondContact O-N 3.14Å
709	M	82.2	Confident	89.1	Confident	108 Å²	108	85.3 Å²	85.3	53%	0.532	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103	-24.8	177.3	-74.5	-68.2	-52.4	0	0	113	N513 F705 K706	N513-M709 WeakPolarHBondContact ND2-CG 3.32Å; N513-M709 PolarHBondContact ND2-SD 2.73Å; F705-M709 HydrophobicContact CD2-CG 4.36Å; F705-M709 HydrophobicContact CE1-CG 4.3Å; F705-M709 HydrophobicContact CE2-CG 3.81Å; F705-M709 HydrophobicContact CE2-SD 4.07Å; F705-M709 HydrophobicContact CZ-CG 3.78Å; F705-M709 HydrophobicContact CZ-SD 4.08Å; F705-M709 WeakPolarHBondContact O-CG 3.24Å; F705-M709 PolarHBondContact O-N 2.77Å; K706-M709 PolarHBondContact O-N 3.36Å; K706-M709 VanDerWaalsContact O-N 3.09Å
710	Y	77.5	Confident	88.6	Confident	250 Å²	250	88.3 Å²	88.3	98%	0.98	41%	0.405	S	S	*	.			trans	-128.9	0	-179.1	-59.3	-78.2	0	0	0	110	K706	K706-Y710 WeakPolarHBondContact O-CD2 3.34Å; K706-Y710 PolarHBondContact O-N 3.21Å; K706-Y710 VanDerWaalsContact O-N 3.17Å

Retrieved 710 of 710 residues in 258 ms (Link to these results)

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