A0A077YX41_TRITR Loading...

Beclin 1-associated autophagy-related key regulat or

AlphaFold DB , UniProt , Accession A0A077YX41, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 460 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.2	Very low	38.1	Very low	245 Å²	245	140.3 Å²	140.3	100%	1.207	85%	0.846	S	S	*	*				0	93.7	0	-75.9	172.8	168.7	0	0	106.5
2	S	40.2	Very low	37.8	Very low	119 Å²	119	145.1 Å²	145.1	83%	0.832	85%	0.853	S	S	*	*			trans	-139.2	115.5	170.2	-64.6	0	0	0	0	104.4
3	D	38.5	Very low	37.1	Very low	174 Å²	174	148.7 Å²	148.7	93%	0.93	86%	0.856	S	S	*	*			trans	-70.5	162.2	-177.7	-76.8	-43.4	0	0	0	111.6
4	C	36.5	Very low	37.3	Very low	104 Å²	104	147.1 Å²	147.1	70%	0.703	85%	0.853	S	S	*	*			trans	-115	147.3	-155.5	-114.8	0	0	0	0	108.8
5	F	37.4	Very low	37.2	Very low	191 Å²	191	146.1 Å²	146.1	84%	0.838	85%	0.851	S	S	*	*			trans	69.5	98.5	153.9	-78.1	-83.2	0	0	0	119.5
6	D	37.3	Very low	36.9	Very low	179 Å²	179	143.1 Å²	143.1	96%	0.957	85%	0.848	S	S	*	*			trans	-122.2	112	139.6	-93.2	-36.9	0	0	0	107.9
7	G	36.3	Very low	36.9	Very low	73 Å²	73	144.3 Å²	144.3	75%	0.753	85%	0.849	S	S	*	*			trans	-135.5	96	-180	0	0	0	0	0	109.8
8	A	37.7	Very low	36.7	Very low	96 Å²	96	149.1 Å²	149.1	79%	0.793	85%	0.85	S	S	*	*			trans	-87.8	131.7	-180	0	0	0	0	0	112.6
9	V	37.6	Very low	36.6	Very low	134 Å²	134	147.9 Å²	147.9	81%	0.812	85%	0.847	S	S	*	*			trans	53.5	129.5	136.5	-171.4	0	0	0	0	121.3
10	P	37.9	Very low	36.5	Very low	114 Å²	114	148.7 Å²	148.7	74%	0.74	84%	0.842	S	S	*	*			trans	-105.1	-161.4	170.6	45.1	-34.6	0	0	0	112.2
11	P	43.3	Very low	36.3	Very low	114 Å²	114	148.9 Å²	148.9	74%	0.74	84%	0.841	S	S	*	*				-120.1	166.2	-94.6	37.1	-19.1	0	0	0	114.1
12	E	35	Very low	36.4	Very low	198 Å²	198	142.1 Å²	142.1	93%	0.925	82%	0.818	S	S	*	*			trans	-131.9	112.8	164.2	-76	-170.1	158.6	0	0	111.3
13	E	28.9	Very low	36	Very low	192 Å²	192	144 Å²	144	90%	0.897	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-88	137.2	159.6	-71.5	180	154.1	0	0	108.7
14	P	38.9	Very low	35.7	Very low	126 Å²	126	142 Å²	142	82%	0.818	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-100.7	128	158.4	13.1	5	0	0	0	111
15	T	36.1	Very low	35.6	Very low	133 Å²	133	148 Å²	148	82%	0.816	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-55.7	148.9	177.4	40.7	0	0	0	0	115.7
16	A	33.3	Very low	35.4	Very low	97 Å²	97	145.7 Å²	145.7	80%	0.802	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-71.4	130.6	172.5	0	0	0	0	0	113.1	R18	A16-R18 PolarHBondContact O-N 2.85Å
17	D	35.6	Very low	35.1	Very low	164 Å²	164	141.9 Å²	141.9	88%	0.877	81%	0.814	S	S	*	*			trans	-75.1	107.7	166.8	-82.7	-34.4	0	0	0	110.5
18	R	33.3	Very low	35.1	Very low	230 Å²	230	144.2 Å²	144.2	87%	0.868	82%	0.815	S	S	*	*			trans	-84.9	108.6	162.8	-95.9	-178.6	165.7	166.7	-3.3	108.5	A16 E20	A16-R18 PolarHBondContact O-N 2.85Å; R18-E20 PolarHBondContact O-N 2.75Å
19	V	34.7	Very low	34.8	Very low	128 Å²	128	148.7 Å²	148.7	78%	0.776	82%	0.82	S	S	*	*			trans	-79.3	100.7	168.2	179.4	0	0	0	0	108.1	D21	V19-D21 PolarHBondContact O-N 3.34Å
20	E	35.5	Very low	34.6	Very low	162 Å²	162	147.5 Å²	147.5	76%	0.757	82%	0.818	S	S	*	*			trans	-81.6	101.9	171.1	-74.6	-173.8	156.9	0	0	110.4	R18 S22	R18-E20 PolarHBondContact O-N 2.75Å; E20-S22 PolarHBondContact O-N 3.26Å
21	D	33	Very low	34.6	Very low	153 Å²	153	147 Å²	147	82%	0.818	82%	0.817	S	S	*	*			trans	-74.4	86.3	170.5	-105	-24.6	0	0	0	110.6	V19	V19-D21 PolarHBondContact O-N 3.34Å
22	S	36.6	Very low	34.2	Very low	103 Å²	103	150.8 Å²	150.8	72%	0.72	82%	0.822	S	S	*	*			trans	-109.3	73.3	171.9	-73.7	0	0	0	0	111.4	E20	E20-S22 PolarHBondContact O-N 3.26Å
23	L	33.3	Very low	34.1	Very low	159 Å²	159	147.1 Å²	147.1	83%	0.832	81%	0.813	S	S	*	*			trans	-135.2	79.2	169.7	-80.1	168.8	0	0	0	110.7
24	C	31.9	Very low	34.5	Very low	131 Å²	131	145.4 Å²	145.4	89%	0.885	81%	0.809	S	S	*	*	S	Bend	trans	-177.3	62.1	148.8	-97.3	0	0	0	0	109.9
25	R	34	Very low	34.5	Very low	231 Å²	231	143.5 Å²	143.5	87%	0.872	81%	0.805	S	S	*	*	S	Bend	trans	-152	131.5	157.1	-110.4	169.8	-163.9	-171.1	3.2	110.6
26	N	34.3	Very low	34.7	Very low	142 Å²	142	142.5 Å²	142.5	76%	0.759	80%	0.803	S	S	*	*			trans	85.4	88.9	161.4	-51	-16.4	0	0	0	115.8	P28	N26-P28 WeakPolarHBondContact O-CD 3.1Å
27	A	29.5	Very low	35.3	Very low	100 Å²	100	144.8 Å²	144.8	83%	0.826	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-52.4	129.9	148	0	0	0	0	0	110.3
28	P	36.4	Very low	36.2	Very low	121 Å²	121	141.2 Å²	141.2	79%	0.786	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-96.4	127	153.1	25.3	-10.5	0	0	0	109.4	N26	N26-P28 WeakPolarHBondContact O-CD 3.1Å
29	E	31.4	Very low	37.5	Very low	191 Å²	191	133 Å²	133	89%	0.893	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-62.7	124.2	163.3	-61.4	168.5	143.2	0	0	109.5
30	S	34.6	Very low	38.8	Very low	109 Å²	109	134 Å²	134	76%	0.762	77%	0.767	S	S	*	*			trans	178.7	137.3	132.6	58.1	0	0	0	0	112.8
31	S	37.9	Very low	40.4	Very low	104 Å²	104	126.3 Å²	126.3	73%	0.727	73%	0.731	S	S	*	*			trans	72.7	95.8	155.3	61.6	0	0	0	0	121.2
32	K	33.8	Very low	42.1	Very low	192 Å²	192	125 Å²	125	84%	0.835	72%	0.723	S	S	*	*				79.5	112.4	117.8	-77.2	-176.3	177.6	179	0	120.3
33	V	33.7	Very low	43.3	Very low	122 Å²	122	125.1 Å²	125.1	74%	0.739	71%	0.713	S	S	*	*			trans	75.9	108	139.8	-174.3	0	0	0	0	113
34	D	36.7	Very low	45.4	Very low	155 Å²	155	119.7 Å²	119.7	83%	0.829	69%	0.688	S	S	*	*				-144.3	149.8	65.3	-86.9	-52.5	0	0	0	115
35	A	39	Very low	47	Very low	87 Å²	87	117.7 Å²	117.7	72%	0.719	67%	0.672	S	S	*	*			trans	-74.6	167	172.9	0	0	0	0	0	112
36	S	40.7	Very low	48.8	Very low	112 Å²	112	115.6 Å²	115.6	78%	0.783	66%	0.664	S	S	*	*			trans	84	84	164.9	65.1	0	0	0	0	119.1
37	T	45.3	Very low	50.2	Low	144 Å²	144	116.8 Å²	116.8	88%	0.883	66%	0.658	S	S	*	*				-176.7	91.5	115.2	25.9	0	0	0	0	108.9	A39	T37-A39 PolarHBondContact O-N 2.97Å
38	S	54.8	Low	51.6	Low	89 Å²	89	113.2 Å²	113.2	62%	0.622	63%	0.627	S	S	*	*			trans	-73.3	109.8	171.9	45.1	0	0	0	0	109.7	W47	S38-W47 WeakPolarHBondContact O-CZ3 3.31Å; S38-W47 WeakPolarHBondContact OG-CZ3 3.19Å
39	A	60.1	Low	52.8	Low	59 Å²	59	119.9 Å²	119.9	49%	0.488	64%	0.636	S	S	.	*	P	Polyproline II helix	trans	-86.8	148.9	173	0	0	0	0	0	111.4	T37 S48	T37-A39 PolarHBondContact O-N 2.97Å; A39-S48 PolarHBondContact O-N 2.92Å
40	R	63.2	Low	54.1	Low	149 Å²	149	119.3 Å²	119.3	56%	0.562	63%	0.626	S	S	*	*	B	Isolated β-bridge	trans	-84.3	137.6	171.7	-66	-179	-177.3	170.6	-0.6	109	L42 V45 W47	R40-L42 PolarHBondContact O-N 3.28Å; R40-V45 HydrophobicContact CB-CG1 4.36Å; R40-W47 HydrophobicContact CG-CE3 4.44Å
41	C	67.5	Low	55.5	Low	0 Å²	0	121.7 Å²	121.7	0%	0	62%	0.623	C	S	.	*	P	Polyproline II helix	trans	-59.6	122.8	172.2	170.1	0	0	0	0	109.5	M43 C44 V45 R46 C53	C41-M43 PolarHBondContact O-N 3.47Å; C41-C44 PolarHBondContact O-N 3.44Å; C41-V45 WeakPolarHBondContact O-CA 3.3Å; C41-V45 PolarHBondContact O-N 3.37Å; C41-R46 VanDerWaalsContact CB-O 3.3Å; C41-R46 WeakPolarHBondContact CB-O 3.4Å; C41-R46 PolarHBondContact N-O 3.44Å; C41-C53 PolarHBondContact SG-N 3.11Å; C41-C53 VanDerWaalsContact SG-N 3.44Å
42	L	69.5	Low	56.6	Low	124 Å²	124	117.6 Å²	117.6	65%	0.649	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.2	-18.8	-176.5	-67.1	177.6	0	0	0	114	R40 F51	R40-L42 PolarHBondContact O-N 3.28Å; L42-F51 HydrophobicContact CD1-CE1 3.63Å; L42-F51 HydrophobicContact CD1-CE2 4Å; L42-F51 HydrophobicContact CD1-CZ 3.31Å; L42-F51 HydrophobicContact CG-CZ 4.38Å
43	M	62.8	Low	58.3	Low	107 Å²	107	109.9 Å²	109.9	53%	0.527	56%	0.564	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95.1	-30.3	-174.9	-61.7	-62.5	-73.4	0	0	114.1	C41 C56 T60	C41-M43 PolarHBondContact O-N 3.47Å; M43-C56 HydrophobicContact CB-CB 4.16Å; M43-T60 HydrophobicContact CE-CG2 4.39Å
44	C	77.2	Confident	59.7	Low	45 Å²	45	107.3 Å²	107.3	30%	0.304	55%	0.55	S	S	.	*	T	Hydrogen-bonded Turn	trans	-128.6	0.1	-179.7	65.7	0	0	0	0	113.7	C41 R46	C41-C44 PolarHBondContact O-N 3.44Å; C44-R46 PolarHBondContact O-N 3.21Å
45	V	65.6	Low	60.9	Low	89 Å²	89	105.3 Å²	105.3	54%	0.539	54%	0.54	S	S	.	.			trans	59.2	0.7	-179	-165.9	0	0	0	0	114	R40 C41	R40-V45 HydrophobicContact CB-CG1 4.36Å; C41-V45 WeakPolarHBondContact O-CA 3.3Å; C41-V45 PolarHBondContact O-N 3.37Å
46	R	70.1	Confident	62.2	Low	187 Å²	187	102.2 Å²	102.2	71%	0.706	51%	0.513	S	S	*	.			trans	-67.7	140.6	173.9	-66.3	-176.8	177.8	-176	-0.5	110.4	C41 C44 S48	C41-R46 VanDerWaalsContact CB-O 3.3Å; C41-R46 WeakPolarHBondContact CB-O 3.4Å; C41-R46 PolarHBondContact N-O 3.44Å; C44-R46 PolarHBondContact O-N 3.21Å; R46-S48 PolarHBondContact O-N 3.45Å
47	W	64.7	Low	63.4	Low	167 Å²	167	100.3 Å²	100.3	63%	0.633	49%	0.493	S	S	*	.	B	Isolated β-bridge	trans	-58.1	123.4	175.5	-64	93.9	0	0	0	109.9	S38 R40	S38-W47 WeakPolarHBondContact O-CZ3 3.31Å; S38-W47 WeakPolarHBondContact OG-CZ3 3.19Å; R40-W47 HydrophobicContact CG-CE3 4.44Å
48	S	59.2	Low	64	Low	25 Å²	25	95.7 Å²	95.7	18%	0.175	46%	0.463	C	S	.	.			trans	-144.8	135.7	-178.2	170.1	0	0	0	0	108.4	A39 R46 R50	A39-S48 PolarHBondContact O-N 2.92Å; R46-S48 PolarHBondContact O-N 3.45Å; S48-R50 VanDerWaalsContact CB-O 3.31Å; S48-R50 WeakPolarHBondContact CB-O 3.32Å; S48-R50 PolarHBondContact O-N 3.24Å; S48-R50 PolarHBondContact OG-N 3.1Å; S48-R50 VanDerWaalsContact OG-N 3.1Å; S48-R50 PolarHBondContact OG-O 3.06Å
49	R	61.5	Low	64.2	Low	261 Å²	261	97.7 Å²	97.7	99%	0.985	47%	0.466	S	S	*	.	S	Bend	trans	-67.2	-12.9	172	-70.4	-173.1	177.1	-174.3	-0.1	112.7
50	R	59.3	Low	64	Low	178 Å²	178	98.8 Å²	98.8	67%	0.672	47%	0.467	S	S	*	.	S	Bend	trans	-114.6	151.2	178.3	-56.4	-177.8	-162.1	172	5.4	110.4	S48 C52	S48-R50 VanDerWaalsContact CB-O 3.31Å; S48-R50 WeakPolarHBondContact CB-O 3.32Å; S48-R50 PolarHBondContact O-N 3.24Å; S48-R50 PolarHBondContact OG-N 3.1Å; S48-R50 VanDerWaalsContact OG-N 3.1Å; S48-R50 PolarHBondContact OG-O 3.06Å; R50-C52 PolarHBondContact O-N 3.22Å
51	F	63.1	Low	63.8	Low	159 Å²	159	98.7 Å²	98.7	70%	0.697	47%	0.471	S	S	*	.	S	Bend	trans	-48.5	-37.5	-179.1	-163.1	-96.6	0	0	0	113.8	L42	L42-F51 HydrophobicContact CD1-CE1 3.63Å; L42-F51 HydrophobicContact CD1-CE2 4Å; L42-F51 HydrophobicContact CD1-CZ 3.31Å; L42-F51 HydrophobicContact CG-CZ 4.38Å
52	C	61.7	Low	63.5	Low	18 Å²	18	100 Å²	100	12%	0.122	48%	0.484	C	S	.	.	S	Bend	trans	-133.7	146	171.6	-73.6	0	0	0	0	111.9	R50 I57	R50-C52 PolarHBondContact O-N 3.22Å; C52-I57 HydrophobicContact CB-CD1 4.09Å; C52-I57 HydrophobicContact CB-CG1 4.01Å
53	C	68.9	Low	63.5	Low	30 Å²	30	99.5 Å²	99.5	20%	0.203	48%	0.477	C	S	.	.			trans	-73.1	154.3	177.6	82.8	0	0	0	0	111.9	C41 N55 C56 I57	C41-C53 PolarHBondContact SG-N 3.11Å; C41-C53 VanDerWaalsContact SG-N 3.44Å; C53-N55 PolarHBondContact O-N 3.12Å; C53-C56 PolarHBondContact O-N 3.48Å; C53-C56 VanDerWaalsContact O-N 3.11Å; C53-C56 PolarHBondContact SG-N 3.41Å; C53-C56 VanDerWaalsContact SG-N 3.44Å; C53-C56 PolarHBondContact SG-SG 3.29Å; C53-I57 PolarHBondContact O-N 2.71Å; C53-I57 VanDerWaalsContact O-N 3.09Å
54	C	63.3	Low	64	Low	68 Å²	68	102.8 Å²	102.8	46%	0.459	48%	0.484	S	S	.	.	H	α-helix	trans	-58.4	-31.8	-177.2	-59.1	0	0	0	0	113.4	N58	C54-N58 WeakPolarHBondContact O-CB 3.26Å; C54-N58 VanDerWaalsContact O-CG 3.24Å; C54-N58 PolarHBondContact O-N 3.13Å; C54-N58 VanDerWaalsContact O-N 3.12Å; C54-N58 PolarHBondContact O-ND2 3.43Å; C54-N58 VanDerWaalsContact O-ND2 3.13Å
55	N	61.9	Low	64.1	Low	114 Å²	114	107.2 Å²	107.2	61%	0.61	50%	0.5	S	S	*	.	H	α-helix	trans	-69.9	-44.8	176.4	-72.7	11.5	0	0	0	111.2	C53 I57 N58 D59	C53-N55 PolarHBondContact O-N 3.12Å; N55-I57 PolarHBondContact O-N 3.09Å; N55-N58 PolarHBondContact O-N 3.07Å; N55-D59 PolarHBondContact O-N 2.9Å
56	C	66.7	Low	64.8	Low	22 Å²	22	110.7 Å²	110.7	15%	0.149	51%	0.508	C	S	.	.	H	α-helix	trans	-62.4	-44	176.9	-65.7	0	0	0	0	111.7	M43 C53 N58 D59 T60	M43-C56 HydrophobicContact CB-CB 4.16Å; C53-C56 PolarHBondContact O-N 3.48Å; C53-C56 VanDerWaalsContact O-N 3.11Å; C53-C56 PolarHBondContact SG-N 3.41Å; C53-C56 VanDerWaalsContact SG-N 3.44Å; C53-C56 PolarHBondContact SG-SG 3.29Å; C56-N58 VanDerWaalsContact C-N 3.32Å; C56-N58 PolarHBondContact O-N 2.56Å; C56-D59 PolarHBondContact O-N 2.88Å; C56-T60 WeakPolarHBondContact O-CB 3.46Å; C56-T60 PolarHBondContact O-N 3.5Å; C56-T60 PolarHBondContact O-OG1 2.95Å
57	I	65	Low	65.3	Low	72 Å²	72	107.8 Å²	107.8	37%	0.369	50%	0.501	S	S	.	.	H	α-helix	trans	-62.1	-39.6	177.3	-78.7	169.3	0	0	0	112	C52 C53 N55	C52-I57 HydrophobicContact CB-CD1 4.09Å; C52-I57 HydrophobicContact CB-CG1 4.01Å; C53-I57 PolarHBondContact O-N 2.71Å; C53-I57 VanDerWaalsContact O-N 3.09Å; N55-I57 PolarHBondContact O-N 3.09Å
58	N	57.6	Low	66.1	Low	46 Å²	46	102.6 Å²	102.6	25%	0.246	49%	0.493	C	S	.	.	H	α-helix	trans	-72.5	-38.1	-178.4	-78.2	-27.8	0	0	0	113.1	C54 N55 C56	C54-N58 WeakPolarHBondContact O-CB 3.26Å; C54-N58 VanDerWaalsContact O-CG 3.24Å; C54-N58 PolarHBondContact O-N 3.13Å; C54-N58 VanDerWaalsContact O-N 3.12Å; C54-N58 PolarHBondContact O-ND2 3.43Å; C54-N58 VanDerWaalsContact O-ND2 3.13Å; N55-N58 PolarHBondContact O-N 3.07Å; C56-N58 VanDerWaalsContact C-N 3.32Å; C56-N58 PolarHBondContact O-N 2.56Å
59	D	58.5	Low	67.4	Low	131 Å²	131	104.7 Å²	104.7	70%	0.701	50%	0.502	S	S	*	.	H	α-helix	trans	-94.7	-36.2	-174	-67.2	-20.5	0	0	0	113.7	N55 C56	N55-D59 PolarHBondContact O-N 2.9Å; C56-D59 PolarHBondContact O-N 2.88Å
60	T	56.3	Low	68.5	Low	82 Å²	82	97.2 Å²	97.2	50%	0.503	48%	0.482	S	S	.	.	H	α-helix	trans	-88.4	-30	-175.5	53.8	0	0	0	0	114.8	M43 C56	M43-T60 HydrophobicContact CE-CG2 4.39Å; C56-T60 WeakPolarHBondContact O-CB 3.46Å; C56-T60 PolarHBondContact O-N 3.5Å; C56-T60 PolarHBondContact O-OG1 2.95Å
61	F	59.2	Low	69.8	Low	147 Å²	147	92.1 Å²	92.1	65%	0.645	47%	0.473	S	S	*	.	S	Bend	trans	-98.1	5.4	-177.8	-77.4	-83.2	0	0	0	114	F63	F61-F63 PolarHBondContact O-N 3.24Å
62	G	61.7	Low	71.1	Confident	27 Å²	27	91.1 Å²	91.1	28%	0.278	47%	0.465	S	S	.	.			trans	57	21.8	-179.3	0	0	0	0	0	113.3	R64 Q65 K66	G62-R64 VanDerWaalsContact C-N 3.25Å; G62-R64 PolarHBondContact O-N 3Å; G62-Q65 WeakPolarHBondContact O-CA 3.27Å; G62-Q65 WeakPolarHBondContact O-CB 3.43Å; G62-Q65 PolarHBondContact O-N 2.89Å; G62-K66 PolarHBondContact O-N 2.88Å
63	F	69.7	Low	72.5	Confident	114 Å²	114	94.8 Å²	94.8	50%	0.5	48%	0.482	S	S	.	.	H	α-helix	trans	-59.6	-36.6	-173	-176.6	-97.5	0	0	0	111.9	F61 Q65 K66 K67	F61-F63 PolarHBondContact O-N 3.24Å; F63-Q65 PolarHBondContact O-N 2.82Å; F63-K66 PolarHBondContact O-N 2.84Å; F63-K67 HydrophobicContact CE1-CD 4.39Å; F63-K67 VanDerWaalsContact O-CB 3.27Å; F63-K67 WeakPolarHBondContact O-CB 3.27Å; F63-K67 PolarHBondContact O-N 3.39Å
64	R	73.6	Confident	73.5	Confident	176 Å²	176	97 Å²	97	66%	0.664	49%	0.491	S	S	*	.	H	α-helix	trans	-59.6	-44.6	172.2	-79	-169.3	-178.6	-150.5	4.3	112.2	G62 A68	G62-R64 VanDerWaalsContact C-N 3.25Å; G62-R64 PolarHBondContact O-N 3Å; R64-A68 VanDerWaalsContact O-CB 3.26Å; R64-A68 WeakPolarHBondContact O-CB 3.46Å; R64-A68 PolarHBondContact O-N 3.47Å
65	Q	77.7	Confident	74.8	Confident	139 Å²	139	95 Å²	95	65%	0.65	48%	0.483	S	S	*	.	H	α-helix	trans	-69	-40.5	179	-167.2	173.5	19	0	0	111.2	G62 F63 A68 N69	G62-Q65 WeakPolarHBondContact O-CA 3.27Å; G62-Q65 WeakPolarHBondContact O-CB 3.43Å; G62-Q65 PolarHBondContact O-N 2.89Å; F63-Q65 PolarHBondContact O-N 2.82Å; Q65-A68 PolarHBondContact O-N 2.86Å; Q65-N69 VanDerWaalsContact O-CB 3.27Å; Q65-N69 WeakPolarHBondContact O-CB 3.48Å; Q65-N69 VanDerWaalsContact O-CG 3.31Å; Q65-N69 PolarHBondContact O-N 3.23Å
66	K	80.8	Confident	76.3	Confident	161 Å²	161	93 Å²	93	70%	0.7	47%	0.47	S	S	*	.	H	α-helix	trans	-66.6	-39.9	177.1	-152.8	173.3	-171.9	178.2	0	112	G62 F63 N69 L70	G62-K66 PolarHBondContact O-N 2.88Å; F63-K66 PolarHBondContact O-N 2.84Å; K66-N69 PolarHBondContact O-N 3.41Å; K66-L70 WeakPolarHBondContact O-CB 3.23Å; K66-L70 PolarHBondContact O-N 2.84Å
67	K	80.9	Confident	77.5	Confident	127 Å²	127	100.4 Å²	100.4	55%	0.552	49%	0.494	S	S	*	.	H	α-helix	trans	-67.1	-44.6	173.5	-174.4	175.4	179.9	175.2	0	111.8	F63 N69 L70 S71	F63-K67 HydrophobicContact CE1-CD 4.39Å; F63-K67 VanDerWaalsContact O-CB 3.27Å; F63-K67 WeakPolarHBondContact O-CB 3.27Å; F63-K67 PolarHBondContact O-N 3.39Å; K67-N69 VanDerWaalsContact C-N 3.33Å; K67-N69 PolarHBondContact O-N 3.35Å; K67-L70 PolarHBondContact O-N 3.49Å; K67-S71 PolarHBondContact O-N 2.83Å; K67-S71 PolarHBondContact O-OG 3.29Å
68	A	82.3	Confident	78.8	Confident	58 Å²	58	101.8 Å²	101.8	48%	0.479	50%	0.499	S	S	.	.	H	α-helix	trans	-61.6	-42	174.9	0	0	0	0	0	111.7	R64 Q65 S71 R72	R64-A68 VanDerWaalsContact O-CB 3.26Å; R64-A68 WeakPolarHBondContact O-CB 3.46Å; R64-A68 PolarHBondContact O-N 3.47Å; Q65-A68 PolarHBondContact O-N 2.86Å; A68-S71 PolarHBondContact O-N 2.92Å; A68-R72 WeakPolarHBondContact O-CB 3.35Å; A68-R72 PolarHBondContact O-N 2.96Å
69	N	85.7	Confident	80.4	Confident	69 Å²	69	107.2 Å²	107.2	37%	0.369	52%	0.516	S	S	.	.	H	α-helix	trans	-63.6	-42.7	173.4	-81.3	-9.6	0	0	0	111.9	Q65 K66 K67 R72 L73	Q65-N69 VanDerWaalsContact O-CB 3.27Å; Q65-N69 WeakPolarHBondContact O-CB 3.48Å; Q65-N69 VanDerWaalsContact O-CG 3.31Å; Q65-N69 PolarHBondContact O-N 3.23Å; K66-N69 PolarHBondContact O-N 3.41Å; K67-N69 VanDerWaalsContact C-N 3.33Å; K67-N69 PolarHBondContact O-N 3.35Å; N69-R72 PolarHBondContact O-N 2.81Å; N69-L73 WeakPolarHBondContact O-CB 3.34Å; N69-L73 VanDerWaalsContact O-CG 3.23Å; N69-L73 WeakPolarHBondContact O-CG 3.48Å; N69-L73 PolarHBondContact O-N 3.25Å
70	L	85.1	Confident	82.1	Confident	104 Å²	104	106.9 Å²	106.9	55%	0.545	51%	0.512	S	S	.	.	H	α-helix	trans	-62.7	-47.7	176.4	-178.6	65	0	0	0	111.1	K66 K67 R72 L73 I74	K66-L70 WeakPolarHBondContact O-CB 3.23Å; K66-L70 PolarHBondContact O-N 2.84Å; K67-L70 PolarHBondContact O-N 3.49Å; L70-R72 VanDerWaalsContact C-N 3.31Å; L70-R72 PolarHBondContact O-N 3.21Å; L70-L73 PolarHBondContact O-N 3.5Å; L70-I74 HydrophobicContact CD1-CD1 4.21Å; L70-I74 HydrophobicContact CD1-CG1 4.39Å; L70-I74 HydrophobicContact CG-CD1 3.87Å; L70-I74 HydrophobicContact CG-CG1 4.46Å; L70-I74 WeakPolarHBondContact O-CB 3.27Å; L70-I74 VanDerWaalsContact O-CG1 3.25Å; L70-I74 WeakPolarHBondContact O-CG1 3.47Å; L70-I74 PolarHBondContact O-N 3.49Å
71	S	86.2	Confident	83.8	Confident	70 Å²	70	104.9 Å²	104.9	49%	0.49	50%	0.504	S	S	.	.	H	α-helix	trans	-61.6	-38.3	175.9	-64.6	0	0	0	0	112.3	K67 A68 G75	K67-S71 PolarHBondContact O-N 2.83Å; K67-S71 PolarHBondContact O-OG 3.29Å; A68-S71 PolarHBondContact O-N 2.92Å; S71-G75 PolarHBondContact O-N 3.42Å
72	R	90.7	Very high	85.4	Confident	139 Å²	139	104.2 Å²	104.2	53%	0.525	50%	0.503	S	S	.	.	H	α-helix	trans	-63.5	-46.7	173.1	-172.8	-170.7	68.6	164.8	2.8	111.4	A68 N69 L70 I74 G75 E76	A68-R72 WeakPolarHBondContact O-CB 3.35Å; A68-R72 PolarHBondContact O-N 2.96Å; N69-R72 PolarHBondContact O-N 2.81Å; L70-R72 VanDerWaalsContact C-N 3.31Å; L70-R72 PolarHBondContact O-N 3.21Å; R72-I74 VanDerWaalsContact C-N 3.35Å; R72-G75 PolarHBondContact O-N 2.82Å; R72-E76 HydrophobicContact CG-CG 4.42Å; R72-E76 WeakPolarHBondContact CG-OE1 3.45Å; R72-E76 IonicContact NE-OE1 2.72Å; R72-E76 WeakPolarHBondContact O-CB 3.38Å; R72-E76 WeakPolarHBondContact O-CG 3.19Å; R72-E76 PolarHBondContact O-N 3.41Å
73	L	91.1	Very high	87	Confident	94 Å²	94	107.8 Å²	107.8	49%	0.492	51%	0.512	S	S	.	.	H	α-helix	trans	-64.7	-38	178.4	-74.3	169.6	0	0	0	112	N69 L70 E76 R77	N69-L73 WeakPolarHBondContact O-CB 3.34Å; N69-L73 VanDerWaalsContact O-CG 3.23Å; N69-L73 WeakPolarHBondContact O-CG 3.48Å; N69-L73 PolarHBondContact O-N 3.25Å; L70-L73 PolarHBondContact O-N 3.5Å; L73-E76 PolarHBondContact O-N 2.8Å; L73-R77 WeakPolarHBondContact O-CB 3.36Å; L73-R77 PolarHBondContact O-N 2.79Å
74	I	89.9	Confident	88.1	Confident	77 Å²	77	105.4 Å²	105.4	40%	0.395	51%	0.509	S	S	.	.	H	α-helix	trans	-62.2	-50	173.1	-70	166.3	0	0	0	109.5	L70 R72 E76 R77 E78	L70-I74 HydrophobicContact CD1-CD1 4.21Å; L70-I74 HydrophobicContact CD1-CG1 4.39Å; L70-I74 HydrophobicContact CG-CD1 3.87Å; L70-I74 HydrophobicContact CG-CG1 4.46Å; L70-I74 WeakPolarHBondContact O-CB 3.27Å; L70-I74 VanDerWaalsContact O-CG1 3.25Å; L70-I74 WeakPolarHBondContact O-CG1 3.47Å; L70-I74 PolarHBondContact O-N 3.49Å; R72-I74 VanDerWaalsContact C-N 3.35Å; I74-E76 PolarHBondContact O-N 2.85Å; I74-R77 WeakPolarHBondContact O-CB 3.25Å; I74-R77 PolarHBondContact O-N 3.05Å; I74-E78 HydrophobicContact CG2-CG 4.43Å; I74-E78 WeakPolarHBondContact O-CB 3.43Å; I74-E78 WeakPolarHBondContact O-CG 3.49Å; I74-E78 PolarHBondContact O-N 3.44Å
75	G	90.8	Very high	89.1	Confident	27 Å²	27	100.6 Å²	100.6	28%	0.278	50%	0.496	S	S	.	.	H	α-helix	trans	-65.3	-34.6	178.1	0	0	0	0	0	113.8	S71 R72 R79	S71-G75 PolarHBondContact O-N 3.42Å; R72-G75 PolarHBondContact O-N 2.82Å; G75-R79 VanDerWaalsContact O-CB 3.27Å; G75-R79 WeakPolarHBondContact O-CB 3.33Å; G75-R79 PolarHBondContact O-N 3.12Å
76	E	92.1	Very high	89.9	Confident	71 Å²	71	98.8 Å²	98.8	33%	0.332	49%	0.488	S	S	.	.	H	α-helix	trans	-67.2	-40.6	172.1	-77.9	171.1	-177.8	0	0	111.4	R72 L73 I74 M80	R72-E76 HydrophobicContact CG-CG 4.42Å; R72-E76 WeakPolarHBondContact CG-OE1 3.45Å; R72-E76 IonicContact NE-OE1 2.72Å; R72-E76 WeakPolarHBondContact O-CB 3.38Å; R72-E76 WeakPolarHBondContact O-CG 3.19Å; R72-E76 PolarHBondContact O-N 3.41Å; L73-E76 PolarHBondContact O-N 2.8Å; I74-E76 PolarHBondContact O-N 2.85Å; E76-M80 VanDerWaalsContact O-CB 3.25Å; E76-M80 WeakPolarHBondContact O-CB 3.41Å; E76-M80 PolarHBondContact O-N 3.29Å
77	R	92.4	Very high	90.6	Very high	178 Å²	178	97.1 Å²	97.1	67%	0.672	48%	0.481	S	S	*	.	H	α-helix	trans	-66.2	-41.8	175.2	179.4	-92.9	-176.1	170.2	-0.8	111.6	L73 I74 A81	L73-R77 WeakPolarHBondContact O-CB 3.36Å; L73-R77 PolarHBondContact O-N 2.79Å; I74-R77 WeakPolarHBondContact O-CB 3.25Å; I74-R77 PolarHBondContact O-N 3.05Å; R77-A81 VanDerWaalsContact O-CB 3.26Å; R77-A81 WeakPolarHBondContact O-CB 3.25Å; R77-A81 PolarHBondContact O-N 3.19Å
78	E	92.3	Very high	91.2	Very high	100 Å²	100	95.1 Å²	95.1	47%	0.467	48%	0.475	S	S	.	.	H	α-helix	trans	-64.9	-47.1	175.4	-75	173.3	169.2	0	0	111.1	I74 M80 A81 E82	I74-E78 HydrophobicContact CG2-CG 4.43Å; I74-E78 WeakPolarHBondContact O-CB 3.43Å; I74-E78 WeakPolarHBondContact O-CG 3.49Å; I74-E78 PolarHBondContact O-N 3.44Å; E78-M80 VanDerWaalsContact C-N 3.34Å; E78-M80 PolarHBondContact O-N 2.87Å; E78-A81 CarbonylContact O-C 3.6Å; E78-A81 WeakPolarHBondContact O-CB 3.36Å; E78-A81 PolarHBondContact O-N 2.91Å; E78-A81 VanDerWaalsContact O-N 3.12Å; E78-E82 WeakPolarHBondContact O-CG 3.47Å; E78-E82 PolarHBondContact O-N 2.84Å
79	R	92.6	Very high	91.8	Very high	161 Å²	161	98.8 Å²	98.8	61%	0.608	48%	0.477	S	S	*	.	H	α-helix	trans	-60	-43.2	175	-167.9	-165.4	-47.7	155.4	9.4	112.1	G75 A81 E82 E83	G75-R79 VanDerWaalsContact O-CB 3.27Å; G75-R79 WeakPolarHBondContact O-CB 3.33Å; G75-R79 PolarHBondContact O-N 3.12Å; R79-A81 VanDerWaalsContact C-N 3.34Å; R79-E82 PolarHBondContact O-N 3.32Å; R79-E83 WeakPolarHBondContact O-CB 3.35Å; R79-E83 PolarHBondContact O-N 2.67Å
80	M	93.2	Very high	92.3	Very high	124 Å²	124	98.5 Å²	98.5	61%	0.611	48%	0.478	S	S	*	.	H	α-helix	trans	-64.8	-40	175.5	-173.2	-163	-66.4	0	0	111	E76 E78 E83 C84	E76-M80 VanDerWaalsContact O-CB 3.25Å; E76-M80 WeakPolarHBondContact O-CB 3.41Å; E76-M80 PolarHBondContact O-N 3.29Å; E78-M80 VanDerWaalsContact C-N 3.34Å; E78-M80 PolarHBondContact O-N 2.87Å; M80-E83 PolarHBondContact O-N 3.36Å; M80-C84 VanDerWaalsContact O-CB 3.28Å; M80-C84 WeakPolarHBondContact O-CB 3.32Å; M80-C84 PolarHBondContact O-N 2.89Å; M80-C84 PolarHBondContact O-SG 3.43Å
81	A	92	Very high	92.8	Very high	40 Å²	40	101.7 Å²	101.7	33%	0.331	48%	0.482	S	S	.	.	H	α-helix	trans	-63.4	-44.2	175.9	0	0	0	0	0	111.4	R77 E78 R79 C84 D85	R77-A81 VanDerWaalsContact O-CB 3.26Å; R77-A81 WeakPolarHBondContact O-CB 3.25Å; R77-A81 PolarHBondContact O-N 3.19Å; E78-A81 CarbonylContact O-C 3.6Å; E78-A81 WeakPolarHBondContact O-CB 3.36Å; E78-A81 PolarHBondContact O-N 2.91Å; E78-A81 VanDerWaalsContact O-N 3.12Å; R79-A81 VanDerWaalsContact C-N 3.34Å; A81-C84 PolarHBondContact O-N 3.31Å; A81-D85 WeakPolarHBondContact O-CB 3.31Å; A81-D85 PolarHBondContact O-N 2.82Å
82	E	93.4	Very high	93.2	Very high	133 Å²	133	101.3 Å²	101.3	62%	0.621	48%	0.475	S	S	*	.	H	α-helix	trans	-62.6	-43.3	174.7	-74.1	175.9	179.2	0	0	112.3	E78 R79 D85 E86	E78-E82 WeakPolarHBondContact O-CG 3.47Å; E78-E82 PolarHBondContact O-N 2.84Å; R79-E82 PolarHBondContact O-N 3.32Å; E82-D85 PolarHBondContact O-N 3.42Å; E82-E86 WeakPolarHBondContact O-CB 3.28Å; E82-E86 PolarHBondContact O-N 2.81Å
83	E	94.2	Very high	93.4	Very high	101 Å²	101	97.5 Å²	97.5	47%	0.472	47%	0.469	S	S	.	.	H	α-helix	trans	-65.5	-39.8	177.3	-166.2	-172.3	159.1	0	0	111.6	R79 M80 K87	R79-E83 WeakPolarHBondContact O-CB 3.35Å; R79-E83 PolarHBondContact O-N 2.67Å; M80-E83 PolarHBondContact O-N 3.36Å; E83-K87 WeakPolarHBondContact O-CB 3.35Å; E83-K87 VanDerWaalsContact O-CG 3.32Å; E83-K87 WeakPolarHBondContact O-CG 3.44Å; E83-K87 PolarHBondContact O-N 2.99Å; E83-K87 VanDerWaalsContact OE1-CE 3.31Å; E83-K87 WeakPolarHBondContact OE1-CE 3.26Å; E83-K87 IonicContact OE1-NZ 2.79Å; E83-K87 PolarHBondContact OE1-NZ 3.28Å
84	C	93.8	Very high	93.6	Very high	64 Å²	64	97.7 Å²	97.7	43%	0.432	47%	0.471	S	S	.	.	H	α-helix	trans	-63	-47	172.5	-78.5	0	0	0	0	111.3	M80 A81 E86 K87 L88	M80-C84 VanDerWaalsContact O-CB 3.28Å; M80-C84 WeakPolarHBondContact O-CB 3.32Å; M80-C84 PolarHBondContact O-N 2.89Å; M80-C84 PolarHBondContact O-SG 3.43Å; A81-C84 PolarHBondContact O-N 3.31Å; C84-E86 VanDerWaalsContact C-N 3.33Å; C84-E86 PolarHBondContact O-N 2.75Å; C84-K87 PolarHBondContact O-N 2.9Å; C84-L88 WeakPolarHBondContact O-CB 3.4Å; C84-L88 WeakPolarHBondContact O-CG 3.42Å; C84-L88 PolarHBondContact O-N 3.3Å
85	D	94.3	Very high	93.9	Very high	76 Å²	76	101.3 Å²	101.3	41%	0.406	48%	0.481	S	S	.	.	H	α-helix	trans	-61	-42.2	177.2	-87.1	0.2	0	0	0	111.5	A81 E82 L88 R89	A81-D85 WeakPolarHBondContact O-CB 3.31Å; A81-D85 PolarHBondContact O-N 2.82Å; E82-D85 PolarHBondContact O-N 3.42Å; D85-L88 CarbonylContact O-C 3.57Å; D85-L88 PolarHBondContact O-N 3.34Å; D85-R89 WeakPolarHBondContact O-CB 3.36Å; D85-R89 VanDerWaalsContact O-CG 3.29Å; D85-R89 WeakPolarHBondContact O-CG 3.23Å; D85-R89 PolarHBondContact O-N 3.46Å; D85-R89 IonicContact OD2-NH2 3.61Å
86	E	94.5	Very high	94.1	Very high	100 Å²	100	108.1 Å²	108.1	47%	0.467	50%	0.498	S	S	.	.	H	α-helix	trans	-68.8	-40.8	179.7	-169	54.1	-147.6	0	0	112.1	E82 C84 L88 R89 T90	E82-E86 WeakPolarHBondContact O-CB 3.28Å; E82-E86 PolarHBondContact O-N 2.81Å; C84-E86 VanDerWaalsContact C-N 3.33Å; C84-E86 PolarHBondContact O-N 2.75Å; E86-L88 VanDerWaalsContact C-N 3.31Å; E86-L88 PolarHBondContact O-N 3.46Å; E86-R89 PolarHBondContact O-N 2.85Å; E86-R89 IonicContact OE2-NH1 3.43Å; E86-R89 PolarHBondContact OE2-NH1 3.25Å; E86-T90 WeakPolarHBondContact O-CB 3.21Å; E86-T90 PolarHBondContact O-N 2.87Å; E86-T90 PolarHBondContact O-OG1 2.79Å
87	K	94.4	Very high	94.3	Very high	127 Å²	127	108.1 Å²	108.1	55%	0.552	51%	0.506	S	S	*	.	H	α-helix	trans	-61.4	-40.9	170.8	-75.7	175	-174.1	165.1	0	111.3	E83 C84 R91	E83-K87 WeakPolarHBondContact O-CB 3.35Å; E83-K87 VanDerWaalsContact O-CG 3.32Å; E83-K87 WeakPolarHBondContact O-CG 3.44Å; E83-K87 PolarHBondContact O-N 2.99Å; E83-K87 VanDerWaalsContact OE1-CE 3.31Å; E83-K87 WeakPolarHBondContact OE1-CE 3.26Å; E83-K87 IonicContact OE1-NZ 2.79Å; E83-K87 PolarHBondContact OE1-NZ 3.28Å; C84-K87 PolarHBondContact O-N 2.9Å; K87-R91 VanDerWaalsContact O-CB 3.23Å; K87-R91 WeakPolarHBondContact O-CB 3.29Å; K87-R91 PolarHBondContact O-N 2.86Å
88	L	95.1	Very high	94.4	Very high	84 Å²	84	105.1 Å²	105.1	44%	0.44	50%	0.503	S	S	.	.	H	α-helix	trans	-66.2	-42.1	175.8	-74.3	170	0	0	0	111.5	C84 D85 E86 R91 N92	C84-L88 WeakPolarHBondContact O-CB 3.4Å; C84-L88 WeakPolarHBondContact O-CG 3.42Å; C84-L88 PolarHBondContact O-N 3.3Å; D85-L88 CarbonylContact O-C 3.57Å; D85-L88 PolarHBondContact O-N 3.34Å; E86-L88 VanDerWaalsContact C-N 3.31Å; E86-L88 PolarHBondContact O-N 3.46Å; L88-R91 PolarHBondContact O-N 3.19Å; L88-N92 WeakPolarHBondContact O-CB 3.39Å; L88-N92 PolarHBondContact O-N 3.38Å; L88-N92 PolarHBondContact O-ND2 3.46Å
89	R	95.2	Very high	94.6	Very high	136 Å²	136	102.8 Å²	102.8	51%	0.513	50%	0.495	S	S	.	.	H	α-helix	trans	-61.1	-49.9	175.3	-76.2	-177.4	-162.7	104.7	11.8	111.2	D85 E86 R91 N92 S93	D85-R89 WeakPolarHBondContact O-CB 3.36Å; D85-R89 VanDerWaalsContact O-CG 3.29Å; D85-R89 WeakPolarHBondContact O-CG 3.23Å; D85-R89 PolarHBondContact O-N 3.46Å; D85-R89 IonicContact OD2-NH2 3.61Å; E86-R89 PolarHBondContact O-N 2.85Å; E86-R89 IonicContact OE2-NH1 3.43Å; E86-R89 PolarHBondContact OE2-NH1 3.25Å; R89-R91 PolarHBondContact O-N 2.89Å; R89-N92 CarbonylContact O-C 3.6Å; R89-N92 PolarHBondContact O-N 3.39Å; R89-S93 PolarHBondContact O-N 3.31Å; R89-S93 PolarHBondContact O-OG 2.88Å
90	T	94.9	Very high	94.7	Very high	62 Å²	62	99.9 Å²	99.9	38%	0.38	50%	0.495	S	S	.	.	H	α-helix	trans	-62.3	-42.5	178.4	-55.7	0	0	0	0	111.6	E86 S93 N94	E86-T90 WeakPolarHBondContact O-CB 3.21Å; E86-T90 PolarHBondContact O-N 2.87Å; E86-T90 PolarHBondContact O-OG1 2.79Å; T90-S93 WeakPolarHBondContact CA-OG 3.42Å; T90-S93 PolarHBondContact O-N 3.03Å; T90-S93 PolarHBondContact O-OG 3.44Å; T90-N94 WeakPolarHBondContact O-CB 3.19Å; T90-N94 PolarHBondContact O-N 3.21Å; T90-N94 PolarHBondContact O-ND2 3.45Å
91	R	95.3	Very high	94.8	Very high	171 Å²	171	96.3 Å²	96.3	65%	0.645	49%	0.485	S	S	*	.	H	α-helix	trans	-62	-45.1	174.4	-169.4	-172.6	103.8	162.7	7	111.1	K87 L88 R89 N94 Y95	K87-R91 VanDerWaalsContact O-CB 3.23Å; K87-R91 WeakPolarHBondContact O-CB 3.29Å; K87-R91 PolarHBondContact O-N 2.86Å; L88-R91 PolarHBondContact O-N 3.19Å; R89-R91 PolarHBondContact O-N 2.89Å; R91-N94 PolarHBondContact O-N 2.99Å; R91-Y95 VanDerWaalsContact O-CB 3.3Å; R91-Y95 WeakPolarHBondContact O-CB 3.43Å; R91-Y95 PolarHBondContact O-N 3.47Å
92	N	95.4	Very high	95	Very high	63 Å²	63	98.4 Å²	98.4	34%	0.337	49%	0.491	S	S	.	.	H	α-helix	trans	-68.7	-36.5	-178.8	-73	-19.6	0	0	0	112.1	L88 R89 R96	L88-N92 WeakPolarHBondContact O-CB 3.39Å; L88-N92 PolarHBondContact O-N 3.38Å; L88-N92 PolarHBondContact O-ND2 3.46Å; R89-N92 CarbonylContact O-C 3.6Å; R89-N92 PolarHBondContact O-N 3.39Å; N92-R96 WeakPolarHBondContact O-CB 3.38Å; N92-R96 VanDerWaalsContact O-CG 3.22Å; N92-R96 WeakPolarHBondContact O-CG 3.39Å; N92-R96 PolarHBondContact O-N 2.86Å
93	S	95.2	Very high	95.1	Very high	58 Å²	58	95.9 Å²	95.9	41%	0.406	48%	0.481	S	S	.	.	H	α-helix	trans	-66.1	-45.7	174	62.5	0	0	0	0	111.4	R89 T90 Y95 R96 S97	R89-S93 PolarHBondContact O-N 3.31Å; R89-S93 PolarHBondContact O-OG 2.88Å; T90-S93 WeakPolarHBondContact CA-OG 3.42Å; T90-S93 PolarHBondContact O-N 3.03Å; T90-S93 PolarHBondContact O-OG 3.44Å; S93-Y95 PolarHBondContact O-N 3.5Å; S93-R96 PolarHBondContact O-N 2.84Å; S93-S97 PolarHBondContact O-N 3.34Å; S93-S97 PolarHBondContact O-OG 3.46Å
94	N	95.3	Very high	95.1	Very high	99 Å²	99	94.2 Å²	94.2	53%	0.529	48%	0.481	S	S	.	.	H	α-helix	trans	-63.3	-41	176.6	-70.9	-13.4	0	0	0	112.1	T90 R91 S97 L98	T90-N94 WeakPolarHBondContact O-CB 3.19Å; T90-N94 PolarHBondContact O-N 3.21Å; T90-N94 PolarHBondContact O-ND2 3.45Å; R91-N94 PolarHBondContact O-N 2.99Å; N94-S97 WeakPolarHBondContact CA-OG 3.3Å; N94-S97 PolarHBondContact O-N 3.49Å; N94-S97 PolarHBondContact O-OG 3.27Å; N94-L98 WeakPolarHBondContact O-CB 3.22Å; N94-L98 PolarHBondContact O-N 3.48Å
95	Y	95.6	Very high	95.2	Very high	152 Å²	152	95 Å²	95	60%	0.596	48%	0.483	S	S	*	.	H	α-helix	trans	-62.1	-47.7	174.3	179.6	-98.8	0	0	0	111	R91 S93 S97 L98 V99	R91-Y95 VanDerWaalsContact O-CB 3.3Å; R91-Y95 WeakPolarHBondContact O-CB 3.43Å; R91-Y95 PolarHBondContact O-N 3.47Å; S93-Y95 PolarHBondContact O-N 3.5Å; Y95-S97 PolarHBondContact O-N 2.95Å; Y95-L98 PolarHBondContact O-N 2.92Å; Y95-V99 HydrophobicContact CD1-CG2 4.15Å; Y95-V99 HydrophobicContact CE1-CG2 3.75Å; Y95-V99 HydrophobicContact CE2-CG2 4.24Å; Y95-V99 VanDerWaalsContact O-CG2 3.3Å; Y95-V99 WeakPolarHBondContact O-CG2 3.37Å; Y95-V99 PolarHBondContact O-N 3.26Å
96	R	95.4	Very high	95.3	Very high	171 Å²	171	97.9 Å²	97.9	65%	0.645	49%	0.489	S	S	*	.	H	α-helix	trans	-60.1	-44.2	176.6	-76.1	173.3	-177.7	147.7	-1.1	112.1	N92 S93 L98 V99 V100	N92-R96 WeakPolarHBondContact O-CB 3.38Å; N92-R96 VanDerWaalsContact O-CG 3.22Å; N92-R96 WeakPolarHBondContact O-CG 3.39Å; N92-R96 PolarHBondContact O-N 2.86Å; S93-R96 PolarHBondContact O-N 2.84Å; R96-L98 VanDerWaalsContact C-N 3.33Å; R96-L98 PolarHBondContact O-N 2.92Å; R96-V99 PolarHBondContact O-N 3.49Å; R96-V100 WeakPolarHBondContact O-CG2 3.26Å; R96-V100 PolarHBondContact O-N 2.87Å
97	S	95.4	Very high	95.3	Very high	71 Å²	71	96.4 Å²	96.4	50%	0.497	49%	0.488	S	S	.	.	H	α-helix	trans	-63.9	-38.8	177.9	61.6	0	0	0	0	112.2	S93 N94 Y95 V100 A101	S93-S97 PolarHBondContact O-N 3.34Å; S93-S97 PolarHBondContact O-OG 3.46Å; N94-S97 WeakPolarHBondContact CA-OG 3.3Å; N94-S97 PolarHBondContact O-N 3.49Å; N94-S97 PolarHBondContact O-OG 3.27Å; Y95-S97 PolarHBondContact O-N 2.95Å; S97-V100 PolarHBondContact O-N 3.47Å; S97-A101 WeakPolarHBondContact O-CB 3.3Å; S97-A101 PolarHBondContact O-N 2.87Å
98	L	95.9	Very high	95.4	Very high	115 Å²	115	99.3 Å²	99.3	60%	0.602	50%	0.495	S	S	*	.	H	α-helix	trans	-66.3	-41.6	176.2	-173.7	68.6	0	0	0	111.6	N94 Y95 R96 A101 L102	N94-L98 WeakPolarHBondContact O-CB 3.22Å; N94-L98 PolarHBondContact O-N 3.48Å; Y95-L98 PolarHBondContact O-N 2.92Å; R96-L98 VanDerWaalsContact C-N 3.33Å; R96-L98 PolarHBondContact O-N 2.92Å; L98-A101 PolarHBondContact O-N 3.24Å; L98-L102 VanDerWaalsContact O-CB 3.26Å; L98-L102 WeakPolarHBondContact O-CB 3.35Å; L98-L102 PolarHBondContact O-N 2.95Å
99	V	95.4	Very high	95.5	Very high	51 Å²	51	99.3 Å²	99.3	31%	0.309	50%	0.495	S	S	.	.	H	α-helix	trans	-61.1	-48.5	175.7	170.3	0	0	0	0	110.5	Y95 R96 A101 L102 D103	Y95-V99 HydrophobicContact CD1-CG2 4.15Å; Y95-V99 HydrophobicContact CE1-CG2 3.75Å; Y95-V99 HydrophobicContact CE2-CG2 4.24Å; Y95-V99 VanDerWaalsContact O-CG2 3.3Å; Y95-V99 WeakPolarHBondContact O-CG2 3.37Å; Y95-V99 PolarHBondContact O-N 3.26Å; R96-V99 PolarHBondContact O-N 3.49Å; V99-A101 VanDerWaalsContact C-N 3.34Å; V99-A101 PolarHBondContact O-N 3.41Å; V99-L102 PolarHBondContact O-N 2.81Å; V99-D103 WeakPolarHBondContact CG1-OD2 3.35Å; V99-D103 WeakPolarHBondContact O-CB 3.41Å; V99-D103 VanDerWaalsContact O-CG 3.27Å; V99-D103 PolarHBondContact O-N 3.19Å
100	V	95	Very high	95.6	Very high	100 Å²	100	96.5 Å²	96.5	61%	0.606	49%	0.493	S	S	*	.	H	α-helix	trans	-60	-43.5	176.7	172.2	0	0	0	0	111.5	R96 S97 L102 D103 S104	R96-V100 WeakPolarHBondContact O-CG2 3.26Å; R96-V100 PolarHBondContact O-N 2.87Å; S97-V100 PolarHBondContact O-N 3.47Å; V100-L102 PolarHBondContact O-N 3.3Å; V100-D103 PolarHBondContact O-N 3.14Å; V100-S104 PolarHBondContact O-N 2.69Å
101	A	95.7	Very high	95.7	Very high	49 Å²	49	97.7 Å²	97.7	41%	0.405	50%	0.5	S	S	.	.	H	α-helix	trans	-61.8	-44.6	176.5	0	0	0	0	0	111.5	S97 L98 V99 S104 V105	S97-A101 WeakPolarHBondContact O-CB 3.3Å; S97-A101 PolarHBondContact O-N 2.87Å; L98-A101 PolarHBondContact O-N 3.24Å; V99-A101 VanDerWaalsContact C-N 3.34Å; V99-A101 PolarHBondContact O-N 3.41Å; A101-S104 PolarHBondContact O-N 3.36Å; A101-S104 PolarHBondContact O-OG 2.95Å; A101-V105 WeakPolarHBondContact O-CG2 3.46Å; A101-V105 PolarHBondContact O-N 3.42Å; A101-V105 VanDerWaalsContact O-N 3.14Å
102	L	95.7	Very high	95.8	Very high	84 Å²	84	95.1 Å²	95.1	44%	0.44	50%	0.499	S	S	.	.	H	α-helix	trans	-66	-41.4	179.1	-167.3	148.2	0	0	0	111.7	L98 V99 V100 S104 V105 R106	L98-L102 VanDerWaalsContact O-CB 3.26Å; L98-L102 WeakPolarHBondContact O-CB 3.35Å; L98-L102 PolarHBondContact O-N 2.95Å; V99-L102 PolarHBondContact O-N 2.81Å; V100-L102 PolarHBondContact O-N 3.3Å; L102-S104 VanDerWaalsContact C-N 3.27Å; L102-S104 PolarHBondContact O-N 2.93Å; L102-V105 PolarHBondContact O-N 3.21Å; L102-R106 WeakPolarHBondContact O-CB 2.87Å; L102-R106 PolarHBondContact O-N 3.41Å
103	D	95.2	Very high	95.9	Very high	80 Å²	80	97.5 Å²	97.5	43%	0.428	51%	0.506	S	S	.	.	H	α-helix	trans	-65.6	-29.1	175.3	-72.1	-19.2	0	0	0	112.1	V99 V100 R106 P107	V99-D103 WeakPolarHBondContact CG1-OD2 3.35Å; V99-D103 WeakPolarHBondContact O-CB 3.41Å; V99-D103 VanDerWaalsContact O-CG 3.27Å; V99-D103 PolarHBondContact O-N 3.19Å; V100-D103 PolarHBondContact O-N 3.14Å; D103-R106 IonicContact OD1-CZ 3.2Å; D103-R106 IonicContact OD1-NH1 2.67Å; D103-R106 PolarHBondContact OD1-NH1 3.12Å; D103-P107 WeakPolarHBondContact O-CD 3.4Å; D103-P107 WeakPolarHBondContact O-CG 3.44Å
104	S	94.3	Very high	96	Very high	66 Å²	66	103 Å²	103	46%	0.462	52%	0.518	S	S	.	.	H	α-helix	trans	-74.2	-32.5	172.9	81.5	0	0	0	0	113.4	V100 A101 L102	V100-S104 PolarHBondContact O-N 2.69Å; A101-S104 PolarHBondContact O-N 3.36Å; A101-S104 PolarHBondContact O-OG 2.95Å; L102-S104 VanDerWaalsContact C-N 3.27Å; L102-S104 PolarHBondContact O-N 2.93Å
105	V	96.2	Very high	96.2	Very high	80 Å²	80	103.1 Å²	103.1	49%	0.485	52%	0.516	S	S	.	.	H	α-helix	trans	-85	-36.2	-177.2	173.7	0	0	0	0	111.9	A101 L102 R108 L109	A101-V105 WeakPolarHBondContact O-CG2 3.46Å; A101-V105 PolarHBondContact O-N 3.42Å; A101-V105 VanDerWaalsContact O-N 3.14Å; L102-V105 PolarHBondContact O-N 3.21Å; V105-R108 WeakPolarHBondContact O-CB 3.44Å; V105-R108 PolarHBondContact O-N 2.91Å; V105-R108 VanDerWaalsContact O-N 3.14Å; V105-L109 PolarHBondContact O-N 2.78Å
106	R	96.3	Very high	96.3	Very high	137 Å²	137	101.6 Å²	101.6	52%	0.517	52%	0.518	S	S	.	.	H	α-helix	trans	-52.7	-47	-179.8	-169.8	-176.5	-77.2	126.6	-12.5	114.2	L102 D103 L109 T110	L102-R106 WeakPolarHBondContact O-CB 2.87Å; L102-R106 PolarHBondContact O-N 3.41Å; D103-R106 IonicContact OD1-CZ 3.2Å; D103-R106 IonicContact OD1-NH1 2.67Å; D103-R106 PolarHBondContact OD1-NH1 3.12Å; R106-L109 PolarHBondContact O-N 3.06Å; R106-T110 WeakPolarHBondContact O-CB 3.46Å; R106-T110 PolarHBondContact O-N 2.69Å; R106-T110 PolarHBondContact O-OG1 3.14Å
107	P	95.2	Very high	96.4	Very high	69 Å²	69	102 Å²	102	45%	0.448	52%	0.519	S	S	.	.	H	α-helix	trans	-67.5	-39.2	177.1	25.3	-33.8	0	0	0	111.8	D103 L109 T110 V111	D103-P107 WeakPolarHBondContact O-CD 3.4Å; D103-P107 WeakPolarHBondContact O-CG 3.44Å; P107-L109 PolarHBondContact O-N 2.92Å; P107-T110 WeakPolarHBondContact O-CB 3.43Å; P107-T110 PolarHBondContact O-N 3.45Å; P107-T110 VanDerWaalsContact O-N 3.12Å; P107-V111 WeakPolarHBondContact O-CG2 3.42Å; P107-V111 PolarHBondContact O-N 3.49Å
108	R	96.5	Very high	96.5	Very high	188 Å²	188	104.1 Å²	104.1	71%	0.709	52%	0.523	S	S	*	.	H	α-helix	trans	-60	-45.5	176.2	-66.5	177	66.1	-178.8	1.1	111.6	V105 T110 V111 L112	V105-R108 WeakPolarHBondContact O-CB 3.44Å; V105-R108 PolarHBondContact O-N 2.91Å; V105-R108 VanDerWaalsContact O-N 3.14Å; R108-T110 VanDerWaalsContact C-N 3.28Å; R108-T110 PolarHBondContact O-N 2.94Å; R108-V111 PolarHBondContact O-N 3.39Å; R108-L112 WeakPolarHBondContact O-CB 3.5Å; R108-L112 PolarHBondContact O-N 3.41Å
109	L	96.6	Very high	96.6	Very high	84 Å²	84	103.4 Å²	103.4	44%	0.44	52%	0.515	S	S	.	.	H	α-helix	trans	-62.4	-37.5	175.7	-177.2	62.2	0	0	0	111.7	V105 R106 P107 L112 K113	V105-L109 PolarHBondContact O-N 2.78Å; R106-L109 PolarHBondContact O-N 3.06Å; P107-L109 PolarHBondContact O-N 2.92Å; L109-L112 PolarHBondContact O-N 3.46Å; L109-K113 HydrophobicContact CD1-CG 4.48Å; L109-K113 HydrophobicContact CG-CD 4.29Å; L109-K113 WeakPolarHBondContact O-CB 3.38Å; L109-K113 VanDerWaalsContact O-CG 3.29Å; L109-K113 WeakPolarHBondContact O-CG 3.47Å; L109-K113 PolarHBondContact O-N 2.88Å
110	T	96.8	Very high	96.7	Very high	77 Å²	77	104 Å²	104	47%	0.472	52%	0.519	S	S	.	.	H	α-helix	trans	-67.2	-44	179	-57.2	0	0	0	0	111.4	R106 P107 R108 K113 R114	R106-T110 WeakPolarHBondContact O-CB 3.46Å; R106-T110 PolarHBondContact O-N 2.69Å; R106-T110 PolarHBondContact O-OG1 3.14Å; P107-T110 WeakPolarHBondContact O-CB 3.43Å; P107-T110 PolarHBondContact O-N 3.45Å; P107-T110 VanDerWaalsContact O-N 3.12Å; R108-T110 VanDerWaalsContact C-N 3.28Å; R108-T110 PolarHBondContact O-N 2.94Å; T110-K113 PolarHBondContact O-N 3.18Å; T110-R114 PolarHBondContact O-N 2.83Å
111	V	96.9	Very high	96.8	Very high	87 Å²	87	106 Å²	106	53%	0.527	52%	0.519	S	S	.	.	H	α-helix	trans	-62.2	-45.9	173.7	173.6	0	0	0	0	110.8	P107 R108 K113 R114 M115	P107-V111 WeakPolarHBondContact O-CG2 3.42Å; P107-V111 PolarHBondContact O-N 3.49Å; R108-V111 PolarHBondContact O-N 3.39Å; V111-K113 PolarHBondContact O-N 3.04Å; V111-R114 WeakPolarHBondContact O-CB 3.44Å; V111-R114 PolarHBondContact O-N 3.29Å; V111-M115 HydrophobicContact CG1-CG 4.44Å; V111-M115 WeakPolarHBondContact O-CG 3.29Å; V111-M115 PolarHBondContact O-N 3.44Å
112	L	97.6	Very high	96.9	Very high	117 Å²	117	107.2 Å²	107.2	61%	0.613	52%	0.517	S	S	*	.	H	α-helix	trans	-62.5	-42.9	179.1	-172.4	66.1	0	0	0	112	R108 L109 R114 M115 L116	R108-L112 WeakPolarHBondContact O-CB 3.5Å; R108-L112 PolarHBondContact O-N 3.41Å; L109-L112 PolarHBondContact O-N 3.46Å; L112-R114 VanDerWaalsContact C-N 3.32Å; L112-R114 PolarHBondContact O-N 3.47Å; L112-M115 PolarHBondContact O-N 2.92Å; L112-L116 WeakPolarHBondContact O-CB 3.41Å; L112-L116 PolarHBondContact O-N 3.45Å
113	K	97.8	Very high	97	Very high	112 Å²	112	107.8 Å²	107.8	49%	0.487	52%	0.519	S	S	.	.	H	α-helix	trans	-61.1	-40.4	174.5	-77	176.2	178	-179.5	0	112	L109 T110 V111 R117	L109-K113 HydrophobicContact CD1-CG 4.48Å; L109-K113 HydrophobicContact CG-CD 4.29Å; L109-K113 WeakPolarHBondContact O-CB 3.38Å; L109-K113 VanDerWaalsContact O-CG 3.29Å; L109-K113 WeakPolarHBondContact O-CG 3.47Å; L109-K113 PolarHBondContact O-N 2.88Å; T110-K113 PolarHBondContact O-N 3.18Å; V111-K113 PolarHBondContact O-N 3.04Å; K113-R117 VanDerWaalsContact O-CG 3.32Å; K113-R117 WeakPolarHBondContact O-CG 3.42Å; K113-R117 PolarHBondContact O-N 2.82Å
114	R	97.6	Very high	97.2	Very high	173 Å²	173	108.2 Å²	108.2	65%	0.653	52%	0.519	S	S	*	.	H	α-helix	trans	-63.7	-47.2	175.4	-174.8	-177.4	-72.2	167.1	-3.3	110.8	T110 V111 L112 L116 R117 M118	T110-R114 PolarHBondContact O-N 2.83Å; V111-R114 WeakPolarHBondContact O-CB 3.44Å; V111-R114 PolarHBondContact O-N 3.29Å; L112-R114 VanDerWaalsContact C-N 3.32Å; L112-R114 PolarHBondContact O-N 3.47Å; R114-L116 PolarHBondContact O-N 2.74Å; R114-R117 PolarHBondContact O-N 2.88Å; R114-M118 WeakPolarHBondContact O-CG 3.5Å; R114-M118 PolarHBondContact O-N 3.26Å
115	M	98.1	Very high	97.3	Very high	102 Å²	102	107.9 Å²	107.9	50%	0.502	52%	0.52	S	S	.	.	H	α-helix	trans	-59.6	-44.9	176.6	-76.7	-65	-65.2	0	0	112.1	V111 L112 R117 M118 K119	V111-M115 HydrophobicContact CG1-CG 4.44Å; V111-M115 WeakPolarHBondContact O-CG 3.29Å; V111-M115 PolarHBondContact O-N 3.44Å; L112-M115 PolarHBondContact O-N 2.92Å; M115-R117 PolarHBondContact O-N 3.49Å; M115-M118 PolarHBondContact O-N 2.99Å; M115-K119 WeakPolarHBondContact O-CB 3.43Å; M115-K119 WeakPolarHBondContact O-CG 3.32Å; M115-K119 PolarHBondContact O-N 3.32Å
116	L	97.9	Very high	97.4	Very high	120 Å²	120	109.7 Å²	109.7	63%	0.628	52%	0.522	S	S	*	.	H	α-helix	trans	-59	-49.5	177.2	-168.6	78.1	0	0	0	110.6	L112 R114 M118 K119 T120	L112-L116 WeakPolarHBondContact O-CB 3.41Å; L112-L116 PolarHBondContact O-N 3.45Å; R114-L116 PolarHBondContact O-N 2.74Å; L116-M118 VanDerWaalsContact C-N 3.33Å; L116-M118 PolarHBondContact O-N 3.19Å; L116-K119 PolarHBondContact O-N 3.37Å; L116-T120 PolarHBondContact O-N 2.95Å; L116-T120 PolarHBondContact O-OG1 3.48Å
117	R	97.6	Very high	97.5	Very high	180 Å²	180	111.4 Å²	111.4	68%	0.679	53%	0.528	S	S	*	.	H	α-helix	trans	-58.4	-42.8	176.9	-72.7	174.1	-177.8	-175.1	0	112.5	K113 R114 M115 K121	K113-R117 VanDerWaalsContact O-CG 3.32Å; K113-R117 WeakPolarHBondContact O-CG 3.42Å; K113-R117 PolarHBondContact O-N 2.82Å; R114-R117 PolarHBondContact O-N 2.88Å; M115-R117 PolarHBondContact O-N 3.49Å; R117-K121 WeakPolarHBondContact O-CG 3.47Å; R117-K121 PolarHBondContact O-N 2.7Å; R117-K121 VanDerWaalsContact O-N 3.11Å
118	M	97.9	Very high	97.6	Very high	115 Å²	115	116 Å²	116	57%	0.567	54%	0.536	S	S	*	.	H	α-helix	trans	-63.7	-44.7	176.9	-69.9	-57.4	-64.5	0	0	111.4	R114 M115 L116 K121 E122	R114-M118 WeakPolarHBondContact O-CG 3.5Å; R114-M118 PolarHBondContact O-N 3.26Å; M115-M118 PolarHBondContact O-N 2.99Å; L116-M118 VanDerWaalsContact C-N 3.33Å; L116-M118 PolarHBondContact O-N 3.19Å; M118-K121 PolarHBondContact O-N 2.87Å; M118-E122 WeakPolarHBondContact O-CB 3.32Å; M118-E122 PolarHBondContact O-N 3.45Å
119	K	97.9	Very high	97.7	Very high	101 Å²	101	112.3 Å²	112.3	44%	0.439	53%	0.53	S	S	.	.	H	α-helix	trans	-67.5	-37.7	178.6	-73.6	-72	169	-163.1	0	112.9	M115 L116 E122 L123	M115-K119 WeakPolarHBondContact O-CB 3.43Å; M115-K119 WeakPolarHBondContact O-CG 3.32Å; M115-K119 PolarHBondContact O-N 3.32Å; L116-K119 PolarHBondContact O-N 3.37Å; K119-E122 WeakPolarHBondContact CD-OE2 3.33Å; K119-E122 WeakPolarHBondContact CE-OE2 3.36Å; K119-E122 IonicContact NZ-OE1 3.55Å; K119-E122 IonicContact NZ-OE2 3.31Å; K119-E122 PolarHBondContact NZ-OE2 3.05Å; K119-E122 PolarHBondContact O-N 3.32Å; K119-L123 WeakPolarHBondContact O-CB 3.46Å; K119-L123 VanDerWaalsContact O-CG 3.32Å; K119-L123 WeakPolarHBondContact O-CG 3.37Å; K119-L123 PolarHBondContact O-N 2.91Å
120	T	97.8	Very high	97.8	Very high	63 Å²	63	113.1 Å²	113.1	39%	0.387	54%	0.535	S	S	.	.	H	α-helix	trans	-61	-46.5	173.4	-55.9	0	0	0	0	110.9	L116 E122 L123 E124	L116-T120 PolarHBondContact O-N 2.95Å; L116-T120 PolarHBondContact O-OG1 3.48Å; T120-E122 PolarHBondContact O-N 3.47Å; T120-L123 PolarHBondContact O-N 3.38Å; T120-E124 WeakPolarHBondContact O-CG 3.4Å; T120-E124 PolarHBondContact O-N 3.39Å
121	K	97.6	Very high	97.8	Very high	143 Å²	143	112.7 Å²	112.7	62%	0.622	53%	0.534	S	S	*	.	H	α-helix	trans	-62	-41.7	175.3	-71.8	-179.6	178.2	-169.5	0	112.5	R117 M118 L123 E124 A125	R117-K121 WeakPolarHBondContact O-CG 3.47Å; R117-K121 PolarHBondContact O-N 2.7Å; R117-K121 VanDerWaalsContact O-N 3.11Å; M118-K121 PolarHBondContact O-N 2.87Å; K121-L123 VanDerWaalsContact C-N 3.34Å; K121-E124 PolarHBondContact O-N 3.26Å; K121-A125 WeakPolarHBondContact O-CB 3.48Å; K121-A125 PolarHBondContact O-N 2.99Å
122	E	98.1	Very high	97.8	Very high	74 Å²	74	114.3 Å²	114.3	35%	0.346	54%	0.536	S	S	.	.	H	α-helix	trans	-62	-42.2	176.1	-169.4	-169.5	155.2	0	0	111.4	M118 K119 T120 A125 K126	M118-E122 WeakPolarHBondContact O-CB 3.32Å; M118-E122 PolarHBondContact O-N 3.45Å; K119-E122 WeakPolarHBondContact CD-OE2 3.33Å; K119-E122 WeakPolarHBondContact CE-OE2 3.36Å; K119-E122 IonicContact NZ-OE1 3.55Å; K119-E122 IonicContact NZ-OE2 3.31Å; K119-E122 PolarHBondContact NZ-OE2 3.05Å; K119-E122 PolarHBondContact O-N 3.32Å; T120-E122 PolarHBondContact O-N 3.47Å; E122-A125 PolarHBondContact O-N 2.93Å; E122-K126 WeakPolarHBondContact O-CG 3.43Å; E122-K126 PolarHBondContact O-N 3.36Å; E122-K126 WeakPolarHBondContact OE1-CE 3.37Å; E122-K126 IonicContact OE1-NZ 2.86Å; E122-K126 PolarHBondContact OE1-NZ 3.11Å
123	L	98.2	Very high	97.9	Very high	95 Å²	95	114.1 Å²	114.1	50%	0.497	54%	0.535	S	S	.	.	H	α-helix	trans	-66.4	-41.4	176.5	-75.5	171.3	0	0	0	112.2	K119 T120 K121 K126 R127	K119-L123 WeakPolarHBondContact O-CB 3.46Å; K119-L123 VanDerWaalsContact O-CG 3.32Å; K119-L123 WeakPolarHBondContact O-CG 3.37Å; K119-L123 PolarHBondContact O-N 2.91Å; T120-L123 PolarHBondContact O-N 3.38Å; K121-L123 VanDerWaalsContact C-N 3.34Å; L123-K126 PolarHBondContact O-N 2.88Å; L123-R127 WeakPolarHBondContact O-CB 3.28Å; L123-R127 VanDerWaalsContact O-CG 3.28Å; L123-R127 WeakPolarHBondContact O-CG 3.38Å; L123-R127 PolarHBondContact O-N 2.97Å
124	E	97.9	Very high	97.9	Very high	90 Å²	90	112.8 Å²	112.8	42%	0.421	53%	0.533	S	S	.	.	H	α-helix	trans	-62	-43.6	174.9	-74.7	171	-169.1	0	0	111.7	T120 K121 R127 R128	T120-E124 WeakPolarHBondContact O-CG 3.4Å; T120-E124 PolarHBondContact O-N 3.39Å; K121-E124 PolarHBondContact O-N 3.26Å; E124-R127 PolarHBondContact O-N 3.32Å; E124-R128 WeakPolarHBondContact O-CG 3.45Å; E124-R128 PolarHBondContact O-N 3.49Å
125	A	97.7	Very high	97.8	Very high	59 Å²	59	109.5 Å²	109.5	49%	0.488	53%	0.528	S	S	.	.	H	α-helix	trans	-61.4	-45.3	175.5	0	0	0	0	0	111.8	K121 E122 R127 R128 L129	K121-A125 WeakPolarHBondContact O-CB 3.48Å; K121-A125 PolarHBondContact O-N 2.99Å; E122-A125 PolarHBondContact O-N 2.93Å; A125-R127 VanDerWaalsContact C-N 3.34Å; A125-R127 PolarHBondContact O-N 3.45Å; A125-R128 PolarHBondContact O-N 3.32Å; A125-L129 PolarHBondContact O-N 2.94Å; A125-L129 VanDerWaalsContact O-N 3.07Å
126	K	98	Very high	97.8	Very high	118 Å²	118	108.4 Å²	108.4	51%	0.513	52%	0.522	S	S	.	.	H	α-helix	trans	-63.3	-37.1	175.8	-73.7	178.3	-175.2	173.4	0	112.8	E122 L123 L129 L130	E122-K126 WeakPolarHBondContact O-CG 3.43Å; E122-K126 PolarHBondContact O-N 3.36Å; E122-K126 WeakPolarHBondContact OE1-CE 3.37Å; E122-K126 IonicContact OE1-NZ 2.86Å; E122-K126 PolarHBondContact OE1-NZ 3.11Å; L123-K126 PolarHBondContact O-N 2.88Å; K126-L129 PolarHBondContact O-N 3.33Å; K126-L130 WeakPolarHBondContact O-CB 3.45Å; K126-L130 PolarHBondContact O-N 3.27Å
127	R	98.1	Very high	97.8	Very high	173 Å²	173	108.1 Å²	108.1	65%	0.653	52%	0.519	S	S	*	.	H	α-helix	trans	-64.3	-42.8	176	-77.6	174.2	-179.3	-176.2	-0.4	111.8	L123 E124 A125 L130 S131	L123-R127 WeakPolarHBondContact O-CB 3.28Å; L123-R127 VanDerWaalsContact O-CG 3.28Å; L123-R127 WeakPolarHBondContact O-CG 3.38Å; L123-R127 PolarHBondContact O-N 2.97Å; E124-R127 PolarHBondContact O-N 3.32Å; A125-R127 VanDerWaalsContact C-N 3.34Å; A125-R127 PolarHBondContact O-N 3.45Å; R127-L130 PolarHBondContact O-N 2.99Å; R127-S131 PolarHBondContact O-N 3.3Å; R127-S131 PolarHBondContact O-OG 2.95Å
128	R	97.7	Very high	97.8	Very high	165 Å²	165	102.7 Å²	102.7	62%	0.623	51%	0.508	S	S	*	.	H	α-helix	trans	-61.7	-48.1	175.4	-67.8	179.4	-159.7	172.6	5	111.6	E124 A125 L130 S131 E132	E124-R128 WeakPolarHBondContact O-CG 3.45Å; E124-R128 PolarHBondContact O-N 3.49Å; A125-R128 PolarHBondContact O-N 3.32Å; R128-L130 VanDerWaalsContact C-N 3.27Å; R128-L130 PolarHBondContact O-N 3.48Å; R128-S131 WeakPolarHBondContact O-CB 3.26Å; R128-S131 PolarHBondContact O-N 2.99Å; R128-S131 VanDerWaalsContact O-N 3.13Å; R128-E132 WeakPolarHBondContact O-CG 3.4Å; R128-E132 PolarHBondContact O-N 3.43Å
129	L	97.8	Very high	97.8	Very high	111 Å²	111	104 Å²	104	58%	0.581	51%	0.508	S	S	*	.	H	α-helix	trans	-58.9	-39.7	176.5	-179.7	63.7	0	0	0	112.2	A125 K126 E132 L133	A125-L129 PolarHBondContact O-N 2.94Å; A125-L129 VanDerWaalsContact O-N 3.07Å; K126-L129 PolarHBondContact O-N 3.33Å; L129-E132 PolarHBondContact O-N 3.05Å; L129-L133 WeakPolarHBondContact O-CB 3.24Å; L129-L133 PolarHBondContact O-N 3.07Å
130	L	98	Very high	97.7	Very high	101 Å²	101	106.4 Å²	106.4	53%	0.529	51%	0.514	S	S	.	.	H	α-helix	trans	-65.7	-41.6	176.8	-176.6	65.1	0	0	0	111.8	K126 R127 R128 L133 I134	K126-L130 WeakPolarHBondContact O-CB 3.45Å; K126-L130 PolarHBondContact O-N 3.27Å; R127-L130 PolarHBondContact O-N 2.99Å; R128-L130 VanDerWaalsContact C-N 3.27Å; R128-L130 PolarHBondContact O-N 3.48Å; L130-L133 PolarHBondContact O-N 3.32Å; L130-I134 HydrophobicContact CD1-CD1 4.45Å; L130-I134 HydrophobicContact CG-CD1 4.04Å; L130-I134 VanDerWaalsContact O-CG1 3.26Å; L130-I134 WeakPolarHBondContact O-CG1 3.46Å; L130-I134 PolarHBondContact O-N 2.96Å
131	S	97.8	Very high	97.7	Very high	67 Å²	67	107.6 Å²	107.6	47%	0.469	52%	0.522	S	S	.	.	H	α-helix	trans	-60.8	-47.8	174.4	-66.9	0	0	0	0	111.7	R127 R128 L133 I134 D135	R127-S131 PolarHBondContact O-N 3.3Å; R127-S131 PolarHBondContact O-OG 2.95Å; R128-S131 WeakPolarHBondContact O-CB 3.26Å; R128-S131 PolarHBondContact O-N 2.99Å; R128-S131 VanDerWaalsContact O-N 3.13Å; S131-L133 VanDerWaalsContact C-N 3.29Å; S131-L133 PolarHBondContact O-N 2.87Å; S131-I134 PolarHBondContact O-N 2.92Å; S131-I134 VanDerWaalsContact O-N 3.14Å; S131-D135 PolarHBondContact O-N 2.96Å
132	E	97.5	Very high	97.7	Very high	122 Å²	122	107.2 Å²	107.2	57%	0.57	52%	0.522	S	S	*	.	H	α-helix	trans	-57.8	-41.2	176.1	-70.3	167.4	-163.8	0	0	111.9	R128 L129 D135 E136	R128-E132 WeakPolarHBondContact O-CG 3.4Å; R128-E132 PolarHBondContact O-N 3.43Å; L129-E132 PolarHBondContact O-N 3.05Å; E132-D135 PolarHBondContact O-N 3.13Å; E132-E136 WeakPolarHBondContact O-CB 3.46Å; E132-E136 PolarHBondContact O-N 3.44Å
133	L	98	Very high	97.7	Very high	113 Å²	113	106.1 Å²	106.1	59%	0.592	52%	0.52	S	S	*	.	H	α-helix	trans	-68.9	-35.7	178	-173.3	63.5	0	0	0	112.8	L129 L130 S131 M137	L129-L133 WeakPolarHBondContact O-CB 3.24Å; L129-L133 PolarHBondContact O-N 3.07Å; L130-L133 PolarHBondContact O-N 3.32Å; S131-L133 VanDerWaalsContact C-N 3.29Å; S131-L133 PolarHBondContact O-N 2.87Å; L133-M137 VanDerWaalsContact O-CB 3.24Å; L133-M137 WeakPolarHBondContact O-CB 3.32Å; L133-M137 PolarHBondContact O-N 3.14Å
134	I	97.7	Very high	97.7	Very high	84 Å²	84	105.2 Å²	105.2	43%	0.431	52%	0.518	S	S	.	.	H	α-helix	trans	-65.8	-44.7	174.8	-71.6	165.1	0	0	0	110.1	L130 S131 M137 S138	L130-I134 HydrophobicContact CD1-CD1 4.45Å; L130-I134 HydrophobicContact CG-CD1 4.04Å; L130-I134 VanDerWaalsContact O-CG1 3.26Å; L130-I134 WeakPolarHBondContact O-CG1 3.46Å; L130-I134 PolarHBondContact O-N 2.96Å; S131-I134 PolarHBondContact O-N 2.92Å; S131-I134 VanDerWaalsContact O-N 3.14Å; I134-M137 PolarHBondContact O-N 3.33Å; I134-S138 WeakPolarHBondContact O-CB 3.43Å; I134-S138 PolarHBondContact O-N 3.35Å
135	D	97.2	Very high	97.6	Very high	104 Å²	104	103.6 Å²	103.6	56%	0.556	52%	0.517	S	S	*	.	H	α-helix	trans	-62.9	-46.4	179	-66.6	-20.4	0	0	0	110.4	S131 E132 M137 S138 Y139	S131-D135 PolarHBondContact O-N 2.96Å; E132-D135 PolarHBondContact O-N 3.13Å; D135-M137 PolarHBondContact O-N 2.72Å; D135-S138 PolarHBondContact O-N 3.47Å; D135-S138 PolarHBondContact O-OG 2.97Å; D135-Y139 PolarHBondContact O-N 3.21Å
136	E	97.4	Very high	97.6	Very high	79 Å²	79	108.2 Å²	108.2	37%	0.369	52%	0.523	S	S	.	.	H	α-helix	trans	-61.2	-42.1	175.3	179.4	63.6	-161.8	0	0	112.4	E132 S138 Y139 R140	E132-E136 WeakPolarHBondContact O-CB 3.46Å; E132-E136 PolarHBondContact O-N 3.44Å; E136-S138 VanDerWaalsContact C-N 3.34Å; E136-Y139 PolarHBondContact O-N 2.96Å; E136-R140 VanDerWaalsContact O-CG 3.32Å; E136-R140 WeakPolarHBondContact O-CG 3.39Å; E136-R140 PolarHBondContact O-N 3.03Å; E136-R140 IonicContact OE1-CZ 2.69Å; E136-R140 VanDerWaalsContact OE1-CZ 3.23Å; E136-R140 IonicContact OE1-NE 2.74Å; E136-R140 PolarHBondContact OE1-NE 3.24Å; E136-R140 IonicContact OE1-NH2 3.89Å; E136-R140 PolarHBondContact OE1-NH2 3Å
137	M	97.8	Very high	97.6	Very high	114 Å²	114	106.9 Å²	106.9	56%	0.562	52%	0.521	S	S	*	.	H	α-helix	trans	-64.7	-39.6	175.9	-176.7	-170.1	71.8	0	0	111.5	L133 I134 D135 R140 T141	L133-M137 VanDerWaalsContact O-CB 3.24Å; L133-M137 WeakPolarHBondContact O-CB 3.32Å; L133-M137 PolarHBondContact O-N 3.14Å; I134-M137 PolarHBondContact O-N 3.33Å; D135-M137 PolarHBondContact O-N 2.72Å; M137-R140 PolarHBondContact O-N 3.43Å; M137-T141 WeakPolarHBondContact O-CB 3.38Å; M137-T141 PolarHBondContact O-N 2.93Å; M137-T141 PolarHBondContact O-OG1 3.45Å
138	S	97.3	Very high	97.5	Very high	66 Å²	66	103.9 Å²	103.9	46%	0.462	52%	0.515	S	S	.	.	H	α-helix	trans	-63.7	-45.4	178.1	78	0	0	0	0	111.1	I134 D135 E136 T141 E142	I134-S138 WeakPolarHBondContact O-CB 3.43Å; I134-S138 PolarHBondContact O-N 3.35Å; D135-S138 PolarHBondContact O-N 3.47Å; D135-S138 PolarHBondContact O-OG 2.97Å; E136-S138 VanDerWaalsContact C-N 3.34Å; S138-T141 WeakPolarHBondContact O-CB 3.5Å; S138-T141 PolarHBondContact O-N 3.2Å; S138-E142 PolarHBondContact O-N 2.9Å
139	Y	97.2	Very high	97.5	Very high	141 Å²	141	99.4 Å²	99.4	55%	0.553	51%	0.506	S	S	*	.	H	α-helix	trans	-60	-48.5	174.7	174.8	-107.3	0	0	0	111.9	D135 E136 T141 E142 V143	D135-Y139 PolarHBondContact O-N 3.21Å; E136-Y139 PolarHBondContact O-N 2.96Å; Y139-T141 VanDerWaalsContact C-N 3.28Å; Y139-T141 PolarHBondContact O-N 2.67Å; Y139-E142 PolarHBondContact O-N 3.41Å; Y139-V143 HydrophobicContact CD1-CG2 4.46Å; Y139-V143 HydrophobicContact CD2-CG2 4.41Å; Y139-V143 HydrophobicContact CE1-CG2 4.02Å; Y139-V143 HydrophobicContact CE2-CG2 3.97Å; Y139-V143 WeakPolarHBondContact O-CG2 3.41Å; Y139-V143 PolarHBondContact O-N 3.46Å
140	R	97.4	Very high	97.5	Very high	152 Å²	152	95.9 Å²	95.9	57%	0.574	49%	0.489	S	S	*	.	H	α-helix	trans	-60.3	-38.8	176.8	-72.4	178	-172.1	-164	3.8	112.5	E136 M137 E142 V143 V144	E136-R140 VanDerWaalsContact O-CG 3.32Å; E136-R140 WeakPolarHBondContact O-CG 3.39Å; E136-R140 PolarHBondContact O-N 3.03Å; E136-R140 IonicContact OE1-CZ 2.69Å; E136-R140 VanDerWaalsContact OE1-CZ 3.23Å; E136-R140 IonicContact OE1-NE 2.74Å; E136-R140 PolarHBondContact OE1-NE 3.24Å; E136-R140 IonicContact OE1-NH2 3.89Å; E136-R140 PolarHBondContact OE1-NH2 3Å; M137-R140 PolarHBondContact O-N 3.43Å; R140-E142 VanDerWaalsContact C-N 3.35Å; R140-V143 PolarHBondContact O-N 2.97Å; R140-V144 WeakPolarHBondContact O-CB 3.49Å; R140-V144 VanDerWaalsContact O-CG2 3.26Å; R140-V144 WeakPolarHBondContact O-CG2 3.34Å; R140-V144 PolarHBondContact O-N 3.34Å
141	T	97.7	Very high	97.5	Very high	89 Å²	89	94.4 Å²	94.4	55%	0.546	49%	0.486	S	S	.	.	H	α-helix	trans	-64.4	-42.2	178.5	-57	0	0	0	0	110.9	M137 S138 Y139 V144 S145	M137-T141 WeakPolarHBondContact O-CB 3.38Å; M137-T141 PolarHBondContact O-N 2.93Å; M137-T141 PolarHBondContact O-OG1 3.45Å; S138-T141 WeakPolarHBondContact O-CB 3.5Å; S138-T141 PolarHBondContact O-N 3.2Å; Y139-T141 VanDerWaalsContact C-N 3.28Å; Y139-T141 PolarHBondContact O-N 2.67Å; T141-V144 PolarHBondContact O-N 2.85Å; T141-S145 WeakPolarHBondContact O-CB 3.26Å; T141-S145 PolarHBondContact O-N 2.74Å
142	E	97.1	Very high	97.4	Very high	134 Å²	134	97.5 Å²	97.5	63%	0.626	49%	0.491	S	S	*	.	H	α-helix	trans	-62.6	-47.9	175.1	-171.4	176.6	-174.3	0	0	111.4	S138 Y139 R140 V144 S145 Y146	S138-E142 PolarHBondContact O-N 2.9Å; Y139-E142 PolarHBondContact O-N 3.41Å; R140-E142 VanDerWaalsContact C-N 3.35Å; E142-V144 VanDerWaalsContact C-N 3.35Å; E142-V144 PolarHBondContact O-N 3.45Å; E142-S145 PolarHBondContact O-N 2.89Å; E142-S145 VanDerWaalsContact O-N 3.14Å; E142-S145 PolarHBondContact O-OG 2.87Å; E142-Y146 PolarHBondContact O-N 3.4Å
143	V	97.6	Very high	97.4	Very high	51 Å²	51	97.7 Å²	97.7	31%	0.309	49%	0.49	S	S	.	.	H	α-helix	trans	-58.5	-45.1	176.6	172.5	0	0	0	0	111.5	Y139 R140 S145 Y146 L147	Y139-V143 HydrophobicContact CD1-CG2 4.46Å; Y139-V143 HydrophobicContact CD2-CG2 4.41Å; Y139-V143 HydrophobicContact CE1-CG2 4.02Å; Y139-V143 HydrophobicContact CE2-CG2 3.97Å; Y139-V143 WeakPolarHBondContact O-CG2 3.41Å; Y139-V143 PolarHBondContact O-N 3.46Å; R140-V143 PolarHBondContact O-N 2.97Å; V143-S145 VanDerWaalsContact C-N 3.34Å; V143-S145 PolarHBondContact O-N 2.97Å; V143-Y146 PolarHBondContact O-N 3.14Å; V143-L147 HydrophobicContact CG1-CD1 3.96Å; V143-L147 HydrophobicContact CG1-CG 4.33Å; V143-L147 WeakPolarHBondContact O-CB 3.46Å; V143-L147 WeakPolarHBondContact O-CG 3.25Å; V143-L147 PolarHBondContact O-N 3.36Å
144	V	97.8	Very high	97.4	Very high	76 Å²	76	98.3 Å²	98.3	46%	0.461	49%	0.488	S	S	.	.	H	α-helix	trans	-61.3	-43	176.6	168.7	0	0	0	0	111	R140 T141 E142 Y146 L147 Q148	R140-V144 WeakPolarHBondContact O-CB 3.49Å; R140-V144 VanDerWaalsContact O-CG2 3.26Å; R140-V144 WeakPolarHBondContact O-CG2 3.34Å; R140-V144 PolarHBondContact O-N 3.34Å; T141-V144 PolarHBondContact O-N 2.85Å; E142-V144 VanDerWaalsContact C-N 3.35Å; E142-V144 PolarHBondContact O-N 3.45Å; V144-Y146 VanDerWaalsContact C-N 3.33Å; V144-Y146 PolarHBondContact O-N 3.4Å; V144-L147 PolarHBondContact O-N 3.3Å; V144-Q148 HydrophobicContact CG1-CG 4.35Å; V144-Q148 WeakPolarHBondContact O-CB 3.48Å; V144-Q148 VanDerWaalsContact O-CG 3.25Å; V144-Q148 WeakPolarHBondContact O-CG 3.4Å; V144-Q148 PolarHBondContact O-N 3.1Å
145	S	97.4	Very high	97.3	Very high	57 Å²	57	99.1 Å²	99.1	40%	0.399	49%	0.493	S	S	.	.	H	α-helix	trans	-63.8	-38.4	178.2	78.9	0	0	0	0	112.7	T141 E142 V143 T149	T141-S145 WeakPolarHBondContact O-CB 3.26Å; T141-S145 PolarHBondContact O-N 2.74Å; E142-S145 PolarHBondContact O-N 2.89Å; E142-S145 VanDerWaalsContact O-N 3.14Å; E142-S145 PolarHBondContact O-OG 2.87Å; V143-S145 VanDerWaalsContact C-N 3.34Å; V143-S145 PolarHBondContact O-N 2.97Å; S145-T149 PolarHBondContact O-N 2.93Å; S145-T149 VanDerWaalsContact O-N 3.1Å; S145-T149 PolarHBondContact O-OG1 3.25Å
146	Y	97	Very high	97.3	Very high	156 Å²	156	100.7 Å²	100.7	61%	0.612	50%	0.497	S	S	*	.	H	α-helix	trans	-65.3	-50	174.6	171.7	-100	0	0	0	111	E142 V143 V144 Q148 T149 V150	E142-Y146 PolarHBondContact O-N 3.4Å; V143-Y146 PolarHBondContact O-N 3.14Å; V144-Y146 VanDerWaalsContact C-N 3.33Å; V144-Y146 PolarHBondContact O-N 3.4Å; Y146-Q148 VanDerWaalsContact C-N 3.33Å; Y146-Q148 PolarHBondContact O-N 3.3Å; Y146-T149 WeakPolarHBondContact O-CA 3.31Å; Y146-T149 WeakPolarHBondContact O-CB 3.25Å; Y146-T149 PolarHBondContact O-N 3.06Å; Y146-V150 HydrophobicContact CD1-CG2 4.29Å; Y146-V150 HydrophobicContact CD2-CG2 4.47Å; Y146-V150 HydrophobicContact CE1-CG2 3.82Å; Y146-V150 HydrophobicContact CE2-CG2 4.02Å; Y146-V150 WeakPolarHBondContact O-CG2 3.45Å; Y146-V150 PolarHBondContact O-N 2.83Å
147	L	97.7	Very high	97.3	Very high	90 Å²	90	101.1 Å²	101.1	47%	0.471	50%	0.499	S	S	.	.	H	α-helix	trans	-60.4	-41.4	178.1	-71.1	175.8	0	0	0	111.8	V143 V144 T149 V150 C151	V143-L147 HydrophobicContact CG1-CD1 3.96Å; V143-L147 HydrophobicContact CG1-CG 4.33Å; V143-L147 WeakPolarHBondContact O-CB 3.46Å; V143-L147 WeakPolarHBondContact O-CG 3.25Å; V143-L147 PolarHBondContact O-N 3.36Å; V144-L147 PolarHBondContact O-N 3.3Å; L147-T149 VanDerWaalsContact C-N 3.28Å; L147-T149 PolarHBondContact O-N 2.69Å; L147-V150 PolarHBondContact O-N 2.9Å; L147-C151 PolarHBondContact O-N 2.82Å; L147-C151 PolarHBondContact O-SG 3.17Å
148	Q	97.4	Very high	97.2	Very high	110 Å²	110	99 Å²	99	51%	0.514	50%	0.496	S	S	.	.	H	α-helix	trans	-59.4	-39.5	173.6	-76.8	175.6	-9.8	0	0	112.3	V144 Y146 K152	V144-Q148 HydrophobicContact CG1-CG 4.35Å; V144-Q148 WeakPolarHBondContact O-CB 3.48Å; V144-Q148 VanDerWaalsContact O-CG 3.25Å; V144-Q148 WeakPolarHBondContact O-CG 3.4Å; V144-Q148 PolarHBondContact O-N 3.1Å; Y146-Q148 VanDerWaalsContact C-N 3.33Å; Y146-Q148 PolarHBondContact O-N 3.3Å; Q148-K152 VanDerWaalsContact O-CG 3.31Å; Q148-K152 WeakPolarHBondContact O-CG 3.35Å; Q148-K152 PolarHBondContact O-N 3.14Å
149	T	96.9	Very high	97.2	Very high	71 Å²	71	100.5 Å²	100.5	44%	0.436	50%	0.495	S	S	.	.	H	α-helix	trans	-66.7	-40.8	176.4	-57.8	0	0	0	0	111.2	S145 Y146 L147 K153	S145-T149 PolarHBondContact O-N 2.93Å; S145-T149 VanDerWaalsContact O-N 3.1Å; S145-T149 PolarHBondContact O-OG1 3.25Å; Y146-T149 WeakPolarHBondContact O-CA 3.31Å; Y146-T149 WeakPolarHBondContact O-CB 3.25Å; Y146-T149 PolarHBondContact O-N 3.06Å; L147-T149 VanDerWaalsContact C-N 3.28Å; L147-T149 PolarHBondContact O-N 2.69Å; T149-K153 WeakPolarHBondContact O-CG 3.48Å; T149-K153 PolarHBondContact O-N 2.93Å; T149-K153 VanDerWaalsContact O-N 3.17Å
150	V	97.8	Very high	97.2	Very high	37 Å²	37	99.2 Å²	99.2	22%	0.224	50%	0.495	C	S	.	.	H	α-helix	trans	-64.7	-46.9	175.9	172.1	0	0	0	0	111.1	Y146 L147 K152 K153 F154	Y146-V150 HydrophobicContact CD1-CG2 4.29Å; Y146-V150 HydrophobicContact CD2-CG2 4.47Å; Y146-V150 HydrophobicContact CE1-CG2 3.82Å; Y146-V150 HydrophobicContact CE2-CG2 4.02Å; Y146-V150 WeakPolarHBondContact O-CG2 3.45Å; Y146-V150 PolarHBondContact O-N 2.83Å; L147-V150 PolarHBondContact O-N 2.9Å; V150-K152 PolarHBondContact O-N 3.05Å; V150-K153 WeakPolarHBondContact O-CB 3.49Å; V150-K153 PolarHBondContact O-N 3.05Å; V150-K153 VanDerWaalsContact O-N 3.14Å; V150-F154 HydrophobicContact CG1-CD2 3.6Å; V150-F154 HydrophobicContact CG1-CE2 3.4Å; V150-F154 VanDerWaalsContact O-CD2 3.29Å; V150-F154 WeakPolarHBondContact O-CD2 3.3Å; V150-F154 PolarHBondContact O-N 2.98Å
151	C	97.5	Very high	97.2	Very high	70 Å²	70	99.2 Å²	99.2	47%	0.473	50%	0.495	S	S	.	.	H	α-helix	trans	-56.2	-48.4	175.3	-70	0	0	0	0	111.5	L147 K153 F154 D155	L147-C151 PolarHBondContact O-N 2.82Å; L147-C151 PolarHBondContact O-SG 3.17Å; C151-K153 VanDerWaalsContact C-N 3.27Å; C151-K153 PolarHBondContact O-N 3.17Å; C151-F154 PolarHBondContact O-N 3.37Å; C151-D155 VanDerWaalsContact O-CG 3.25Å; C151-D155 PolarHBondContact O-N 3.04Å
152	K	97	Very high	97.2	Very high	131 Å²	131	100.4 Å²	100.4	57%	0.57	49%	0.492	S	S	*	.	H	α-helix	trans	-57.6	-38	176.9	-74.2	174.1	-178.1	178.7	0	113.1	Q148 V150 Q156	Q148-K152 VanDerWaalsContact O-CG 3.31Å; Q148-K152 WeakPolarHBondContact O-CG 3.35Å; Q148-K152 PolarHBondContact O-N 3.14Å; V150-K152 PolarHBondContact O-N 3.05Å; K152-Q156 WeakPolarHBondContact O-CB 3.44Å; K152-Q156 VanDerWaalsContact O-CG 3.25Å; K152-Q156 WeakPolarHBondContact O-CG 3.34Å; K152-Q156 PolarHBondContact O-N 3.43Å
153	K	96.6	Very high	97.2	Very high	127 Å²	127	100 Å²	100	55%	0.552	49%	0.488	S	S	*	.	H	α-helix	trans	-67	-42.7	175.6	-73.1	178.5	178.7	-177.4	0	111.6	T149 V150 C151 Q156 Q157	T149-K153 WeakPolarHBondContact O-CG 3.48Å; T149-K153 PolarHBondContact O-N 2.93Å; T149-K153 VanDerWaalsContact O-N 3.17Å; V150-K153 WeakPolarHBondContact O-CB 3.49Å; V150-K153 PolarHBondContact O-N 3.05Å; V150-K153 VanDerWaalsContact O-N 3.14Å; C151-K153 VanDerWaalsContact C-N 3.27Å; C151-K153 PolarHBondContact O-N 3.17Å; K153-Q156 PolarHBondContact O-N 3.44Å; K153-Q157 WeakPolarHBondContact O-CG 3.49Å; K153-Q157 PolarHBondContact O-N 2.94Å
154	F	97	Very high	97.2	Very high	126 Å²	126	101.1 Å²	101.1	55%	0.553	49%	0.49	S	S	*	.	H	α-helix	trans	-64.8	-41.2	175.8	-80.6	-65.7	0	0	0	112.1	V150 C151 Q156 Q157 S158	V150-F154 HydrophobicContact CG1-CD2 3.6Å; V150-F154 HydrophobicContact CG1-CE2 3.4Å; V150-F154 VanDerWaalsContact O-CD2 3.29Å; V150-F154 WeakPolarHBondContact O-CD2 3.3Å; V150-F154 PolarHBondContact O-N 2.98Å; C151-F154 PolarHBondContact O-N 3.37Å; F154-Q156 PolarHBondContact O-N 3.02Å; F154-Q157 PolarHBondContact O-N 3.49Å; F154-S158 VanDerWaalsContact O-CB 3.3Å; F154-S158 WeakPolarHBondContact O-CB 3.43Å; F154-S158 PolarHBondContact O-N 2.82Å
155	D	96.8	Very high	97.2	Very high	101 Å²	101	100.2 Å²	100.2	54%	0.54	49%	0.49	S	S	.	.	H	α-helix	trans	-60.5	-46.8	175.8	-65.2	-24.8	0	0	0	110.7	C151 Q157 S158 E159	C151-D155 VanDerWaalsContact O-CG 3.25Å; C151-D155 PolarHBondContact O-N 3.04Å; D155-Q157 PolarHBondContact O-N 3.21Å; D155-S158 WeakPolarHBondContact O-CB 3.47Å; D155-S158 PolarHBondContact O-N 3.45Å; D155-E159 WeakPolarHBondContact O-CG 3.34Å; D155-E159 PolarHBondContact O-N 3.31Å
156	Q	96.7	Very high	97.2	Very high	137 Å²	137	102.1 Å²	102.1	64%	0.64	49%	0.493	S	S	*	.	H	α-helix	trans	-59.7	-45.3	176.2	-74.6	172.3	0.4	0	0	112.4	K152 K153 F154 S158 E159 E160	K152-Q156 WeakPolarHBondContact O-CB 3.44Å; K152-Q156 VanDerWaalsContact O-CG 3.25Å; K152-Q156 WeakPolarHBondContact O-CG 3.34Å; K152-Q156 PolarHBondContact O-N 3.43Å; K153-Q156 PolarHBondContact O-N 3.44Å; F154-Q156 PolarHBondContact O-N 3.02Å; Q156-S158 VanDerWaalsContact C-N 3.33Å; Q156-S158 PolarHBondContact O-N 3.44Å; Q156-E159 PolarHBondContact O-N 3Å; Q156-E160 WeakPolarHBondContact O-CB 3.29Å; Q156-E160 PolarHBondContact O-N 3Å
157	Q	96.8	Very high	97.2	Very high	87 Å²	87	100.3 Å²	100.3	41%	0.407	49%	0.49	S	S	.	.	H	α-helix	trans	-66.8	-33.7	176.9	-73.7	-178.8	-0	0	0	113	K153 F154 D155 R161	K153-Q157 WeakPolarHBondContact O-CG 3.49Å; K153-Q157 PolarHBondContact O-N 2.94Å; F154-Q157 PolarHBondContact O-N 3.49Å; D155-Q157 PolarHBondContact O-N 3.21Å; Q157-R161 WeakPolarHBondContact O-CB 3.46Å; Q157-R161 WeakPolarHBondContact O-CG 3.41Å; Q157-R161 PolarHBondContact O-N 3.31Å; Q157-R161 VanDerWaalsContact O-N 3.07Å
158	S	96.8	Very high	97.1	Very high	70 Å²	70	103.2 Å²	103.2	49%	0.49	50%	0.496	S	S	.	.	H	α-helix	trans	-66.9	-46.5	176.7	-176.4	0	0	0	0	110.3	F154 D155 Q156 R161 K162	F154-S158 VanDerWaalsContact O-CB 3.3Å; F154-S158 WeakPolarHBondContact O-CB 3.43Å; F154-S158 PolarHBondContact O-N 2.82Å; D155-S158 WeakPolarHBondContact O-CB 3.47Å; D155-S158 PolarHBondContact O-N 3.45Å; Q156-S158 VanDerWaalsContact C-N 3.33Å; Q156-S158 PolarHBondContact O-N 3.44Å; S158-R161 PolarHBondContact O-N 2.97Å; S158-K162 WeakPolarHBondContact O-CB 3.48Å; S158-K162 PolarHBondContact O-N 2.9Å
159	E	97.2	Very high	97	Very high	97 Å²	97	104.2 Å²	104.2	45%	0.453	50%	0.501	S	S	.	.	H	α-helix	trans	-65.1	-39.2	177.3	-71.9	-59.4	125.7	0	0	112.6	D155 Q156 K162 K163	D155-E159 WeakPolarHBondContact O-CG 3.34Å; D155-E159 PolarHBondContact O-N 3.31Å; Q156-E159 PolarHBondContact O-N 3Å; E159-K162 PolarHBondContact O-N 3.5Å; E159-K163 WeakPolarHBondContact O-CG 3.47Å; E159-K163 PolarHBondContact O-N 3.45Å
160	E	97.2	Very high	96.9	Very high	115 Å²	115	108.1 Å²	108.1	54%	0.537	51%	0.512	S	S	.	.	H	α-helix	trans	-62.5	-46.8	174.3	-176	176.4	-172.2	0	0	111.7	Q156 K162 K163 Q164	Q156-E160 WeakPolarHBondContact O-CB 3.29Å; Q156-E160 PolarHBondContact O-N 3Å; E160-K162 VanDerWaalsContact C-N 3.34Å; E160-K162 PolarHBondContact O-N 3.46Å; E160-K163 PolarHBondContact O-N 3.07Å; E160-Q164 WeakPolarHBondContact O-CG 3.42Å; E160-Q164 PolarHBondContact O-N 2.99Å
161	R	97.4	Very high	96.8	Very high	152 Å²	152	111.6 Å²	111.6	57%	0.574	53%	0.526	S	S	*	.	H	α-helix	trans	-63.8	-38.6	177.1	-81	-171.4	-98	-135.3	-2.8	112.7	Q157 S158 Q164 A165	Q157-R161 WeakPolarHBondContact O-CB 3.46Å; Q157-R161 WeakPolarHBondContact O-CG 3.41Å; Q157-R161 PolarHBondContact O-N 3.31Å; Q157-R161 VanDerWaalsContact O-N 3.07Å; S158-R161 PolarHBondContact O-N 2.97Å; R161-Q164 PolarHBondContact O-N 3.19Å; R161-A165 WeakPolarHBondContact O-CB 3.25Å; R161-A165 PolarHBondContact O-N 3.43Å
162	K	97.7	Very high	96.5	Very high	113 Å²	113	114.2 Å²	114.2	49%	0.491	53%	0.534	S	S	.	.	H	α-helix	trans	-61.1	-47.8	175.3	-172.2	-173.9	176.4	-168.8	0	111.1	S158 E159 E160 Q164 A165 E166	S158-K162 WeakPolarHBondContact O-CB 3.48Å; S158-K162 PolarHBondContact O-N 2.9Å; E159-K162 PolarHBondContact O-N 3.5Å; E160-K162 VanDerWaalsContact C-N 3.34Å; E160-K162 PolarHBondContact O-N 3.46Å; K162-Q164 VanDerWaalsContact C-N 3.33Å; K162-Q164 PolarHBondContact O-N 2.91Å; K162-A165 WeakPolarHBondContact O-CB 3.39Å; K162-A165 PolarHBondContact O-N 3.35Å; K162-E166 VanDerWaalsContact CE-OE1 3.25Å; K162-E166 WeakPolarHBondContact CE-OE1 3.37Å; K162-E166 WeakPolarHBondContact O-CG 3.49Å; K162-E166 PolarHBondContact O-N 3.36Å
163	K	97.3	Very high	96.2	Very high	125 Å²	125	111.5 Å²	111.5	54%	0.543	53%	0.528	S	S	.	.	H	α-helix	trans	-61.4	-40.2	176.1	-72.6	174.3	-177	179.3	0	112.5	E159 E160 E166 Q167	E159-K163 WeakPolarHBondContact O-CG 3.47Å; E159-K163 PolarHBondContact O-N 3.45Å; E160-K163 PolarHBondContact O-N 3.07Å; K163-E166 PolarHBondContact O-N 3.5Å; K163-Q167 WeakPolarHBondContact O-CB 3.43Å; K163-Q167 VanDerWaalsContact O-CG 3.27Å; K163-Q167 WeakPolarHBondContact O-CG 3.29Å; K163-Q167 PolarHBondContact O-N 2.95Å
164	Q	97.6	Very high	95.9	Very high	75 Å²	75	107.4 Å²	107.4	35%	0.35	52%	0.516	S	S	.	.	H	α-helix	trans	-63.3	-43.3	174.9	-73.6	173.5	-2.3	0	0	111.4	E160 R161 K162 Q167 Y168	E160-Q164 WeakPolarHBondContact O-CG 3.42Å; E160-Q164 PolarHBondContact O-N 2.99Å; R161-Q164 PolarHBondContact O-N 3.19Å; K162-Q164 VanDerWaalsContact C-N 3.33Å; K162-Q164 PolarHBondContact O-N 2.91Å; Q164-Q167 PolarHBondContact O-N 2.85Å; Q164-Y168 HydrophobicContact CB-CD2 4.45Å; Q164-Y168 HydrophobicContact CB-CE2 4.18Å; Q164-Y168 WeakPolarHBondContact O-CD2 3.47Å; Q164-Y168 PolarHBondContact O-N 3.24Å
165	A	97.2	Very high	95.7	Very high	57 Å²	57	105.1 Å²	105.1	47%	0.471	52%	0.515	S	S	.	.	H	α-helix	trans	-61	-46	176.5	0	0	0	0	0	111.9	R161 K162 Q167 Y168 E169	R161-A165 WeakPolarHBondContact O-CB 3.25Å; R161-A165 PolarHBondContact O-N 3.43Å; K162-A165 WeakPolarHBondContact O-CB 3.39Å; K162-A165 PolarHBondContact O-N 3.35Å; A165-Q167 VanDerWaalsContact C-N 3.31Å; A165-Q167 PolarHBondContact O-N 3Å; A165-Y168 PolarHBondContact O-N 3.41Å; A165-E169 WeakPolarHBondContact O-CB 3.03Å; A165-E169 PolarHBondContact O-N 2.94Å
166	E	97	Very high	95.2	Very high	98 Å²	98	103.4 Å²	103.4	46%	0.458	50%	0.503	S	S	.	.	H	α-helix	trans	-60.6	-39.3	175.6	-70.3	169	-178.3	0	0	111.8	K162 K163 E169 F170	K162-E166 VanDerWaalsContact CE-OE1 3.25Å; K162-E166 WeakPolarHBondContact CE-OE1 3.37Å; K162-E166 WeakPolarHBondContact O-CG 3.49Å; K162-E166 PolarHBondContact O-N 3.36Å; K163-E166 PolarHBondContact O-N 3.5Å; E166-E169 PolarHBondContact O-N 3.26Å; E166-F170 WeakPolarHBondContact O-CB 3.27Å; E166-F170 PolarHBondContact O-N 3.45Å
167	Q	96.9	Very high	94.8	Very high	117 Å²	117	101.9 Å²	101.9	55%	0.547	50%	0.496	S	S	.	.	H	α-helix	trans	-66	-43.6	174.9	-74.6	173.5	3.1	0	0	112.4	K163 Q164 A165 E169 F170 Q171	K163-Q167 WeakPolarHBondContact O-CB 3.43Å; K163-Q167 VanDerWaalsContact O-CG 3.27Å; K163-Q167 WeakPolarHBondContact O-CG 3.29Å; K163-Q167 PolarHBondContact O-N 2.95Å; Q164-Q167 PolarHBondContact O-N 2.85Å; A165-Q167 VanDerWaalsContact C-N 3.31Å; A165-Q167 PolarHBondContact O-N 3Å; Q167-E169 VanDerWaalsContact C-N 3.35Å; Q167-F170 PolarHBondContact O-N 2.98Å; Q167-Q171 WeakPolarHBondContact O-CB 3.39Å; Q167-Q171 VanDerWaalsContact O-CG 3.29Å; Q167-Q171 WeakPolarHBondContact O-CG 3.49Å; Q167-Q171 PolarHBondContact O-N 3.47Å
168	Y	96.7	Very high	94.5	Very high	151 Å²	151	103 Å²	103	59%	0.592	50%	0.501	S	S	*	.	H	α-helix	trans	-66.9	-36.9	176.9	-70.8	-51.3	0	0	0	112	Q164 A165 Q171 L172	Q164-Y168 HydrophobicContact CB-CD2 4.45Å; Q164-Y168 HydrophobicContact CB-CE2 4.18Å; Q164-Y168 WeakPolarHBondContact O-CD2 3.47Å; Q164-Y168 PolarHBondContact O-N 3.24Å; A165-Y168 PolarHBondContact O-N 3.41Å; Y168-Q171 PolarHBondContact O-N 3.41Å; Y168-L172 VanDerWaalsContact O-CB 3.24Å; Y168-L172 WeakPolarHBondContact O-CB 3.38Å; Y168-L172 PolarHBondContact O-N 2.9Å
169	E	94.8	Very high	94.1	Very high	131 Å²	131	103.1 Å²	103.1	61%	0.612	50%	0.496	S	S	*	.	H	α-helix	trans	-62.5	-46.6	174	-173.9	176.4	-171.5	0	0	110.9	A165 E166 Q167 Q171 L172 V173	A165-E169 WeakPolarHBondContact O-CB 3.03Å; A165-E169 PolarHBondContact O-N 2.94Å; E166-E169 PolarHBondContact O-N 3.26Å; Q167-E169 VanDerWaalsContact C-N 3.35Å; E169-Q171 PolarHBondContact O-N 2.92Å; E169-L172 WeakPolarHBondContact O-CB 3.43Å; E169-L172 PolarHBondContact O-N 3.2Å; E169-V173 WeakPolarHBondContact O-CG2 3.24Å; E169-V173 PolarHBondContact O-N 2.83Å
170	F	95.2	Very high	93.6	Very high	153 Å²	153	99.2 Å²	99.2	67%	0.671	48%	0.482	S	S	*	.	H	α-helix	trans	-61.1	-44.7	175.3	-178.5	-95.5	0	0	0	112.4	E166 Q167 L172 V173 S174	E166-F170 WeakPolarHBondContact O-CB 3.27Å; E166-F170 PolarHBondContact O-N 3.45Å; Q167-F170 PolarHBondContact O-N 2.98Å; F170-L172 VanDerWaalsContact C-N 3.33Å; F170-L172 PolarHBondContact O-N 3.39Å; F170-V173 PolarHBondContact O-N 3.41Å; F170-S174 PolarHBondContact O-N 2.88Å
171	Q	95.5	Very high	93.2	Very high	111 Å²	111	100.4 Å²	100.4	52%	0.519	48%	0.481	S	S	.	.	H	α-helix	trans	-62.8	-40.2	176.3	-74.5	174.2	13.7	0	0	112	Q167 Y168 E169 S174 C175	Q167-Q171 WeakPolarHBondContact O-CB 3.39Å; Q167-Q171 VanDerWaalsContact O-CG 3.29Å; Q167-Q171 WeakPolarHBondContact O-CG 3.49Å; Q167-Q171 PolarHBondContact O-N 3.47Å; Y168-Q171 PolarHBondContact O-N 3.41Å; E169-Q171 PolarHBondContact O-N 2.92Å; Q171-S174 PolarHBondContact O-N 3.44Å; Q171-C175 WeakPolarHBondContact O-CB 3.5Å; Q171-C175 PolarHBondContact O-N 2.85Å
172	L	90.9	Very high	92.9	Very high	124 Å²	124	95.9 Å²	95.9	65%	0.649	48%	0.477	S	S	*	.	H	α-helix	trans	-62.3	-46.6	177.5	-174.5	74	0	0	0	110.7	Y168 E169 F170 C175 H176	Y168-L172 VanDerWaalsContact O-CB 3.24Å; Y168-L172 WeakPolarHBondContact O-CB 3.38Å; Y168-L172 PolarHBondContact O-N 2.9Å; E169-L172 WeakPolarHBondContact O-CB 3.43Å; E169-L172 PolarHBondContact O-N 3.2Å; F170-L172 VanDerWaalsContact C-N 3.33Å; F170-L172 PolarHBondContact O-N 3.39Å; L172-C175 PolarHBondContact O-N 3.48Å; L172-H176 WeakPolarHBondContact O-CB 3.15Å; L172-H176 PolarHBondContact O-N 3.27Å
173	V	90.4	Very high	92.5	Very high	74 Å²	74	92.2 Å²	92.2	45%	0.448	46%	0.46	S	S	.	.	H	α-helix	trans	-61.2	-48.5	176.7	173.3	0	0	0	0	110.9	E169 F170 C175 H176 E177	E169-V173 WeakPolarHBondContact O-CG2 3.24Å; E169-V173 PolarHBondContact O-N 2.83Å; F170-V173 PolarHBondContact O-N 3.41Å; V173-C175 PolarHBondContact O-N 2.98Å; V173-H176 WeakPolarHBondContact O-CB 3.49Å; V173-H176 PolarHBondContact O-N 3.37Å; V173-E177 WeakPolarHBondContact O-CG 3.37Å; V173-E177 PolarHBondContact O-N 3.46Å
174	S	91.5	Very high	92.2	Very high	42 Å²	42	87.3 Å²	87.3	29%	0.294	44%	0.44	S	S	.	.	H	α-helix	trans	-59.7	-46.9	178.4	-171.1	0	0	0	0	112.3	F170 Q171 H176 E177 E178	F170-S174 PolarHBondContact O-N 2.88Å; Q171-S174 PolarHBondContact O-N 3.44Å; S174-H176 VanDerWaalsContact C-N 3.3Å; S174-H176 PolarHBondContact O-N 2.99Å; S174-E177 PolarHBondContact O-N 3.48Å; S174-E178 WeakPolarHBondContact O-CG 3.39Å; S174-E178 PolarHBondContact O-N 3.4Å
175	C	91.6	Very high	91.9	Very high	77 Å²	77	89.4 Å²	89.4	52%	0.52	45%	0.449	S	S	.	.	H	α-helix	trans	-63	-39.7	177.5	-176.8	0	0	0	0	111.2	Q171 L172 V173 E178 L179	Q171-C175 WeakPolarHBondContact O-CB 3.5Å; Q171-C175 PolarHBondContact O-N 2.85Å; L172-C175 PolarHBondContact O-N 3.48Å; V173-C175 PolarHBondContact O-N 2.98Å; C175-E178 PolarHBondContact O-N 2.94Å; C175-L179 VanDerWaalsContact O-CB 3.3Å; C175-L179 WeakPolarHBondContact O-CB 3.2Å; C175-L179 PolarHBondContact O-N 3.38Å
176	H	87	Confident	91.6	Very high	65 Å²	65	89.6 Å²	89.6	30%	0.301	44%	0.44	S	S	.	.	H	α-helix	trans	-65.4	-41.8	178.3	-171.2	59.9	0	0	0	112.2	L172 V173 S174 L179 G180 P384	L172-H176 WeakPolarHBondContact O-CB 3.15Å; L172-H176 PolarHBondContact O-N 3.27Å; V173-H176 WeakPolarHBondContact O-CB 3.49Å; V173-H176 PolarHBondContact O-N 3.37Å; S174-H176 VanDerWaalsContact C-N 3.3Å; S174-H176 PolarHBondContact O-N 2.99Å; H176-L179 PolarHBondContact O-N 3.47Å; H176-G180 PolarHBondContact O-N 2.85Å; H176-P384 WeakPolarHBondContact CE1-CD 3.48Å; H176-P384 WeakPolarHBondContact CE1-CG 3.22Å; H176-P384 WeakPolarHBondContact NE2-CD 3.48Å; H176-P384 WeakPolarHBondContact NE2-CG 3.46Å
177	E	88.1	Confident	91.4	Very high	105 Å²	105	84.9 Å²	84.9	49%	0.491	42%	0.418	S	S	.	.	H	α-helix	trans	-65.9	-41.1	174	-70.8	-177.1	-178	0	0	112.8	V173 S174 G180 R181	V173-E177 WeakPolarHBondContact O-CG 3.37Å; V173-E177 PolarHBondContact O-N 3.46Å; S174-E177 PolarHBondContact O-N 3.48Å; E177-G180 PolarHBondContact O-N 3.46Å; E177-R181 WeakPolarHBondContact O-CG 3.31Å; E177-R181 PolarHBondContact O-N 2.89Å; E177-R181 IonicContact OE2-NH1 3.83Å
178	E	90.4	Very high	91.1	Very high	110 Å²	110	81.1 Å²	81.1	51%	0.514	40%	0.403	S	S	.	.	H	α-helix	trans	-61.8	-45.4	175.2	-76	176.2	-165.2	0	0	111.7	S174 C175 R181 A182	S174-E178 WeakPolarHBondContact O-CG 3.39Å; S174-E178 PolarHBondContact O-N 3.4Å; C175-E178 PolarHBondContact O-N 2.94Å; E178-R181 PolarHBondContact O-N 3.37Å; E178-A182 WeakPolarHBondContact O-CB 3.43Å; E178-A182 PolarHBondContact O-N 3.38Å
179	L	88.7	Confident	90.9	Very high	74 Å²	74	79.8 Å²	79.8	39%	0.387	40%	0.397	S	S	.	.	H	α-helix	trans	-63	-43.6	175.4	-178	62.5	0	0	0	111.3	C175 H176 R181 A182 R183	C175-L179 VanDerWaalsContact O-CB 3.3Å; C175-L179 WeakPolarHBondContact O-CB 3.2Å; C175-L179 PolarHBondContact O-N 3.38Å; H176-L179 PolarHBondContact O-N 3.47Å; L179-R181 PolarHBondContact O-N 2.93Å; L179-A182 PolarHBondContact O-N 2.6Å; L179-R183 HydrophobicContact CD1-CG 4.36Å; L179-R183 HydrophobicContact CG-CG 4.47Å; L179-R183 WeakPolarHBondContact O-CB 3.3Å; L179-R183 VanDerWaalsContact O-CG 3.3Å; L179-R183 WeakPolarHBondContact O-CG 3.23Å; L179-R183 PolarHBondContact O-N 2.87Å
180	G	87	Confident	90.8	Very high	14 Å²	14	73.9 Å²	73.9	14%	0.144	37%	0.37	C	S	.	.	H	α-helix	trans	-57.4	-48.2	175.1	0	0	0	0	0	111.9	H176 E177 A182 R183 C184	H176-G180 PolarHBondContact O-N 2.85Å; E177-G180 PolarHBondContact O-N 3.46Å; G180-A182 PolarHBondContact O-N 3.14Å; G180-R183 PolarHBondContact O-N 3.08Å; G180-C184 WeakPolarHBondContact O-CB 3.41Å; G180-C184 PolarHBondContact O-N 3.29Å; G180-C184 PolarHBondContact O-SG 3.24Å
181	R	88.7	Confident	90.5	Very high	141 Å²	141	66.6 Å²	66.6	53%	0.532	34%	0.338	S	S	.	.	H	α-helix	trans	-60.9	-42.8	175.5	-73.3	-173.3	-66.5	-94.4	3.6	112.5	E177 E178 L179 K185	E177-R181 WeakPolarHBondContact O-CG 3.31Å; E177-R181 PolarHBondContact O-N 2.89Å; E177-R181 IonicContact OE2-NH1 3.83Å; E178-R181 PolarHBondContact O-N 3.37Å; L179-R181 PolarHBondContact O-N 2.93Å; R181-K185 WeakPolarHBondContact O-CB 3.09Å; R181-K185 PolarHBondContact O-N 3.05Å
182	A	90.2	Very high	90.2	Very high	57 Å²	57	65.3 Å²	65.3	47%	0.471	33%	0.332	S	S	.	.	H	α-helix	trans	-64.7	-43.2	178.3	0	0	0	0	0	111.8	E178 L179 G180 K185 M186	E178-A182 WeakPolarHBondContact O-CB 3.43Å; E178-A182 PolarHBondContact O-N 3.38Å; L179-A182 PolarHBondContact O-N 2.6Å; G180-A182 PolarHBondContact O-N 3.14Å; A182-K185 PolarHBondContact O-N 3.37Å; A182-M186 WeakPolarHBondContact O-CB 3.41Å; A182-M186 PolarHBondContact O-N 2.91Å
183	R	90.8	Very high	90.1	Very high	36 Å²	36	65 Å²	65	14%	0.136	33%	0.331	C	S	.	.	H	α-helix	trans	-61.3	-51.8	175.3	-76.1	177.2	167.1	164.6	-1.3	111.5	L179 G180 K185 M186 V187 V313 D315 G382	L179-R183 HydrophobicContact CD1-CG 4.36Å; L179-R183 HydrophobicContact CG-CG 4.47Å; L179-R183 WeakPolarHBondContact O-CB 3.3Å; L179-R183 VanDerWaalsContact O-CG 3.3Å; L179-R183 WeakPolarHBondContact O-CG 3.23Å; L179-R183 PolarHBondContact O-N 2.87Å; G180-R183 PolarHBondContact O-N 3.08Å; R183-K185 VanDerWaalsContact C-N 3.33Å; R183-K185 PolarHBondContact O-N 3.49Å; R183-M186 PolarHBondContact O-N 3.33Å; R183-M186 VanDerWaalsContact O-N 3.11Å; R183-V187 WeakPolarHBondContact O-CG2 3.5Å; R183-V187 PolarHBondContact O-N 2.85Å; R183-V313 HydrophobicContact CB-CG1 4.3Å; R183-V313 WeakPolarHBondContact CD-O 3.26Å; R183-V313 HydrophobicContact CG-CG1 4.19Å; R183-V313 WeakPolarHBondContact CG-O 3.29Å; R183-V313 PolarHBondContact NE-O 3.28Å; R183-D315 VanDerWaalsContact NH2-CB 3.31Å; R183-G382 PolarHBondContact NH1-O 3.36Å
184	C	90.4	Very high	90	Very high	21 Å²	21	63.7 Å²	63.7	14%	0.142	32%	0.323	C	S	.	.	H	α-helix	trans	-54.5	-50.8	178.2	-65.8	0	0	0	0	110.6	G180 M186 V187 T188 V378	G180-C184 WeakPolarHBondContact O-CB 3.41Å; G180-C184 PolarHBondContact O-N 3.29Å; G180-C184 PolarHBondContact O-SG 3.24Å; C184-M186 VanDerWaalsContact C-N 3.32Å; C184-M186 PolarHBondContact O-N 3.23Å; C184-V187 PolarHBondContact O-N 3.15Å; C184-T188 PolarHBondContact O-N 3.44Å; C184-T188 PolarHBondContact O-OG1 3.26Å; C184-V378 WeakPolarHBondContact CB-O 3.38Å; C184-V378 PolarHBondContact SG-O 3.05Å
185	K	90.8	Very high	90	Very high	120 Å²	120	62 Å²	62	52%	0.522	31%	0.31	S	S	.	.	H	α-helix	trans	-58.2	-41.4	177.7	-177.3	179	-179.8	-179.9	0	113.1	R181 A182 R183 R189	R181-K185 WeakPolarHBondContact O-CB 3.09Å; R181-K185 PolarHBondContact O-N 3.05Å; A182-K185 PolarHBondContact O-N 3.37Å; R183-K185 VanDerWaalsContact C-N 3.33Å; R183-K185 PolarHBondContact O-N 3.49Å; K185-R189 WeakPolarHBondContact O-CG 3.37Å; K185-R189 PolarHBondContact O-N 3.49Å; K185-R189 VanDerWaalsContact O-N 3.11Å
186	M	91.6	Very high	89.7	Confident	60 Å²	60	60.3 Å²	60.3	30%	0.296	30%	0.299	S	S	.	.	H	α-helix	trans	-68.4	-43.2	178.5	-175.3	63	178.3	0	0	111.4	A182 R183 C184 R189 L190 V313	A182-M186 WeakPolarHBondContact O-CB 3.41Å; A182-M186 PolarHBondContact O-N 2.91Å; R183-M186 PolarHBondContact O-N 3.33Å; R183-M186 VanDerWaalsContact O-N 3.11Å; C184-M186 VanDerWaalsContact C-N 3.32Å; C184-M186 PolarHBondContact O-N 3.23Å; M186-R189 PolarHBondContact O-N 2.73Å; M186-L190 HydrophobicContact CE-CD1 4.28Å; M186-L190 HydrophobicContact CE-CD2 4.29Å; M186-L190 HydrophobicContact CE-CG 4.25Å; M186-L190 HydrophobicContact CG-CD1 4.3Å; M186-L190 WeakPolarHBondContact O-CG 3.41Å; M186-L190 PolarHBondContact O-N 2.93Å; M186-V313 HydrophobicContact CB-CG1 3.96Å; M186-V313 HydrophobicContact CG-CB 4.5Å; M186-V313 HydrophobicContact CG-CG1 3.96Å; M186-V313 HydrophobicContact CG-CG2 3.67Å
187	V	91.7	Very high	89.6	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-62.3	-43.2	175.8	174.3	0	0	0	0	111	R183 C184 R189 L190 L191 L310 V313 L314 V378 L381	R183-V187 WeakPolarHBondContact O-CG2 3.5Å; R183-V187 PolarHBondContact O-N 2.85Å; C184-V187 PolarHBondContact O-N 3.15Å; V187-R189 PolarHBondContact O-N 3.19Å; V187-L190 PolarHBondContact O-N 2.72Å; V187-L191 HydrophobicContact CG1-CD1 3.59Å; V187-L191 HydrophobicContact CG1-CG 4.26Å; V187-L191 WeakPolarHBondContact O-CB 3.01Å; V187-L191 WeakPolarHBondContact O-CG 2.99Å; V187-L191 PolarHBondContact O-N 3.12Å; V187-L310 HydrophobicContact CB-CD2 4.18Å; V187-L310 HydrophobicContact CG1-CD2 3.72Å; V187-L310 HydrophobicContact CG2-CD2 3.88Å; V187-V313 HydrophobicContact CG2-CG1 4.01Å; V187-L314 HydrophobicContact CG2-CD1 4.35Å; V187-L314 HydrophobicContact CG2-CD2 3.99Å; V187-L314 HydrophobicContact CG2-CG 4.12Å; V187-V378 HydrophobicContact CG1-CG2 4.22Å; V187-L381 HydrophobicContact CB-CD1 3.86Å; V187-L381 HydrophobicContact CG1-CD1 3.48Å; V187-L381 VanDerWaalsContact CG1-CD1 3.48Å; V187-L381 HydrophobicContact CG2-CD1 4.06Å
188	T	91	Very high	89.3	Confident	37 Å²	37	57.2 Å²	57.2	23%	0.227	28%	0.284	C	S	.	.	H	α-helix	trans	-54.7	-51.8	173.6	-46	0	0	0	0	110.7	C184 L190 L191 E192 V378	C184-T188 PolarHBondContact O-N 3.44Å; C184-T188 PolarHBondContact O-OG1 3.26Å; T188-L190 VanDerWaalsContact C-N 3.31Å; T188-L190 PolarHBondContact O-N 2.81Å; T188-L191 PolarHBondContact O-N 3.31Å; T188-E192 HydrophobicContact CG2-CG 4.05Å; T188-E192 WeakPolarHBondContact CG2-OE2 3.17Å; T188-E192 VanDerWaalsContact O-CB 3.25Å; T188-E192 WeakPolarHBondContact O-CB 3.33Å; T188-E192 VanDerWaalsContact O-CG 3.3Å; T188-E192 WeakPolarHBondContact O-CG 3.06Å; T188-E192 PolarHBondContact O-N 3.46Å; T188-V378 WeakPolarHBondContact OG1-CG1 3.34Å
189	R	92.2	Very high	88.8	Confident	123 Å²	123	55 Å²	55	46%	0.464	28%	0.279	S	S	.	.	H	α-helix	trans	-60.3	-40.9	179.1	-72.7	174	170.8	-170.5	-8.4	112.4	K185 M186 V187 D193 V194	K185-R189 WeakPolarHBondContact O-CG 3.37Å; K185-R189 PolarHBondContact O-N 3.49Å; K185-R189 VanDerWaalsContact O-N 3.11Å; M186-R189 PolarHBondContact O-N 2.73Å; V187-R189 PolarHBondContact O-N 3.19Å; R189-D193 WeakPolarHBondContact CG-OD2 3.3Å; R189-D193 WeakPolarHBondContact O-CA 3.35Å; R189-D193 VanDerWaalsContact O-CB 3.3Å; R189-D193 WeakPolarHBondContact O-CB 3.41Å; R189-D193 PolarHBondContact O-N 2.98Å; R189-V194 PolarHBondContact O-N 2.72Å
190	L	92.7	Very high	88.2	Confident	7 Å²	7	54 Å²	54	4%	0.037	28%	0.275	C	S	.	.	I	π-helix	trans	-63.7	-42.7	177.6	-73.9	172.5	0	0	0	111.8	M186 V187 T188 V194 F195 L306 L309 L310 V313	M186-L190 HydrophobicContact CE-CD1 4.28Å; M186-L190 HydrophobicContact CE-CD2 4.29Å; M186-L190 HydrophobicContact CE-CG 4.25Å; M186-L190 HydrophobicContact CG-CD1 4.3Å; M186-L190 WeakPolarHBondContact O-CG 3.41Å; M186-L190 PolarHBondContact O-N 2.93Å; V187-L190 PolarHBondContact O-N 2.72Å; T188-L190 VanDerWaalsContact C-N 3.31Å; T188-L190 PolarHBondContact O-N 2.81Å; L190-V194 HydrophobicContact CD2-CB 4.39Å; L190-V194 HydrophobicContact CD2-CG2 4.36Å; L190-F195 HydrophobicContact CD2-CD2 4.38Å; L190-F195 HydrophobicContact CD2-CE2 4.24Å; L190-F195 WeakPolarHBondContact O-CA 3.46Å; L190-F195 WeakPolarHBondContact O-CB 3.39Å; L190-F195 PolarHBondContact O-N 3.21Å; L190-L306 HydrophobicContact CB-CD1 4.06Å; L190-L309 HydrophobicContact CD1-CB 4.16Å; L190-L309 HydrophobicContact CD2-CD1 4.1Å; L190-L310 HydrophobicContact CB-CD2 4.35Å; L190-L310 HydrophobicContact CD1-CD2 3.99Å; L190-V313 HydrophobicContact CD1-CG2 4.18Å
191	L	90.4	Very high	87	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	30%	0.301	C	S	.	.	I	π-helix	trans	-84.2	-21.6	-176.6	-69.1	172.2	0	0	0	114.4	V187 T188 P196 I197 L306 L310 R375 V378	V187-L191 HydrophobicContact CG1-CD1 3.59Å; V187-L191 HydrophobicContact CG1-CG 4.26Å; V187-L191 WeakPolarHBondContact O-CB 3.01Å; V187-L191 WeakPolarHBondContact O-CG 2.99Å; V187-L191 PolarHBondContact O-N 3.12Å; T188-L191 PolarHBondContact O-N 3.31Å; L191-P196 WeakPolarHBondContact O-CA 3.38Å; L191-I197 HydrophobicContact CD2-CD1 4.16Å; L191-L306 HydrophobicContact CD2-CD1 4.15Å; L191-L306 HydrophobicContact CD2-CD2 3.79Å; L191-L306 HydrophobicContact CD2-CG 4.47Å; L191-L310 HydrophobicContact CD2-CD1 4.32Å; L191-R375 HydrophobicContact CB-CG 4.37Å; L191-R375 HydrophobicContact CD1-CB 3.91Å; L191-R375 HydrophobicContact CD1-CG 4.26Å; L191-V378 HydrophobicContact CD1-CG2 4.4Å
192	E	88.6	Confident	85.4	Confident	84 Å²	84	55.2 Å²	55.2	39%	0.393	29%	0.291	S	S	.	.	I	π-helix	trans	-107.6	-40.1	-176.4	-59.1	-164.7	148.3	0	0	113.1	T188 R375	T188-E192 HydrophobicContact CG2-CG 4.05Å; T188-E192 WeakPolarHBondContact CG2-OE2 3.17Å; T188-E192 VanDerWaalsContact O-CB 3.25Å; T188-E192 WeakPolarHBondContact O-CB 3.33Å; T188-E192 VanDerWaalsContact O-CG 3.3Å; T188-E192 WeakPolarHBondContact O-CG 3.06Å; T188-E192 PolarHBondContact O-N 3.46Å; E192-R375 IonicContact OE1-CZ 3.6Å; E192-R375 IonicContact OE1-NE 3.29Å; E192-R375 PolarHBondContact OE1-NE 3.07Å; E192-R375 IonicContact OE1-NH2 3.06Å; E192-R375 PolarHBondContact OE1-NH2 3.12Å
193	D	88.3	Confident	83.2	Confident	117 Å²	117	58 Å²	58	63%	0.626	30%	0.304	S	S	*	.	I	π-helix	trans	-102.2	-41.5	-172.4	-55.5	-37	0	0	0	112.4	R189	R189-D193 WeakPolarHBondContact CG-OD2 3.3Å; R189-D193 WeakPolarHBondContact O-CA 3.35Å; R189-D193 VanDerWaalsContact O-CB 3.3Å; R189-D193 WeakPolarHBondContact O-CB 3.41Å; R189-D193 PolarHBondContact O-N 2.98Å
194	V	89	Confident	80.8	Confident	48 Å²	48	64.1 Å²	64.1	29%	0.291	33%	0.334	S	S	.	.	I	π-helix	trans	-92.9	-46.9	-172.1	-171.8	0	0	0	0	112	R189 L190 P196	R189-V194 PolarHBondContact O-N 2.72Å; L190-V194 HydrophobicContact CD2-CB 4.39Å; L190-V194 HydrophobicContact CD2-CG2 4.36Å; V194-P196 VanDerWaalsContact C-CD 3.42Å
195	F	89.9	Confident	78.2	Confident	5 Å²	5	71.8 Å²	71.8	2%	0.022	37%	0.368	C	S	.	.	S	Bend	trans	-126.9	64.5	-179.7	-57.3	-80.9	0	0	0	110.3	L190 I197 F253 V254 Y302 Q305 L306 L309	L190-F195 HydrophobicContact CD2-CD2 4.38Å; L190-F195 HydrophobicContact CD2-CE2 4.24Å; L190-F195 WeakPolarHBondContact O-CA 3.46Å; L190-F195 WeakPolarHBondContact O-CB 3.39Å; L190-F195 PolarHBondContact O-N 3.21Å; F195-I197 PolarHBondContact O-N 3.43Å; F195-F253 HydrophobicContact CB-CE1 3.91Å; F195-F253 HydrophobicContact CB-CZ 4.15Å; F195-F253 HydrophobicContact CD1-CE1 4.17Å; F195-F253 HydrophobicContact CG-CE1 4.49Å; F195-V254 HydrophobicContact CD1-CG2 4.22Å; F195-Y302 HydrophobicContact CE1-CD1 4.11Å; F195-Q305 HydrophobicContact CZ-CB 4.45Å; F195-Q305 HydrophobicContact CZ-CG 3.98Å; F195-L306 HydrophobicContact CB-CB 4.44Å; F195-L306 HydrophobicContact CB-CD1 4.13Å; F195-L306 HydrophobicContact CB-CD2 4.06Å; F195-L306 HydrophobicContact CB-CG 4.44Å; F195-L306 HydrophobicContact CD2-CB 4.12Å; F195-L306 HydrophobicContact CD2-CD1 3.71Å; F195-L306 HydrophobicContact CD2-CG 4.43Å; F195-L306 HydrophobicContact CE2-CD1 4.48Å; F195-L306 HydrophobicContact CG-CB 4.12Å; F195-L306 HydrophobicContact CG-CD1 4.17Å; F195-L309 HydrophobicContact CE2-CD1 3.71Å; F195-L309 HydrophobicContact CZ-CD1 4.13Å
196	P	87.2	Confident	75.2	Confident	43 Å²	43	73 Å²	73	28%	0.279	38%	0.38	S	S	.	.			trans	-57.8	130.4	179.7	23.7	-34.9	0	0	0	111.6	L191 V194	L191-P196 WeakPolarHBondContact O-CA 3.38Å; V194-P196 VanDerWaalsContact C-CD 3.42Å
197	I	84.1	Confident	72.7	Confident	5 Å²	5	76.2 Å²	76.2	3%	0.026	40%	0.403	C	S	.	.			trans	-111.4	109.3	172.5	-38.4	-174.9	0	0	0	108.3	L191 F195 F251 F253 L306 L371 V372	L191-I197 HydrophobicContact CD2-CD1 4.16Å; F195-I197 PolarHBondContact O-N 3.43Å; I197-F251 HydrophobicContact CG2-CB 4.19Å; I197-F251 HydrophobicContact CG2-CD1 4.12Å; I197-F253 HydrophobicContact CB-CD2 4.44Å; I197-F253 HydrophobicContact CB-CE2 4.26Å; I197-F253 HydrophobicContact CD1-CD2 4.49Å; I197-F253 HydrophobicContact CD1-CE2 3.55Å; I197-F253 HydrophobicContact CD1-CZ 4.13Å; I197-F253 HydrophobicContact CG1-CD2 4Å; I197-F253 HydrophobicContact CG1-CE2 3.38Å; I197-F253 HydrophobicContact CG1-CZ 4Å; I197-F253 HydrophobicContact CG2-CD2 4.14Å; I197-F253 HydrophobicContact CG2-CE2 4.18Å; I197-L306 HydrophobicContact CD1-CD2 4.33Å; I197-L371 HydrophobicContact CD1-CB 3.66Å; I197-L371 HydrophobicContact CD1-CD1 4.29Å; I197-V372 HydrophobicContact CB-CG2 4.11Å; I197-V372 HydrophobicContact CG2-CG2 3.64Å
198	E	81.8	Confident	69.7	Low	99 Å²	99	84 Å²	84	46%	0.463	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	131.4	176	-67.1	179.5	167.7	0	0	109.8	F251 K252	E198-F251 WeakPolarHBondContact O-CA 3.49Å; E198-K252 HydrophobicContact CB-CB 4.21Å; E198-K252 PolarHBondContact N-O 3.38Å; E198-K252 PolarHBondContact O-N 3.26Å; E198-K252 WeakPolarHBondContact OE2-CD 3.34Å; E198-K252 WeakPolarHBondContact OE2-CE 3.5Å; E198-K252 IonicContact OE2-NZ 3.63Å; E198-K252 PolarHBondContact OE2-NZ 3.31Å
199	V	80.2	Confident	67	Low	65 Å²	65	88.2 Å²	88.2	39%	0.394	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	115.2	173.4	-175.2	0	0	0	0	108.5	V249 F251 V372	V199-V249 HydrophobicContact CG1-CG1 3.42Å; V199-V249 VanDerWaalsContact CG1-CG1 3.42Å; V199-F251 HydrophobicContact CG2-CD1 4.29Å; V199-F251 HydrophobicContact CG2-CE1 4.23Å; V199-V372 HydrophobicContact CG2-CG1 4.23Å; V199-V372 HydrophobicContact CG2-CG2 4.4Å
200	V	74.9	Confident	64.2	Low	53 Å²	53	87.5 Å²	87.5	32%	0.321	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	102.3	174.7	-175.9	0	0	0	0	107.9	T202 Q250 K252	V200-T202 PolarHBondContact O-N 2.79Å; V200-Q250 WeakPolarHBondContact CA-O 3.5Å; V200-Q250 HydrophobicContact CB-CB 4.17Å; V200-Q250 WeakPolarHBondContact CB-O 3.39Å; V200-Q250 PolarHBondContact N-O 3.49Å; V200-Q250 PolarHBondContact O-N 3.36Å; V200-K252 HydrophobicContact CG2-CB 3.78Å
201	N	63.4	Low	61.4	Low	127 Å²	127	96.6 Å²	96.6	68%	0.679	52%	0.521	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.6	114.7	170.3	-65.3	-20	0	0	0	108
202	T	54.9	Low	58.6	Low	52 Å²	52	99 Å²	99	32%	0.319	55%	0.547	S	S	.	.			trans	-64.9	126.9	164.8	50.3	0	0	0	0	107.6	V200 E204 K248	V200-T202 PolarHBondContact O-N 2.79Å; T202-E204 PolarHBondContact O-N 3.44Å; T202-E204 VanDerWaalsContact O-N 3.16Å; T202-K248 PolarHBondContact OG1-O 3.02Å
203	P	43.5	Very low	56.1	Low	115 Å²	115	102.4 Å²	102.4	75%	0.747	57%	0.567	S	S	*	*			trans	-58.5	126.2	177.8	21.9	-29.8	0	0	0	107.7	E205	P203-E205 PolarHBondContact O-N 3.11Å
204	E	39.4	Very low	53.6	Low	166 Å²	166	106.5 Å²	106.5	78%	0.776	58%	0.58	S	S	*	*			trans	-46.3	108.4	172.2	-64.2	177.1	169.7	0	0	107.4	T202 N206	T202-E204 PolarHBondContact O-N 3.44Å; T202-E204 VanDerWaalsContact O-N 3.16Å; E204-N206 VanDerWaalsContact C-N 3.31Å; E204-N206 PolarHBondContact O-N 3.28Å
205	E	36.7	Very low	51.2	Low	181 Å²	181	109.6 Å²	109.6	85%	0.846	60%	0.603	S	S	*	*			trans	-55.9	110.6	162.5	-75.1	-171.5	160.8	0	0	104.5	P203 V207	P203-E205 PolarHBondContact O-N 3.11Å; E205-V207 PolarHBondContact O-N 2.83Å
206	N	28.8	Very low	48.9	Very low	146 Å²	146	114.4 Å²	114.4	78%	0.781	64%	0.636	S	S	*	*			trans	-49.3	91.5	173.9	-86.9	-54	0	0	0	107.4	E204 Q208	E204-N206 VanDerWaalsContact C-N 3.31Å; E204-N206 PolarHBondContact O-N 3.28Å; N206-Q208 PolarHBondContact O-N 2.87Å
207	V	38.6	Very low	47.1	Very low	128 Å²	128	116.9 Å²	116.9	78%	0.776	66%	0.661	S	S	*	*			trans	-69.9	83	158.5	-177.9	0	0	0	0	102.9	E205 T209	E205-V207 PolarHBondContact O-N 2.83Å; V207-T209 VanDerWaalsContact C-N 3.3Å; V207-T209 PolarHBondContact O-N 3.21Å
208	Q	28.7	Very low	45.5	Very low	164 Å²	164	124 Å²	124	77%	0.766	70%	0.699	S	S	*	*			trans	-46.8	108.5	160.2	-71	179.8	-13.6	0	0	104.4	N206 S210	N206-Q208 PolarHBondContact O-N 2.87Å; Q208-S210 PolarHBondContact O-N 3.33Å
209	T	33	Very low	44	Very low	125 Å²	125	127.2 Å²	127.2	77%	0.767	71%	0.714	S	S	*	*			trans	-57.7	87.3	161.8	37.4	0	0	0	0	105.2	V207 E211	V207-T209 VanDerWaalsContact C-N 3.3Å; V207-T209 PolarHBondContact O-N 3.21Å; T209-E211 PolarHBondContact O-N 2.85Å
210	S	34.4	Very low	42.6	Very low	108 Å²	108	126.5 Å²	126.5	76%	0.755	72%	0.715	S	S	*	*			trans	-62.3	96.8	168	175.9	0	0	0	0	105	Q208 G212	Q208-S210 PolarHBondContact O-N 3.33Å; S210-G212 PolarHBondContact O-N 3.11Å
211	E	34.2	Very low	41.6	Very low	197 Å²	197	127.6 Å²	127.6	92%	0.921	72%	0.723	S	S	*	*			trans	-55.9	90.2	164.7	-65	-173.6	153.9	0	0	107.5	T209	T209-E211 PolarHBondContact O-N 2.85Å
212	G	31.1	Very low	41.7	Very low	52 Å²	52	126.2 Å²	126.2	54%	0.536	72%	0.719	S	S	.	*			trans	-143.2	94.4	-174.8	0	0	0	0	0	109.9	S210	S210-G212 PolarHBondContact O-N 3.11Å
213	D	35.9	Very low	42.5	Very low	154 Å²	154	129 Å²	129	82%	0.824	73%	0.731	S	S	*	*			trans	69.6	93.3	153.7	-63.5	-27.3	0	0	0	120	S215	D213-S215 PolarHBondContact O-N 2.97Å
214	K	36.3	Very low	44	Very low	204 Å²	204	127.5 Å²	127.5	89%	0.887	72%	0.72	S	S	*	*				9.7	101.2	118.4	-68.6	174.6	179.1	168	0	115.5
215	S	37.8	Very low	45.5	Very low	112 Å²	112	126.2 Å²	126.2	78%	0.783	71%	0.714	S	S	*	*				155.9	116.9	120.2	62.4	0	0	0	0	109.9	D213	D213-S215 PolarHBondContact O-N 2.97Å
216	C	41.1	Very low	47.3	Very low	106 Å²	106	119.9 Å²	119.9	72%	0.716	69%	0.693	S	S	*	*			trans	141.5	71.9	161	-79.3	0	0	0	0	108.7	D218	C216-D218 PolarHBondContact O-N 2.94Å
217	A	50.4	Low	49.5	Very low	96 Å²	96	117.7 Å²	117.7	79%	0.793	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	15.6	-164.9	0	0	0	0	0	115.8
218	D	50.7	Low	50.9	Low	155 Å²	155	116 Å²	116	83%	0.829	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.3	-21.4	177.2	-83.8	-33.1	0	0	0	115.1	C216	C216-D218 PolarHBondContact O-N 2.94Å
219	E	50.4	Low	52.8	Low	165 Å²	165	113 Å²	113	77%	0.771	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.3	-12.8	175.6	-63.9	-158.5	167.4	0	0	114	L223	E219-L223 PolarHBondContact O-N 3.25Å
220	A	50.7	Low	54.4	Low	51 Å²	51	109.8 Å²	109.8	42%	0.421	64%	0.639	S	S	.	*	H	α-helix	trans	-58.1	-43.6	178.7	0	0	0	0	0	114.7	V222 L223 T224	A220-V222 PolarHBondContact O-N 3.15Å; A220-L223 PolarHBondContact O-N 3.21Å; A220-T224 WeakPolarHBondContact O-CG2 3.47Å; A220-T224 PolarHBondContact O-N 3.02Å; A220-T224 PolarHBondContact O-OG1 3.29Å
221	P	54.7	Low	55.9	Low	75 Å²	75	109.6 Å²	109.6	49%	0.487	63%	0.633	S	S	.	*	H	α-helix	trans	-65.2	-40	-176.4	22.8	-30.5	0	0	0	112.2	T224 E225	P221-T224 WeakPolarHBondContact CA-OG1 3.42Å; P221-T224 PolarHBondContact O-N 3.21Å; P221-T224 PolarHBondContact O-OG1 3.27Å; P221-E225 VanDerWaalsContact O-CB 3.3Å; P221-E225 WeakPolarHBondContact O-CB 3.25Å; P221-E225 PolarHBondContact O-N 3.12Å
222	V	65.3	Low	57.1	Low	99 Å²	99	101.8 Å²	101.8	60%	0.6	60%	0.597	S	S	*	*	H	α-helix	trans	-68.7	-42	179.7	-178.3	0	0	0	0	111.3	A220 E225 A226	A220-V222 PolarHBondContact O-N 3.15Å; V222-E225 PolarHBondContact O-N 3.21Å; V222-A226 VanDerWaalsContact O-CB 3.27Å; V222-A226 WeakPolarHBondContact O-CB 3.5Å; V222-A226 PolarHBondContact O-N 3.39Å
223	L	70.8	Confident	58.6	Low	110 Å²	110	101.9 Å²	101.9	58%	0.576	59%	0.585	S	S	*	*	H	α-helix	trans	-67.6	-40.1	177.1	-177.1	64	0	0	0	111.5	E219 A220 L227	E219-L223 PolarHBondContact O-N 3.25Å; A220-L223 PolarHBondContact O-N 3.21Å; L223-L227 HydrophobicContact CD1-CD1 4.21Å; L223-L227 HydrophobicContact CD1-CG 4.23Å; L223-L227 HydrophobicContact CG-CD1 3.97Å; L223-L227 HydrophobicContact CG-CG 4.41Å; L223-L227 VanDerWaalsContact O-CB 3.29Å; L223-L227 WeakPolarHBondContact O-CB 3.23Å; L223-L227 WeakPolarHBondContact O-CG 3.45Å; L223-L227 PolarHBondContact O-N 2.85Å
224	T	74.9	Confident	60	Low	84 Å²	84	97.7 Å²	97.7	52%	0.515	56%	0.56	S	S	.	*	H	α-helix	trans	-64.2	-41.6	174.9	45.7	0	0	0	0	111.8	A220 P221 L227 L228	A220-T224 WeakPolarHBondContact O-CG2 3.47Å; A220-T224 PolarHBondContact O-N 3.02Å; A220-T224 PolarHBondContact O-OG1 3.29Å; P221-T224 WeakPolarHBondContact CA-OG1 3.42Å; P221-T224 PolarHBondContact O-N 3.21Å; P221-T224 PolarHBondContact O-OG1 3.27Å; T224-L227 PolarHBondContact O-N 2.83Å; T224-L228 WeakPolarHBondContact O-CB 3.37Å; T224-L228 PolarHBondContact O-N 3.01Å
225	E	71.4	Confident	61.2	Low	138 Å²	138	93.2 Å²	93.2	65%	0.645	54%	0.541	S	S	*	.	H	α-helix	trans	-66.9	-44.3	178.6	-169.5	168.8	-158.4	0	0	111.6	P221 V222 L227 L228 E229	P221-E225 VanDerWaalsContact O-CB 3.3Å; P221-E225 WeakPolarHBondContact O-CB 3.25Å; P221-E225 PolarHBondContact O-N 3.12Å; V222-E225 PolarHBondContact O-N 3.21Å; E225-L227 PolarHBondContact O-N 3.3Å; E225-L228 WeakPolarHBondContact O-CB 3.32Å; E225-L228 PolarHBondContact O-N 3.07Å; E225-E229 WeakPolarHBondContact O-CB 3.41Å; E225-E229 PolarHBondContact O-N 2.76Å
226	A	74.3	Confident	62.2	Low	48 Å²	48	88.7 Å²	88.7	40%	0.397	51%	0.51	S	S	.	.	H	α-helix	trans	-66.1	-35.4	176	0	0	0	0	0	113	V222 A230	V222-A226 VanDerWaalsContact O-CB 3.27Å; V222-A226 WeakPolarHBondContact O-CB 3.5Å; V222-A226 PolarHBondContact O-N 3.39Å; A226-A230 VanDerWaalsContact O-CB 3.26Å; A226-A230 WeakPolarHBondContact O-CB 3.45Å; A226-A230 PolarHBondContact O-N 3.37Å
227	L	74.1	Confident	63.1	Low	101 Å²	101	86.9 Å²	86.9	53%	0.529	49%	0.488	S	S	.	.	H	α-helix	trans	-69.8	-38.3	172.7	-74.2	171.8	0	0	0	111.2	L223 T224 E225 A230 T231	L223-L227 HydrophobicContact CD1-CD1 4.21Å; L223-L227 HydrophobicContact CD1-CG 4.23Å; L223-L227 HydrophobicContact CG-CD1 3.97Å; L223-L227 HydrophobicContact CG-CG 4.41Å; L223-L227 VanDerWaalsContact O-CB 3.29Å; L223-L227 WeakPolarHBondContact O-CB 3.23Å; L223-L227 WeakPolarHBondContact O-CG 3.45Å; L223-L227 PolarHBondContact O-N 2.85Å; T224-L227 PolarHBondContact O-N 2.83Å; E225-L227 PolarHBondContact O-N 3.3Å; L227-A230 PolarHBondContact O-N 3.31Å; L227-T231 WeakPolarHBondContact O-CG2 3.45Å; L227-T231 PolarHBondContact O-N 3.02Å; L227-T231 PolarHBondContact O-OG1 3.34Å
228	L	68.8	Low	63.5	Low	92 Å²	92	88.2 Å²	88.2	48%	0.482	48%	0.482	S	S	.	.	H	α-helix	trans	-62.5	-46.1	174.3	-135.1	129.5	0	0	0	110.3	T224 E225 T231 M232 N245	T224-L228 WeakPolarHBondContact O-CB 3.37Å; T224-L228 PolarHBondContact O-N 3.01Å; E225-L228 WeakPolarHBondContact O-CB 3.32Å; E225-L228 PolarHBondContact O-N 3.07Å; L228-T231 WeakPolarHBondContact CA-OG1 3.34Å; L228-T231 PolarHBondContact O-N 3.2Å; L228-T231 PolarHBondContact O-OG1 3.05Å; L228-M232 HydrophobicContact CD2-SD 4.13Å; L228-M232 WeakPolarHBondContact O-CG 3.49Å; L228-M232 PolarHBondContact O-N 3.4Å; L228-N245 WeakPolarHBondContact CD2-ND2 3.26Å
229	E	69	Low	64.1	Low	102 Å²	102	85.8 Å²	85.8	48%	0.477	46%	0.461	S	S	.	.	H	α-helix	trans	-61.2	-43.3	173.4	-166.6	-176.8	178.3	0	0	111.3	E225 T231 M232 L233 L242	E225-E229 WeakPolarHBondContact O-CB 3.41Å; E225-E229 PolarHBondContact O-N 2.76Å; E229-T231 VanDerWaalsContact C-N 3.31Å; E229-T231 PolarHBondContact O-N 2.85Å; E229-M232 CarbonylContact O-C 3.51Å; E229-M232 WeakPolarHBondContact O-CA 3.4Å; E229-M232 VanDerWaalsContact O-CB 3.26Å; E229-M232 WeakPolarHBondContact O-CB 3.34Å; E229-M232 PolarHBondContact O-N 2.91Å; E229-L233 WeakPolarHBondContact O-CG 3.27Å; E229-L233 PolarHBondContact O-N 3.43Å; E229-L242 HydrophobicContact CG-CD1 3.64Å
230	A	66.8	Low	64.7	Low	57 Å²	57	86.3 Å²	86.3	47%	0.471	46%	0.456	S	S	.	.	H	α-helix	trans	-64.2	-34	175.9	0	0	0	0	0	112.9	A226 L227 M232 L233	A226-A230 VanDerWaalsContact O-CB 3.26Å; A226-A230 WeakPolarHBondContact O-CB 3.45Å; A226-A230 PolarHBondContact O-N 3.37Å; L227-A230 PolarHBondContact O-N 3.31Å; A230-M232 PolarHBondContact O-N 2.85Å; A230-L233 PolarHBondContact O-N 2.64Å
231	T	64.4	Low	65.4	Low	104 Å²	104	85.4 Å²	85.4	64%	0.638	44%	0.444	S	S	*	.	H	α-helix	trans	-72	-20.2	172.5	56.1	0	0	0	0	113.1	L227 L228 E229	L227-T231 WeakPolarHBondContact O-CG2 3.45Å; L227-T231 PolarHBondContact O-N 3.02Å; L227-T231 PolarHBondContact O-OG1 3.34Å; L228-T231 WeakPolarHBondContact CA-OG1 3.34Å; L228-T231 PolarHBondContact O-N 3.2Å; L228-T231 PolarHBondContact O-OG1 3.05Å; E229-T231 VanDerWaalsContact C-N 3.31Å; E229-T231 PolarHBondContact O-N 2.85Å
232	M	60.5	Low	65.8	Low	32 Å²	32	86.4 Å²	86.4	16%	0.158	45%	0.445	C	S	.	.	H	α-helix	trans	-84.4	-24.4	174.1	-72.4	171	88.6	0	0	111.7	L228 E229 A230 Q234 L242 M243 N245	L228-M232 HydrophobicContact CD2-SD 4.13Å; L228-M232 WeakPolarHBondContact O-CG 3.49Å; L228-M232 PolarHBondContact O-N 3.4Å; E229-M232 CarbonylContact O-C 3.51Å; E229-M232 WeakPolarHBondContact O-CA 3.4Å; E229-M232 VanDerWaalsContact O-CB 3.26Å; E229-M232 WeakPolarHBondContact O-CB 3.34Å; E229-M232 PolarHBondContact O-N 2.91Å; A230-M232 PolarHBondContact O-N 2.85Å; M232-Q234 PolarHBondContact O-N 2.88Å; M232-L242 HydrophobicContact CB-CD1 3.74Å; M232-L242 HydrophobicContact CB-CG 4.36Å; M232-M243 WeakPolarHBondContact CA-O 3.37Å; M232-M243 WeakPolarHBondContact CB-O 3.35Å; M232-M243 WeakPolarHBondContact CE-O 3.41Å; M232-M243 VanDerWaalsContact CG-O 3.24Å; M232-M243 WeakPolarHBondContact CG-O 3.3Å; M232-M243 WeakPolarHBondContact O-CA 3.4Å; M232-M243 WeakPolarHBondContact O-CB 3.49Å; M232-M243 PolarHBondContact O-N 3.21Å; M232-N245 WeakPolarHBondContact CG-OD1 3.34Å
233	L	63.4	Low	65.6	Low	55 Å²	55	82.7 Å²	82.7	29%	0.288	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	118.2	-178.6	-69.6	168.7	0	0	0	112	E229 A230 W240 I241 L242	E229-L233 WeakPolarHBondContact O-CG 3.27Å; E229-L233 PolarHBondContact O-N 3.43Å; A230-L233 PolarHBondContact O-N 2.64Å; L233-W240 HydrophobicContact CB-CE3 3.85Å; L233-W240 HydrophobicContact CB-CZ3 4.35Å; L233-W240 HydrophobicContact CD2-CB 4.29Å; L233-I241 CarbonylContact C-O 3.59Å; L233-I241 WeakPolarHBondContact CA-O 3.25Å; L233-L242 HydrophobicContact CD2-CB 4.04Å; L233-L242 HydrophobicContact CD2-CD1 3.77Å; L233-L242 HydrophobicContact CG-CD1 4.02Å
234	Q	63.3	Low	64.9	Low	65 Å²	65	82.7 Å²	82.7	30%	0.304	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	137.6	168.4	-76.2	-172.7	-23.8	0	0	111	M232 C236 I241 M243 N262	M232-Q234 PolarHBondContact O-N 2.88Å; Q234-C236 PolarHBondContact O-N 2.91Å; Q234-I241 PolarHBondContact N-O 3.35Å; Q234-I241 PolarHBondContact O-N 2.93Å; Q234-M243 HydrophobicContact CB-CG 3.98Å; Q234-M243 HydrophobicContact CG-CG 3.92Å; Q234-N262 PolarHBondContact OE1-ND2 2.98Å
235	F	61.4	Low	63.7	Low	110 Å²	110	81.7 Å²	81.7	48%	0.482	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	105.9	175.6	-168.6	-104.2	0	0	0	110.1	D238 R239 W240	F235-D238 VanDerWaalsContact CZ-CA 3.43Å; F235-D238 HydrophobicContact CZ-CB 4.39Å; F235-R239 CarbonylContact C-O 3.56Å; F235-R239 WeakPolarHBondContact CA-O 3.39Å; F235-R239 WeakPolarHBondContact CD2-O 3.3Å; F235-W240 HydrophobicContact CB-CD2 4.34Å; F235-W240 HydrophobicContact CB-CE3 4.04Å; F235-W240 HydrophobicContact CB-CH2 4.32Å; F235-W240 HydrophobicContact CB-CZ3 4.05Å; F235-W240 AromaticContact CD2-CD2 3.88Å; F235-W240 HydrophobicContact CD2-CD2 3.88Å; F235-W240 AromaticContact CD2-CE2 3.79Å; F235-W240 HydrophobicContact CD2-CE3 4.43Å; F235-W240 HydrophobicContact CD2-CG 4.07Å; F235-W240 HydrophobicContact CD2-CZ2 4.3Å; F235-W240 AromaticContact CD2-NE1 3.84Å
236	C	60.1	Low	62.7	Low	18 Å²	18	76.1 Å²	76.1	12%	0.122	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	139.4	178.8	-57.8	0	0	0	0	109.2	Q234 D238 R239 I241	Q234-C236 PolarHBondContact O-N 2.91Å; C236-D238 PolarHBondContact O-N 3.22Å; C236-R239 PolarHBondContact N-O 3.21Å; C236-R239 PolarHBondContact O-N 3.36Å; C236-I241 HydrophobicContact CB-CD1 3.92Å
237	Y	58.9	Low	61.6	Low	68 Å²	68	77.4 Å²	77.4	27%	0.267	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.1	45.5	177.4	-49.5	-80	0	0	0	114.6	R239 L342 L403	Y237-R239 PolarHBondContact O-N 2.82Å; Y237-L342 HydrophobicContact CE1-CD1 4.1Å; Y237-L342 HydrophobicContact CE2-CD2 4.25Å; Y237-L403 HydrophobicContact CD1-CD2 4.43Å; Y237-L403 HydrophobicContact CD2-CD1 4.43Å; Y237-L403 HydrophobicContact CD2-CD2 3.87Å; Y237-L403 HydrophobicContact CG-CD2 3.74Å
238	D	59.2	Low	60.8	Low	123 Å²	123	78.9 Å²	78.9	66%	0.658	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	22.4	-176.9	-67.1	-27	0	0	0	115.2	F235 C236	F235-D238 VanDerWaalsContact CZ-CA 3.43Å; F235-D238 HydrophobicContact CZ-CB 4.39Å; C236-D238 PolarHBondContact O-N 3.22Å
239	R	62.7	Low	60.6	Low	105 Å²	105	76.1 Å²	76.1	40%	0.396	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	153.2	-179.4	-61.8	-179.1	-172.4	-176	4.3	111.4	F235 C236 Y237	F235-R239 CarbonylContact C-O 3.56Å; F235-R239 WeakPolarHBondContact CA-O 3.39Å; F235-R239 WeakPolarHBondContact CD2-O 3.3Å; C236-R239 PolarHBondContact N-O 3.21Å; C236-R239 PolarHBondContact O-N 3.36Å; Y237-R239 PolarHBondContact O-N 2.82Å
240	W	64.7	Low	60.7	Low	176 Å²	176	75 Å²	75	67%	0.667	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88	118.7	169.9	-68.6	99.7	0	0	0	109	L233 F235	L233-W240 HydrophobicContact CB-CE3 3.85Å; L233-W240 HydrophobicContact CB-CZ3 4.35Å; L233-W240 HydrophobicContact CD2-CB 4.29Å; F235-W240 HydrophobicContact CB-CD2 4.34Å; F235-W240 HydrophobicContact CB-CE3 4.04Å; F235-W240 HydrophobicContact CB-CH2 4.32Å; F235-W240 HydrophobicContact CB-CZ3 4.05Å; F235-W240 AromaticContact CD2-CD2 3.88Å; F235-W240 HydrophobicContact CD2-CD2 3.88Å; F235-W240 AromaticContact CD2-CE2 3.79Å; F235-W240 HydrophobicContact CD2-CE3 4.43Å; F235-W240 HydrophobicContact CD2-CG 4.07Å; F235-W240 HydrophobicContact CD2-CZ2 4.3Å; F235-W240 AromaticContact CD2-NE1 3.84Å
241	I	64.2	Low	61.1	Low	31 Å²	31	72.9 Å²	72.9	16%	0.159	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	127.3	178.2	-55.9	-179.2	0	0	0	107.9	L233 Q234 C236 M243 L365	L233-I241 CarbonylContact C-O 3.59Å; L233-I241 WeakPolarHBondContact CA-O 3.25Å; Q234-I241 PolarHBondContact N-O 3.35Å; Q234-I241 PolarHBondContact O-N 2.93Å; C236-I241 HydrophobicContact CB-CD1 3.92Å; I241-M243 HydrophobicContact CG2-SD 4.36Å; I241-M243 PolarHBondContact O-N 2.91Å; I241-L365 HydrophobicContact CD1-CD1 3.92Å; I241-L365 HydrophobicContact CG2-CD1 4.38Å
242	L	63.2	Low	61.6	Low	97 Å²	97	70.3 Å²	70.3	51%	0.508	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	113.2	173.7	-168.2	78.8	0	0	0	109.2	E229 M232 L233	E229-L242 HydrophobicContact CG-CD1 3.64Å; M232-L242 HydrophobicContact CB-CD1 3.74Å; M232-L242 HydrophobicContact CB-CG 4.36Å; L233-L242 HydrophobicContact CD2-CB 4.04Å; L233-L242 HydrophobicContact CD2-CD1 3.77Å; L233-L242 HydrophobicContact CG-CD1 4.02Å
243	M	60.6	Low	62.4	Low	20 Å²	20	68.9 Å²	68.9	10%	0.099	33%	0.334	C	S	.	.			trans	-95	130.8	173.7	-60.1	-66.5	-62.5	0	0	109.1	M232 Q234 I241 N262 L365	M232-M243 WeakPolarHBondContact CA-O 3.37Å; M232-M243 WeakPolarHBondContact CB-O 3.35Å; M232-M243 WeakPolarHBondContact CE-O 3.41Å; M232-M243 VanDerWaalsContact CG-O 3.24Å; M232-M243 WeakPolarHBondContact CG-O 3.3Å; M232-M243 WeakPolarHBondContact O-CA 3.4Å; M232-M243 WeakPolarHBondContact O-CB 3.49Å; M232-M243 PolarHBondContact O-N 3.21Å; Q234-M243 HydrophobicContact CB-CG 3.98Å; Q234-M243 HydrophobicContact CG-CG 3.92Å; I241-M243 HydrophobicContact CG2-SD 4.36Å; I241-M243 PolarHBondContact O-N 2.91Å; M243-N262 WeakPolarHBondContact CE-ND2 3.36Å; M243-N262 PolarHBondContact SD-ND2 3.23Å; M243-L365 HydrophobicContact SD-CD1 4.23Å
244	D	57.2	Low	62.7	Low	110 Å²	110	67.1 Å²	67.1	59%	0.588	33%	0.325	S	S	*	.			trans	-61.1	145.9	166.3	-165.9	4.1	0	0	0	110.1	A246 S247	D244-A246 PolarHBondContact O-N 3.25Å; D244-S247 PolarHBondContact O-N 3.07Å
245	N	49.6	Very low	63	Low	63 Å²	63	68.5 Å²	68.5	34%	0.337	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-61.9	2.9	-179.4	-76	-35.8	0	0	0	113.9	L228 M232 S247	L228-N245 WeakPolarHBondContact CD2-ND2 3.26Å; M232-N245 WeakPolarHBondContact CG-OD1 3.34Å; N245-S247 PolarHBondContact O-N 2.97Å; N245-S247 VanDerWaalsContact O-N 3.09Å
246	A	50.3	Low	63.1	Low	22 Å²	22	68.7 Å²	68.7	18%	0.182	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-65.5	3.3	168.7	0	0	0	0	0	114.2	D244 K248 V249 R366	D244-A246 PolarHBondContact O-N 3.25Å; A246-K248 PolarHBondContact O-N 2.9Å; A246-V249 PolarHBondContact O-N 3.05Å; A246-V249 VanDerWaalsContact O-N 3.08Å; A246-R366 PolarHBondContact O-NH2 3.41Å
247	S	51.7	Low	63.6	Low	75 Å²	75	68.9 Å²	68.9	52%	0.524	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-55.9	-12.2	168.9	58.3	0	0	0	0	114.4	D244 N245 V249	D244-S247 PolarHBondContact O-N 3.07Å; N245-S247 PolarHBondContact O-N 2.97Å; N245-S247 VanDerWaalsContact O-N 3.09Å; S247-V249 VanDerWaalsContact C-N 3.31Å
248	K	57.6	Low	64.2	Low	132 Å²	132	68.3 Å²	68.3	57%	0.574	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-79.1	-9	174.3	-64.8	-176	-178.2	-179.8	0	114.6	T202 A246	T202-K248 PolarHBondContact OG1-O 3.02Å; A246-K248 PolarHBondContact O-N 2.9Å
249	V	64.5	Low	64.8	Low	34 Å²	34	62.9 Å²	62.9	21%	0.206	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	108.1	-178.5	-175.5	0	0	0	0	109.4	V199 A246 S247 F251	V199-V249 HydrophobicContact CG1-CG1 3.42Å; V199-V249 VanDerWaalsContact CG1-CG1 3.42Å; A246-V249 PolarHBondContact O-N 3.05Å; A246-V249 VanDerWaalsContact O-N 3.08Å; S247-V249 VanDerWaalsContact C-N 3.31Å; V249-F251 HydrophobicContact CG1-CE1 4Å; V249-F251 HydrophobicContact CG1-CE2 4.34Å; V249-F251 HydrophobicContact CG1-CZ 3.81Å
250	Q	69.9	Low	65.1	Low	77 Å²	77	58.5 Å²	58.5	36%	0.36	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	142.8	169.9	-73.1	-176.1	-9.1	0	0	109.3	V200	V200-Q250 WeakPolarHBondContact CA-O 3.5Å; V200-Q250 HydrophobicContact CB-CB 4.17Å; V200-Q250 WeakPolarHBondContact CB-O 3.39Å; V200-Q250 PolarHBondContact N-O 3.49Å; V200-Q250 PolarHBondContact O-N 3.36Å
251	F	75.9	Confident	65.1	Low	13 Å²	13	53.1 Å²	53.1	6%	0.057	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	135.5	171.5	-51.8	-89.1	0	0	0	108.9	I197 E198 V199 V249 A259 F368 W369 V372	I197-F251 HydrophobicContact CG2-CB 4.19Å; I197-F251 HydrophobicContact CG2-CD1 4.12Å; E198-F251 WeakPolarHBondContact O-CA 3.49Å; V199-F251 HydrophobicContact CG2-CD1 4.29Å; V199-F251 HydrophobicContact CG2-CE1 4.23Å; V249-F251 HydrophobicContact CG1-CE1 4Å; V249-F251 HydrophobicContact CG1-CE2 4.34Å; V249-F251 HydrophobicContact CG1-CZ 3.81Å; F251-A259 HydrophobicContact CB-CB 3.7Å; F251-A259 HydrophobicContact CD2-CB 4.25Å; F251-A259 HydrophobicContact CG-CB 4.47Å; F251-A259 WeakPolarHBondContact O-CB 3.41Å; F251-A259 PolarHBondContact O-N 3.03Å; F251-F368 HydrophobicContact CB-CB 4.11Å; F251-F368 HydrophobicContact CD1-CB 4.3Å; F251-F368 HydrophobicContact CD2-CB 3.59Å; F251-F368 HydrophobicContact CD2-CG 4.49Å; F251-F368 HydrophobicContact CE2-CB 4.09Å; F251-F368 HydrophobicContact CG-CB 3.72Å; F251-W369 HydrophobicContact CE1-CE3 4.03Å; F251-W369 HydrophobicContact CE2-CB 4.27Å; F251-W369 HydrophobicContact CZ-CB 3.75Å; F251-W369 HydrophobicContact CZ-CD2 4.4Å; F251-W369 AromaticContact CZ-CE3 3.71Å; F251-W369 HydrophobicContact CZ-CE3 3.71Å; F251-W369 HydrophobicContact CZ-CG 4.48Å; F251-V372 HydrophobicContact CD1-CG2 3.97Å; F251-V372 HydrophobicContact CE1-CG2 3.9Å
252	K	75.6	Confident	65	Low	51 Å²	51	52.6 Å²	52.6	22%	0.222	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	122.3	169.6	177.4	-175	151.3	-159	0	108	E198 V200 N256	E198-K252 HydrophobicContact CB-CB 4.21Å; E198-K252 PolarHBondContact N-O 3.38Å; E198-K252 PolarHBondContact O-N 3.26Å; E198-K252 WeakPolarHBondContact OE2-CD 3.34Å; E198-K252 WeakPolarHBondContact OE2-CE 3.5Å; E198-K252 IonicContact OE2-NZ 3.63Å; E198-K252 PolarHBondContact OE2-NZ 3.31Å; V200-K252 HydrophobicContact CG2-CB 3.78Å; K252-N256 HydrophobicContact CD-CB 4.48Å; K252-N256 WeakPolarHBondContact CE-OD1 3.47Å; K252-N256 PolarHBondContact NZ-OD1 3.38Å
253	F	75.8	Confident	64.7	Low	2 Å²	2	50.7 Å²	50.7	1%	0.009	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	168.6	173.1	-129.1	-104.1	0	0	0	109.9	F195 I197 D255 N256 C257 Y302 L306 F368	F195-F253 HydrophobicContact CB-CE1 3.91Å; F195-F253 HydrophobicContact CB-CZ 4.15Å; F195-F253 HydrophobicContact CD1-CE1 4.17Å; F195-F253 HydrophobicContact CG-CE1 4.49Å; I197-F253 HydrophobicContact CB-CD2 4.44Å; I197-F253 HydrophobicContact CB-CE2 4.26Å; I197-F253 HydrophobicContact CD1-CD2 4.49Å; I197-F253 HydrophobicContact CD1-CE2 3.55Å; I197-F253 HydrophobicContact CD1-CZ 4.13Å; I197-F253 HydrophobicContact CG1-CD2 4Å; I197-F253 HydrophobicContact CG1-CE2 3.38Å; I197-F253 HydrophobicContact CG1-CZ 4Å; I197-F253 HydrophobicContact CG2-CD2 4.14Å; I197-F253 HydrophobicContact CG2-CE2 4.18Å; F253-D255 PolarHBondContact O-N 2.87Å; F253-N256 PolarHBondContact O-N 3.18Å; F253-C257 HydrophobicContact CB-CB 4.36Å; F253-C257 PolarHBondContact N-O 2.94Å; F253-C257 PolarHBondContact O-N 3.32Å; F253-Y302 HydrophobicContact CD1-CD2 4.36Å; F253-Y302 HydrophobicContact CD1-CG 4.47Å; F253-L306 HydrophobicContact CZ-CD2 3.83Å; F253-F368 AromaticContact CD2-CD1 3.68Å; F253-F368 HydrophobicContact CD2-CD1 3.68Å; F253-F368 AromaticContact CD2-CE1 3.65Å; F253-F368 HydrophobicContact CD2-CE1 3.65Å; F253-F368 AromaticContact CE2-CD1 3.63Å; F253-F368 HydrophobicContact CE2-CD1 3.63Å; F253-F368 AromaticContact CE2-CE1 3.7Å; F253-F368 HydrophobicContact CE2-CE1 3.7Å; F253-F368 HydrophobicContact CG-CE1 4.33Å; F253-F368 HydrophobicContact CZ-CE1 4.45Å
254	V	70.6	Confident	64.9	Low	18 Å²	18	50.2 Å²	50.2	11%	0.109	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-12.9	122.7	168.4	-179	0	0	0	0	113.4	F195 N256 C257 Y302	F195-V254 HydrophobicContact CD1-CG2 4.22Å; V254-N256 VanDerWaalsContact C-N 3.32Å; V254-N256 PolarHBondContact O-N 2.92Å; V254-C257 PolarHBondContact O-N 3.41Å; V254-C257 PolarHBondContact O-SG 3.05Å; V254-Y302 HydrophobicContact CB-CD2 4.18Å; V254-Y302 HydrophobicContact CB-CE2 4.17Å; V254-Y302 HydrophobicContact CG1-CE2 4.18Å
255	D	70.3	Confident	65.3	Low	93 Å²	93	46.4 Å²	46.4	50%	0.497	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	57.9	30	174.6	-63.6	-53.1	0	0	0	117.3	F253 I443	F253-D255 PolarHBondContact O-N 2.87Å; D255-I443 HydrophobicContact CB-CD1 4.27Å; D255-I443 HydrophobicContact CB-CG2 4.33Å; D255-I443 WeakPolarHBondContact OD2-CG2 3.37Å
256	N	63.1	Low	66.1	Low	114 Å²	114	46.2 Å²	46.2	61%	0.61	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	72.8	21	-179.5	-41	-79.1	0	0	0	114.7	K252 F253 V254 L258	K252-N256 HydrophobicContact CD-CB 4.48Å; K252-N256 WeakPolarHBondContact CE-OD1 3.47Å; K252-N256 PolarHBondContact NZ-OD1 3.38Å; F253-N256 PolarHBondContact O-N 3.18Å; V254-N256 VanDerWaalsContact C-N 3.32Å; V254-N256 PolarHBondContact O-N 2.92Å; N256-L258 PolarHBondContact O-N 2.91Å
257	C	70.4	Confident	66.8	Low	22 Å²	22	47.7 Å²	47.7	15%	0.149	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	120.9	166.6	-67.5	0	0	0	0	109.4	F253 V254	F253-C257 HydrophobicContact CB-CB 4.36Å; F253-C257 PolarHBondContact N-O 2.94Å; F253-C257 PolarHBondContact O-N 3.32Å; V254-C257 PolarHBondContact O-N 3.41Å; V254-C257 PolarHBondContact O-SG 3.05Å
258	L	71.9	Confident	67.6	Low	57 Å²	57	44.3 Å²	44.3	30%	0.298	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	132.1	174.2	-66.6	173.1	0	0	0	108.9	N256 S299	N256-L258 PolarHBondContact O-N 2.91Å; L258-S299 PolarHBondContact O-OG 2.85Å
259	A	71	Confident	68	Low	8 Å²	8	41.5 Å²	41.5	7%	0.066	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-62.2	137.3	168.4	0	0	0	0	0	109.3	F251 D261 F368	F251-A259 HydrophobicContact CB-CB 3.7Å; F251-A259 HydrophobicContact CD2-CB 4.25Å; F251-A259 HydrophobicContact CG-CB 4.47Å; F251-A259 WeakPolarHBondContact O-CB 3.41Å; F251-A259 PolarHBondContact O-N 3.03Å; A259-D261 PolarHBondContact O-N 3.46Å; A259-F368 HydrophobicContact CB-CB 4.35Å; A259-F368 HydrophobicContact CB-CD1 3.98Å; A259-F368 HydrophobicContact CB-CD2 3.5Å; A259-F368 HydrophobicContact CB-CE1 4.13Å; A259-F368 HydrophobicContact CB-CE2 3.7Å; A259-F368 HydrophobicContact CB-CG 3.66Å; A259-F368 HydrophobicContact CB-CZ 4Å
260	P	69.5	Low	68.1	Low	14 Å²	14	46.9 Å²	46.9	9%	0.091	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-59.5	132.3	175.1	20.9	-28.7	0	0	0	109.7	D264 Y265 S299 L300 F368	P260-D264 WeakPolarHBondContact CA-OD2 3.36Å; P260-D264 HydrophobicContact CB-CB 3.87Å; P260-Y265 HydrophobicContact CB-CD2 4Å; P260-Y265 HydrophobicContact CB-CE2 3.74Å; P260-Y265 HydrophobicContact CG-CE1 4.43Å; P260-Y265 HydrophobicContact CG-CE2 3.79Å; P260-S299 WeakPolarHBondContact CD-OG 3.26Å; P260-L300 HydrophobicContact CG-CD1 4.28Å; P260-L300 HydrophobicContact CG-CD2 3.83Å; P260-L300 HydrophobicContact CG-CG 4.03Å; P260-F368 HydrophobicContact CG-CE2 4.08Å
261	D	64.7	Low	68	Low	62 Å²	62	43.9 Å²	43.9	33%	0.332	24%	0.235	S	C	.	.	P	Polyproline II helix	trans	-81.1	170.9	153.5	68	28	0	0	0	110.3	A259 S263 D264 Y265	A259-D261 PolarHBondContact O-N 3.46Å; D261-S263 VanDerWaalsContact CG-OG 3.25Å; D261-S263 PolarHBondContact O-N 2.88Å; D261-S263 VanDerWaalsContact O-N 3.15Å; D261-S263 VanDerWaalsContact OD1-CA 3.22Å; D261-S263 WeakPolarHBondContact OD1-CA 3.4Å; D261-S263 WeakPolarHBondContact OD1-CB 3.5Å; D261-S263 PolarHBondContact OD1-N 3.07Å; D261-S263 PolarHBondContact OD1-OG 3.1Å; D261-S263 PolarHBondContact OD2-OG 2.97Å; D261-D264 PolarHBondContact N-OD2 2.79Å; D261-D264 WeakPolarHBondContact O-CB 3.49Å; D261-D264 PolarHBondContact O-N 3.36Å; D261-D264 PolarHBondContact OD1-N 3.28Å; D261-Y265 VanDerWaalsContact O-CD2 3.31Å; D261-Y265 WeakPolarHBondContact O-CD2 3.36Å; D261-Y265 PolarHBondContact O-N 3.35Å
262	N	60.7	Low	67.6	Low	20 Å²	20	44.2 Å²	44.2	11%	0.107	24%	0.237	C	C	.	.	H	α-helix	trans	-59.6	-24.4	176.3	-77	-6.7	0	0	0	113	Q234 M243 S266	Q234-N262 PolarHBondContact OE1-ND2 2.98Å; M243-N262 WeakPolarHBondContact CE-ND2 3.36Å; M243-N262 PolarHBondContact SD-ND2 3.23Å; N262-S266 PolarHBondContact O-N 3.37Å; N262-S266 PolarHBondContact O-OG 3.49Å
263	S	58.6	Low	67	Low	58 Å²	58	46.3 Å²	46.3	41%	0.406	25%	0.247	S	C	.	.	H	α-helix	trans	-73.9	-36.3	175.5	87.2	0	0	0	0	111.2	D261 Y265 S266 V267	D261-S263 VanDerWaalsContact CG-OG 3.25Å; D261-S263 PolarHBondContact O-N 2.88Å; D261-S263 VanDerWaalsContact O-N 3.15Å; D261-S263 VanDerWaalsContact OD1-CA 3.22Å; D261-S263 WeakPolarHBondContact OD1-CA 3.4Å; D261-S263 WeakPolarHBondContact OD1-CB 3.5Å; D261-S263 PolarHBondContact OD1-N 3.07Å; D261-S263 PolarHBondContact OD1-OG 3.1Å; D261-S263 PolarHBondContact OD2-OG 2.97Å; S263-Y265 PolarHBondContact O-N 2.96Å; S263-S266 CarbonylContact O-C 3.59Å; S263-S266 WeakPolarHBondContact O-CB 3.21Å; S263-S266 PolarHBondContact O-N 3.38Å; S263-S266 VanDerWaalsContact O-N 3.09Å; S263-V267 VanDerWaalsContact O-CG2 3.31Å; S263-V267 WeakPolarHBondContact O-CG2 3.25Å; S263-V267 PolarHBondContact O-N 2.87Å
264	D	63.6	Low	66.5	Low	9 Å²	9	50.1 Å²	50.1	5%	0.048	27%	0.273	C	S	.	.	H	α-helix	trans	-64.8	-39.5	176.4	-69.4	-46.4	0	0	0	111	P260 D261 S266 V267 L268 S292 A293	P260-D264 WeakPolarHBondContact CA-OD2 3.36Å; P260-D264 HydrophobicContact CB-CB 3.87Å; D261-D264 PolarHBondContact N-OD2 2.79Å; D261-D264 WeakPolarHBondContact O-CB 3.49Å; D261-D264 PolarHBondContact O-N 3.36Å; D261-D264 PolarHBondContact OD1-N 3.28Å; D264-S266 VanDerWaalsContact C-N 3.31Å; D264-S266 PolarHBondContact O-N 2.89Å; D264-V267 PolarHBondContact O-N 3.4Å; D264-L268 VanDerWaalsContact O-CB 3.31Å; D264-L268 WeakPolarHBondContact O-CB 3.32Å; D264-L268 WeakPolarHBondContact O-CG 3.49Å; D264-L268 PolarHBondContact O-N 3.46Å; D264-S292 WeakPolarHBondContact OD1-CB 3.44Å; D264-S292 PolarHBondContact OD1-OG 2.87Å; D264-A293 HydrophobicContact CB-CB 4.41Å
265	Y	66.5	Low	66.1	Low	30 Å²	30	51.3 Å²	51.3	12%	0.118	28%	0.278	C	S	.	.	H	α-helix	trans	-59.6	-41.8	171	-74.3	-77.2	0	0	0	111.8	P260 D261 S263 K269 L300 F337 A341	P260-Y265 HydrophobicContact CB-CD2 4Å; P260-Y265 HydrophobicContact CB-CE2 3.74Å; P260-Y265 HydrophobicContact CG-CE1 4.43Å; P260-Y265 HydrophobicContact CG-CE2 3.79Å; D261-Y265 VanDerWaalsContact O-CD2 3.31Å; D261-Y265 WeakPolarHBondContact O-CD2 3.36Å; D261-Y265 PolarHBondContact O-N 3.35Å; S263-Y265 PolarHBondContact O-N 2.96Å; Y265-K269 WeakPolarHBondContact O-CB 3.44Å; Y265-K269 PolarHBondContact O-N 3.13Å; Y265-L300 HydrophobicContact CE1-CD1 3.9Å; Y265-L300 HydrophobicContact CE1-CD2 4.39Å; Y265-L300 VanDerWaalsContact OH-CD2 3.29Å; Y265-L300 WeakPolarHBondContact OH-CD2 3.42Å; Y265-F337 HydrophobicContact CD1-CE1 4.15Å; Y265-F337 HydrophobicContact CD1-CZ 4.38Å; Y265-A341 HydrophobicContact CD1-CB 4.41Å; Y265-A341 HydrophobicContact CE1-CB 3.76Å
266	S	66.1	Low	65.3	Low	60 Å²	60	56.9 Å²	56.9	42%	0.42	30%	0.298	S	S	.	.	H	α-helix	trans	-69.8	-38.1	179.4	-59.7	0	0	0	0	112.3	N262 S263 D264 Q270	N262-S266 PolarHBondContact O-N 3.37Å; N262-S266 PolarHBondContact O-OG 3.49Å; S263-S266 CarbonylContact O-C 3.59Å; S263-S266 WeakPolarHBondContact O-CB 3.21Å; S263-S266 PolarHBondContact O-N 3.38Å; S263-S266 VanDerWaalsContact O-N 3.09Å; D264-S266 VanDerWaalsContact C-N 3.31Å; D264-S266 PolarHBondContact O-N 2.89Å; S266-Q270 WeakPolarHBondContact O-CB 3.15Å; S266-Q270 PolarHBondContact O-N 3.48Å
267	V	65.8	Low	64.9	Low	53 Å²	53	55.5 Å²	55.5	32%	0.321	29%	0.294	S	S	.	.	H	α-helix	trans	-68.6	-45.9	176	171.1	0	0	0	0	110.8	S263 D264 K269 Q270 F271 I289 A293	S263-V267 VanDerWaalsContact O-CG2 3.31Å; S263-V267 WeakPolarHBondContact O-CG2 3.25Å; S263-V267 PolarHBondContact O-N 2.87Å; D264-V267 PolarHBondContact O-N 3.4Å; V267-K269 VanDerWaalsContact C-N 3.33Å; V267-K269 PolarHBondContact O-N 2.92Å; V267-Q270 PolarHBondContact O-N 3.34Å; V267-F271 WeakPolarHBondContact O-CB 3.46Å; V267-F271 PolarHBondContact O-N 2.88Å; V267-I289 HydrophobicContact CG1-CG2 4.34Å; V267-A293 HydrophobicContact CB-CB 4.22Å; V267-A293 HydrophobicContact CG1-CB 3.82Å
268	L	67.1	Low	64.2	Low	3 Å²	3	62.1 Å²	62.1	2%	0.016	33%	0.327	C	S	.	.	H	α-helix	trans	-59.5	-45.8	173.5	-81.9	-178.6	0	0	0	111.2	D264 F271 L272 I289 A293 S296 F337	D264-L268 VanDerWaalsContact O-CB 3.31Å; D264-L268 WeakPolarHBondContact O-CB 3.32Å; D264-L268 WeakPolarHBondContact O-CG 3.49Å; D264-L268 PolarHBondContact O-N 3.46Å; L268-F271 PolarHBondContact O-N 3.49Å; L268-L272 WeakPolarHBondContact O-CB 3.23Å; L268-L272 VanDerWaalsContact O-CG 3.26Å; L268-L272 WeakPolarHBondContact O-CG 3.35Å; L268-L272 PolarHBondContact O-N 2.81Å; L268-I289 HydrophobicContact CD2-CD1 4.08Å; L268-I289 HydrophobicContact CD2-CG2 4.22Å; L268-A293 HydrophobicContact CD2-CB 4.05Å; L268-A293 WeakPolarHBondContact CD2-O 3.38Å; L268-A293 HydrophobicContact CG-CB 3.89Å; L268-S296 WeakPolarHBondContact CD1-OG 3.39Å; L268-F337 HydrophobicContact CD1-CE1 4.34Å; L268-F337 HydrophobicContact CD1-CZ 3.76Å
269	K	67.2	Low	63.4	Low	74 Å²	74	63.9 Å²	63.9	32%	0.322	34%	0.335	S	S	.	.	H	α-helix	trans	-56.1	-56.4	173.9	-180	176.6	-178.7	142	0	110.4	Y265 V267 F271 L272 F273 E338	Y265-K269 WeakPolarHBondContact O-CB 3.44Å; Y265-K269 PolarHBondContact O-N 3.13Å; V267-K269 VanDerWaalsContact C-N 3.33Å; V267-K269 PolarHBondContact O-N 2.92Å; K269-F271 PolarHBondContact O-N 3.34Å; K269-L272 PolarHBondContact O-N 2.83Å; K269-L272 VanDerWaalsContact O-N 3.16Å; K269-F273 HydrophobicContact CD-CE2 4.18Å; K269-F273 HydrophobicContact CG-CD2 3.62Å; K269-F273 HydrophobicContact CG-CE2 3.47Å; K269-F273 VanDerWaalsContact CG-CE2 3.47Å; K269-F273 WeakPolarHBondContact O-CB 3.49Å; K269-F273 WeakPolarHBondContact O-CD2 3.27Å; K269-F273 PolarHBondContact O-N 3.22Å; K269-E338 WeakPolarHBondContact CD-OE1 3.29Å; K269-E338 WeakPolarHBondContact CE-OE1 3.26Å; K269-E338 VanDerWaalsContact CG-OE1 3.31Å; K269-E338 WeakPolarHBondContact CG-OE1 3.36Å; K269-E338 IonicContact NZ-OE1 2.87Å; K269-E338 PolarHBondContact NZ-OE1 3.5Å; K269-E338 IonicContact NZ-OE2 2.6Å; K269-E338 PolarHBondContact NZ-OE2 3.02Å
270	Q	67.1	Low	62.7	Low	146 Å²	146	63.9 Å²	63.9	68%	0.682	33%	0.334	S	S	*	.	H	α-helix	trans	-56.5	-39.7	-179.7	-174.2	176.9	-0.2	0	0	112.1	S266 V267 F273 S274	S266-Q270 WeakPolarHBondContact O-CB 3.15Å; S266-Q270 PolarHBondContact O-N 3.48Å; V267-Q270 PolarHBondContact O-N 3.34Å; Q270-F273 PolarHBondContact O-N 2.99Å; Q270-S274 WeakPolarHBondContact O-CB 3.33Å; Q270-S274 PolarHBondContact O-N 3.42Å
271	F	67.5	Low	62.1	Low	15 Å²	15	65.7 Å²	65.7	7%	0.066	35%	0.348	C	S	.	.	H	α-helix	trans	-64	-51.7	175.7	172.5	-101	0	0	0	112.4	V267 L268 K269 F273 S274 Q275 P280 C285 T288 I289	V267-F271 WeakPolarHBondContact O-CB 3.46Å; V267-F271 PolarHBondContact O-N 2.88Å; L268-F271 PolarHBondContact O-N 3.49Å; K269-F271 PolarHBondContact O-N 3.34Å; F271-F273 PolarHBondContact O-N 3.26Å; F271-S274 WeakPolarHBondContact O-CB 3.41Å; F271-S274 PolarHBondContact O-N 2.91Å; F271-S274 PolarHBondContact O-OG 3.42Å; F271-Q275 HydrophobicContact CE1-CG 4.19Å; F271-Q275 HydrophobicContact CE2-CG 4.38Å; F271-Q275 VanDerWaalsContact CE2-NE2 3.34Å; F271-Q275 HydrophobicContact CZ-CG 4.09Å; F271-Q275 PolarHBondContact O-N 2.83Å; F271-P280 HydrophobicContact CE1-CB 4.32Å; F271-P280 HydrophobicContact CZ-CB 4.46Å; F271-C285 HydrophobicContact CE1-CB 4.19Å; F271-C285 WeakPolarHBondContact CE1-SG 3.31Å; F271-C285 HydrophobicContact CZ-CB 4Å; F271-C285 WeakPolarHBondContact CZ-SG 3.29Å; F271-T288 WeakPolarHBondContact CE2-OG1 3.4Å; F271-I289 HydrophobicContact CB-CD1 4.35Å; F271-I289 HydrophobicContact CB-CG1 3.96Å; F271-I289 HydrophobicContact CD1-CD1 3.19Å; F271-I289 HydrophobicContact CD1-CG1 3.51Å; F271-I289 HydrophobicContact CD2-CD1 4.15Å; F271-I289 HydrophobicContact CD2-CG1 3.48Å; F271-I289 VanDerWaalsContact CD2-CG1 3.48Å; F271-I289 HydrophobicContact CE1-CD1 3.31Å; F271-I289 HydrophobicContact CE1-CG1 3.77Å; F271-I289 HydrophobicContact CE2-CD1 4.27Å; F271-I289 HydrophobicContact CE2-CG1 3.78Å; F271-I289 HydrophobicContact CG-CD1 3.61Å; F271-I289 HydrophobicContact CG-CG1 3.31Å; F271-I289 HydrophobicContact CZ-CD1 3.82Å; F271-I289 HydrophobicContact CZ-CG1 3.84Å
272	L	66	Low	61.8	Low	19 Å²	19	65.6 Å²	65.6	10%	0.099	35%	0.349	C	S	.	.	H	α-helix	trans	-59.2	-35.6	176.5	-69	170.5	0	0	0	111.5	L268 K269 S274 I332 F337	L268-L272 WeakPolarHBondContact O-CB 3.23Å; L268-L272 VanDerWaalsContact O-CG 3.26Å; L268-L272 WeakPolarHBondContact O-CG 3.35Å; L268-L272 PolarHBondContact O-N 2.81Å; K269-L272 PolarHBondContact O-N 2.83Å; K269-L272 VanDerWaalsContact O-N 3.16Å; L272-S274 VanDerWaalsContact C-N 3.34Å; L272-I332 HydrophobicContact CD1-CG2 3.6Å; L272-I332 HydrophobicContact CD2-CB 4.46Å; L272-I332 HydrophobicContact CD2-CG2 3.78Å; L272-I332 HydrophobicContact CG-CG2 4.35Å; L272-F337 HydrophobicContact CD1-CB 4.46Å; L272-F337 HydrophobicContact CD1-CD1 4.34Å; L272-F337 HydrophobicContact CD1-CG 4.37Å
273	F	64.7	Low	61.5	Low	96 Å²	96	68 Å²	68	42%	0.421	37%	0.365	S	S	.	.	H	α-helix	trans	-70.7	-26.1	173.9	-87.4	-106	0	0	0	113.6	K269 Q270 F271 K334	K269-F273 HydrophobicContact CD-CE2 4.18Å; K269-F273 HydrophobicContact CG-CD2 3.62Å; K269-F273 HydrophobicContact CG-CE2 3.47Å; K269-F273 VanDerWaalsContact CG-CE2 3.47Å; K269-F273 WeakPolarHBondContact O-CB 3.49Å; K269-F273 WeakPolarHBondContact O-CD2 3.27Å; K269-F273 PolarHBondContact O-N 3.22Å; Q270-F273 PolarHBondContact O-N 2.99Å; F271-F273 PolarHBondContact O-N 3.26Å; F273-K334 HydrophobicContact CD2-CD 4.36Å; F273-K334 VanDerWaalsContact CD2-CE 3.5Å; F273-K334 HydrophobicContact CD2-CG 4.24Å; F273-K334 HydrophobicContact CE2-CD 4.34Å; F273-K334 HydrophobicContact CE2-CG 4.07Å; F273-K334 VanDerWaalsContact CG-CE 3.48Å; F273-K334 HydrophobicContact CZ-CD 4.44Å; F273-K334 HydrophobicContact CZ-CG 4.5Å
274	S	65.1	Low	61.5	Low	81 Å²	81	69.4 Å²	69.4	57%	0.566	37%	0.368	S	S	*	.	H	α-helix	trans	-81.8	-18.8	179.5	75.2	0	0	0	0	113.5	Q270 F271 L272	Q270-S274 WeakPolarHBondContact O-CB 3.33Å; Q270-S274 PolarHBondContact O-N 3.42Å; F271-S274 WeakPolarHBondContact O-CB 3.41Å; F271-S274 PolarHBondContact O-N 2.91Å; F271-S274 PolarHBondContact O-OG 3.42Å; L272-S274 VanDerWaalsContact C-N 3.34Å
275	Q	61	Low	61.1	Low	44 Å²	44	69 Å²	69	21%	0.206	37%	0.365	C	S	.	.			trans	-69.7	129.6	175.9	-70.3	-83.8	-14.7	0	0	110.2	F271 P280	F271-Q275 HydrophobicContact CE1-CG 4.19Å; F271-Q275 HydrophobicContact CE2-CG 4.38Å; F271-Q275 VanDerWaalsContact CE2-NE2 3.34Å; F271-Q275 HydrophobicContact CZ-CG 4.09Å; F271-Q275 PolarHBondContact O-N 2.83Å; Q275-P280 VanDerWaalsContact CD-CB 3.5Å; Q275-P280 HydrophobicContact CG-CB 4.01Å
276	K	54.5	Low	60.5	Low	210 Å²	210	72.3 Å²	72.3	91%	0.913	39%	0.385	S	S	*	.	S	Bend	trans	-84.7	-15.3	175.6	-75.9	-176.8	178.1	175	0	113.1
277	T	54.2	Low	60	Low	85 Å²	85	77.4 Å²	77.4	52%	0.521	40%	0.4	S	S	.	.	S	Bend	trans	-108.1	141.1	-177.7	44.6	0	0	0	0	109.3	M279	T277-M279 PolarHBondContact O-N 3.46Å; T277-M279 PolarHBondContact OG1-O 3.41Å
278	D	56.4	Low	59.5	Low	160 Å²	160	79.2 Å²	79.2	86%	0.856	41%	0.411	S	S	*	.	S	Bend	trans	-62.6	-13.4	178.3	-64.7	-35.1	0	0	0	113
279	M	54.4	Low	59.1	Low	95 Å²	95	79.6 Å²	79.6	47%	0.468	41%	0.413	S	S	.	.	S	Bend	trans	-128.6	116.2	175.6	-161.7	58.9	71.6	0	0	111.6	T277 E330	T277-M279 PolarHBondContact O-N 3.46Å; T277-M279 PolarHBondContact OG1-O 3.41Å; M279-E330 WeakPolarHBondContact CE-O 3.08Å
280	P	55.4	Low	58.8	Low	7 Å²	7	78.6 Å²	78.6	5%	0.045	42%	0.415	C	S	.	.			trans	-80	134.4	173.3	33.2	-34	0	0	0	110.7	F271 Q275 V282 C285	F271-P280 HydrophobicContact CE1-CB 4.32Å; F271-P280 HydrophobicContact CZ-CB 4.46Å; Q275-P280 VanDerWaalsContact CD-CB 3.5Å; Q275-P280 HydrophobicContact CG-CB 4.01Å; P280-V282 PolarHBondContact O-N 3.47Å; P280-C285 VanDerWaalsContact CB-SG 3.59Å
281	S	58.3	Low	58.6	Low	53 Å²	53	80.9 Å²	80.9	37%	0.371	42%	0.423	S	S	.	.			trans	-64.1	130.6	168.8	161.5	0	0	0	0	109.5	T283 D284 C285	S281-T283 PolarHBondContact O-N 3.49Å; S281-T283 VanDerWaalsContact O-N 3.09Å; S281-T283 PolarHBondContact OG-N 2.86Å; S281-D284 WeakPolarHBondContact CB-OD2 3.44Å; S281-D284 PolarHBondContact O-N 2.84Å; S281-C285 PolarHBondContact O-N 3.38Å; S281-C285 PolarHBondContact O-SG 3.43Å; S281-C285 VanDerWaalsContact O-SG 3.41Å
282	V	57.2	Low	58.4	Low	60 Å²	60	81.9 Å²	81.9	36%	0.364	43%	0.432	S	S	.	.	H	α-helix	trans	-51.1	-36.9	176.6	178.8	0	0	0	0	111.5	P280 C285 L286 F294 E330	P280-V282 PolarHBondContact O-N 3.47Å; V282-C285 WeakPolarHBondContact O-CB 3.3Å; V282-C285 PolarHBondContact O-N 2.86Å; V282-L286 PolarHBondContact O-N 3.22Å; V282-L286 VanDerWaalsContact O-N 3.15Å; V282-F294 HydrophobicContact CG1-CE2 4.36Å; V282-F294 HydrophobicContact CG1-CZ 4.13Å; V282-E330 HydrophobicContact CG2-CG 4.2Å
283	T	55.7	Low	58.3	Low	70 Å²	70	81 Å²	81	43%	0.429	43%	0.427	S	S	.	.	H	α-helix	trans	-65	-43	177.5	-45.2	0	0	0	0	111.5	S281 L286 F287	S281-T283 PolarHBondContact O-N 3.49Å; S281-T283 VanDerWaalsContact O-N 3.09Å; S281-T283 PolarHBondContact OG-N 2.86Å; T283-L286 PolarHBondContact O-N 2.89Å; T283-F287 HydrophobicContact CG2-CD2 4.26Å; T283-F287 HydrophobicContact CG2-CE2 3.93Å; T283-F287 WeakPolarHBondContact O-CD2 3.32Å
284	D	58.4	Low	58.4	Low	88 Å²	88	78.7 Å²	78.7	47%	0.471	42%	0.417	S	S	.	.	H	α-helix	trans	-67.5	-40.1	179.9	-67.1	-21.8	0	0	0	110.6	S281 L286 F287 T288	S281-D284 WeakPolarHBondContact CB-OD2 3.44Å; S281-D284 PolarHBondContact O-N 2.84Å; D284-L286 VanDerWaalsContact C-N 3.34Å; D284-L286 PolarHBondContact O-N 3.42Å; D284-F287 PolarHBondContact O-N 2.84Å; D284-T288 WeakPolarHBondContact O-CB 3.22Å; D284-T288 WeakPolarHBondContact O-CG2 3.06Å; D284-T288 PolarHBondContact O-N 3.48Å; D284-T288 PolarHBondContact O-OG1 2.81Å
285	C	55.1	Low	58.6	Low	0 Å²	0	75.5 Å²	75.5	0%	0	40%	0.397	C	S	.	.	H	α-helix	trans	-56	-45.5	173.9	-63.1	0	0	0	0	112.5	F271 P280 S281 V282 F287 T288 I289 F294	F271-C285 HydrophobicContact CE1-CB 4.19Å; F271-C285 WeakPolarHBondContact CE1-SG 3.31Å; F271-C285 HydrophobicContact CZ-CB 4Å; F271-C285 WeakPolarHBondContact CZ-SG 3.29Å; P280-C285 VanDerWaalsContact CB-SG 3.59Å; S281-C285 PolarHBondContact O-N 3.38Å; S281-C285 PolarHBondContact O-SG 3.43Å; S281-C285 VanDerWaalsContact O-SG 3.41Å; V282-C285 WeakPolarHBondContact O-CB 3.3Å; V282-C285 PolarHBondContact O-N 2.86Å; C285-F287 VanDerWaalsContact C-N 3.26Å; C285-F287 PolarHBondContact O-N 3.43Å; C285-T288 PolarHBondContact O-N 3.21Å; C285-T288 PolarHBondContact O-OG1 2.94Å; C285-I289 HydrophobicContact CB-CD1 3.87Å; C285-I289 WeakPolarHBondContact O-CB 3.39Å; C285-I289 WeakPolarHBondContact O-CG1 3.24Å; C285-I289 PolarHBondContact O-N 2.93Å; C285-F294 HydrophobicContact CB-CD2 3.96Å; C285-F294 HydrophobicContact CB-CE2 3.9Å
286	L	54.1	Low	59.2	Low	100 Å²	100	73.4 Å²	73.4	52%	0.524	39%	0.387	S	S	.	.	H	α-helix	trans	-63	-31.5	-175.8	-161.4	84.8	0	0	0	112.9	V282 T283 D284 F294	V282-L286 PolarHBondContact O-N 3.22Å; V282-L286 VanDerWaalsContact O-N 3.15Å; T283-L286 PolarHBondContact O-N 2.89Å; D284-L286 VanDerWaalsContact C-N 3.34Å; D284-L286 PolarHBondContact O-N 3.42Å; L286-F294 HydrophobicContact CD1-CD1 4.08Å; L286-F294 HydrophobicContact CD1-CD2 4.46Å; L286-F294 HydrophobicContact CD1-CE1 3.87Å; L286-F294 HydrophobicContact CD1-CE2 4.24Å; L286-F294 HydrophobicContact CD1-CG 4.38Å; L286-F294 HydrophobicContact CD1-CZ 3.96Å
287	F	55.3	Low	60.4	Low	167 Å²	167	63.5 Å²	63.5	73%	0.732	35%	0.345	S	S	*	.	H	α-helix	trans	-90	-17.7	-178.3	-74.8	-69.2	0	0	0	114.2	T283 D284 C285	T283-F287 HydrophobicContact CG2-CD2 4.26Å; T283-F287 HydrophobicContact CG2-CE2 3.93Å; T283-F287 WeakPolarHBondContact O-CD2 3.32Å; D284-F287 PolarHBondContact O-N 2.84Å; C285-F287 VanDerWaalsContact C-N 3.26Å; C285-F287 PolarHBondContact O-N 3.43Å
288	T	55	Low	61.7	Low	91 Å²	91	61.7 Å²	61.7	56%	0.558	33%	0.334	S	S	*	.	H	α-helix	trans	-110.7	-32.5	-170.8	47.5	0	0	0	0	113.2	F271 D284 C285	F271-T288 WeakPolarHBondContact CE2-OG1 3.4Å; D284-T288 WeakPolarHBondContact O-CB 3.22Å; D284-T288 WeakPolarHBondContact O-CG2 3.06Å; D284-T288 PolarHBondContact O-N 3.48Å; D284-T288 PolarHBondContact O-OG1 2.81Å; C285-T288 PolarHBondContact O-N 3.21Å; C285-T288 PolarHBondContact O-OG1 2.94Å
289	I	59	Low	63	Low	10 Å²	10	54 Å²	54	5%	0.051	29%	0.293	C	S	.	.	S	Bend	trans	-88.3	146	176.7	-50.2	174.7	0	0	0	109	V267 L268 F271 C285 A293	V267-I289 HydrophobicContact CG1-CG2 4.34Å; L268-I289 HydrophobicContact CD2-CD1 4.08Å; L268-I289 HydrophobicContact CD2-CG2 4.22Å; F271-I289 HydrophobicContact CB-CD1 4.35Å; F271-I289 HydrophobicContact CB-CG1 3.96Å; F271-I289 HydrophobicContact CD1-CD1 3.19Å; F271-I289 HydrophobicContact CD1-CG1 3.51Å; F271-I289 HydrophobicContact CD2-CD1 4.15Å; F271-I289 HydrophobicContact CD2-CG1 3.48Å; F271-I289 VanDerWaalsContact CD2-CG1 3.48Å; F271-I289 HydrophobicContact CE1-CD1 3.31Å; F271-I289 HydrophobicContact CE1-CG1 3.77Å; F271-I289 HydrophobicContact CE2-CD1 4.27Å; F271-I289 HydrophobicContact CE2-CG1 3.78Å; F271-I289 HydrophobicContact CG-CD1 3.61Å; F271-I289 HydrophobicContact CG-CG1 3.31Å; F271-I289 HydrophobicContact CZ-CD1 3.82Å; F271-I289 HydrophobicContact CZ-CG1 3.84Å; C285-I289 HydrophobicContact CB-CD1 3.87Å; C285-I289 WeakPolarHBondContact O-CB 3.39Å; C285-I289 WeakPolarHBondContact O-CG1 3.24Å; C285-I289 PolarHBondContact O-N 2.93Å; I289-A293 HydrophobicContact CG2-CB 3.3Å
290	S	60.7	Low	64.6	Low	53 Å²	53	49.5 Å²	49.5	37%	0.371	27%	0.271	S	S	.	.			trans	-55.6	145.8	166.6	62.9	0	0	0	0	109.9	S292 A293 F294	S290-S292 PolarHBondContact O-N 2.85Å; S290-S292 VanDerWaalsContact O-N 3.08Å; S290-S292 PolarHBondContact OG-OG 2.77Å; S290-A293 PolarHBondContact O-N 2.95Å; S290-A293 VanDerWaalsContact O-N 3.16Å; S290-A293 WeakPolarHBondContact OG-CB 3.04Å; S290-A293 PolarHBondContact OG-N 2.89Å; S290-F294 PolarHBondContact O-N 3.46Å; S290-F294 VanDerWaalsContact O-N 3.07Å
291	K	62.4	Low	66.2	Low	194 Å²	194	49.9 Å²	49.9	84%	0.843	27%	0.274	S	S	*	.	H	α-helix	trans	-55.5	-28.4	175.6	-70.5	-176.9	178.6	-179.7	0	112.5	G295	K291-G295 PolarHBondContact O-N 3.46Å
292	S	62.7	Low	67.7	Low	37 Å²	37	49 Å²	49	26%	0.259	26%	0.263	S	S	.	.	H	α-helix	trans	-65.1	-54.4	175.8	64.3	0	0	0	0	111.5	D264 S290 F294 G295 S296	D264-S292 WeakPolarHBondContact OD1-CB 3.44Å; D264-S292 PolarHBondContact OD1-OG 2.87Å; S290-S292 PolarHBondContact O-N 2.85Å; S290-S292 VanDerWaalsContact O-N 3.08Å; S290-S292 PolarHBondContact OG-OG 2.77Å; S292-F294 PolarHBondContact O-N 2.7Å; S292-G295 CarbonylContact O-C 3.58Å; S292-G295 WeakPolarHBondContact O-CA 3.22Å; S292-G295 PolarHBondContact O-N 3.24Å; S292-G295 VanDerWaalsContact O-N 3.07Å; S292-S296 PolarHBondContact O-N 3.42Å
293	A	65	Low	69.2	Low	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-66	-38.7	-177.7	0	0	0	0	0	111.3	D264 V267 L268 I289 S290 G295 S296	D264-A293 HydrophobicContact CB-CB 4.41Å; V267-A293 HydrophobicContact CB-CB 4.22Å; V267-A293 HydrophobicContact CG1-CB 3.82Å; L268-A293 HydrophobicContact CD2-CB 4.05Å; L268-A293 WeakPolarHBondContact CD2-O 3.38Å; L268-A293 HydrophobicContact CG-CB 3.89Å; I289-A293 HydrophobicContact CG2-CB 3.3Å; S290-A293 PolarHBondContact O-N 2.95Å; S290-A293 VanDerWaalsContact O-N 3.16Å; S290-A293 WeakPolarHBondContact OG-CB 3.04Å; S290-A293 PolarHBondContact OG-N 2.89Å; A293-G295 VanDerWaalsContact C-N 3.34Å; A293-G295 PolarHBondContact O-N 3.04Å; A293-S296 WeakPolarHBondContact O-CB 3.45Å; A293-S296 PolarHBondContact O-N 3.5Å; A293-S296 PolarHBondContact O-OG 3.49Å
294	F	66	Low	71	Confident	47 Å²	47	43 Å²	43	21%	0.206	23%	0.227	C	C	.	.	H	α-helix	trans	-62.4	-40.4	171.5	-173.4	-87.7	0	0	0	112.5	V282 C285 L286 S290 S292 S296 P298 L329	V282-F294 HydrophobicContact CG1-CE2 4.36Å; V282-F294 HydrophobicContact CG1-CZ 4.13Å; C285-F294 HydrophobicContact CB-CD2 3.96Å; C285-F294 HydrophobicContact CB-CE2 3.9Å; L286-F294 HydrophobicContact CD1-CD1 4.08Å; L286-F294 HydrophobicContact CD1-CD2 4.46Å; L286-F294 HydrophobicContact CD1-CE1 3.87Å; L286-F294 HydrophobicContact CD1-CE2 4.24Å; L286-F294 HydrophobicContact CD1-CG 4.38Å; L286-F294 HydrophobicContact CD1-CZ 3.96Å; S290-F294 PolarHBondContact O-N 3.46Å; S290-F294 VanDerWaalsContact O-N 3.07Å; S292-F294 PolarHBondContact O-N 2.7Å; F294-S296 PolarHBondContact O-N 3.28Å; F294-P298 WeakPolarHBondContact O-CD 3.44Å; F294-L329 HydrophobicContact CD2-CD1 3.7Å; F294-L329 HydrophobicContact CE1-CD1 4.47Å; F294-L329 HydrophobicContact CE2-CD1 3.19Å; F294-L329 HydrophobicContact CZ-CD1 3.64Å
295	G	68.9	Low	72.6	Confident	15 Å²	15	40 Å²	40	16%	0.155	21%	0.21	C	C	.	.	H	α-helix	trans	-67	-17.1	177.1	0	0	0	0	0	114.4	K291 S292 A293	K291-G295 PolarHBondContact O-N 3.46Å; S292-G295 CarbonylContact O-C 3.58Å; S292-G295 WeakPolarHBondContact O-CA 3.22Å; S292-G295 PolarHBondContact O-N 3.24Å; S292-G295 VanDerWaalsContact O-N 3.07Å; A293-G295 VanDerWaalsContact C-N 3.34Å; A293-G295 PolarHBondContact O-N 3.04Å
296	S	73.4	Confident	74.5	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-78.2	-30.8	-178.1	75.7	0	0	0	0	114	L268 S292 A293 F294 S299 L300	L268-S296 WeakPolarHBondContact CD1-OG 3.39Å; S292-S296 PolarHBondContact O-N 3.42Å; A293-S296 WeakPolarHBondContact O-CB 3.45Å; A293-S296 PolarHBondContact O-N 3.5Å; A293-S296 PolarHBondContact O-OG 3.49Å; F294-S296 PolarHBondContact O-N 3.28Å; S296-S299 WeakPolarHBondContact O-CB 3.46Å; S296-S299 PolarHBondContact O-N 3.42Å; S296-S299 VanDerWaalsContact O-N 3.13Å; S296-S299 PolarHBondContact O-OG 3.09Å; S296-L300 WeakPolarHBondContact O-CG 3.26Å; S296-L300 PolarHBondContact O-N 3.41Å
297	C	80.4	Confident	76.4	Confident	2 Å²	2	35.3 Å²	35.3	1%	0.014	19%	0.186	C	C	.	.	H	α-helix	trans	-59.2	-50.5	178.8	-70.6	0	0	0	0	112.9	S299 L300 A301 F327 L329	C297-S299 VanDerWaalsContact C-N 3.28Å; C297-S299 PolarHBondContact O-N 2.67Å; C297-L300 PolarHBondContact O-N 2.8Å; C297-A301 PolarHBondContact O-N 2.97Å; C297-A301 VanDerWaalsContact O-N 3.07Å; C297-F327 WeakPolarHBondContact CB-O 3.42Å; C297-L329 HydrophobicContact CB-CD2 4.38Å; C297-L329 HydrophobicContact CB-CG 4.21Å
298	P	81.4	Confident	78.3	Confident	46 Å²	46	29.2 Å²	29.2	30%	0.299	17%	0.166	S	C	.	.	H	α-helix	trans	-59.7	-36.9	173.3	-23.7	33.5	0	0	0	113.2	F294 L300 A301 Y302	F294-P298 WeakPolarHBondContact O-CD 3.44Å; P298-L300 VanDerWaalsContact C-N 3.3Å; P298-L300 PolarHBondContact O-N 3.26Å; P298-A301 PolarHBondContact O-N 2.91Å; P298-Y302 HydrophobicContact CB-CE2 4.2Å; P298-Y302 WeakPolarHBondContact O-CD2 2.78Å; P298-Y302 PolarHBondContact O-N 2.87Å
299	S	84.8	Confident	80.2	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-63.4	-36.6	178.7	81	0	0	0	0	112.2	L258 P260 S296 C297 A303	L258-S299 PolarHBondContact O-OG 2.85Å; P260-S299 WeakPolarHBondContact CD-OG 3.26Å; S296-S299 WeakPolarHBondContact O-CB 3.46Å; S296-S299 PolarHBondContact O-N 3.42Å; S296-S299 VanDerWaalsContact O-N 3.13Å; S296-S299 PolarHBondContact O-OG 3.09Å; C297-S299 VanDerWaalsContact C-N 3.28Å; C297-S299 PolarHBondContact O-N 2.67Å; S299-A303 VanDerWaalsContact O-CB 3.29Å; S299-A303 WeakPolarHBondContact O-CB 3.5Å; S299-A303 PolarHBondContact O-N 3.16Å
300	L	87.5	Confident	81.9	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-71	-40.2	175	-67.3	173	0	0	0	112	P260 Y265 S296 C297 P298 Y302 A303 A304 F327 F337 L344 F368	P260-L300 HydrophobicContact CG-CD1 4.28Å; P260-L300 HydrophobicContact CG-CD2 3.83Å; P260-L300 HydrophobicContact CG-CG 4.03Å; Y265-L300 HydrophobicContact CE1-CD1 3.9Å; Y265-L300 HydrophobicContact CE1-CD2 4.39Å; Y265-L300 VanDerWaalsContact OH-CD2 3.29Å; Y265-L300 WeakPolarHBondContact OH-CD2 3.42Å; S296-L300 WeakPolarHBondContact O-CG 3.26Å; S296-L300 PolarHBondContact O-N 3.41Å; C297-L300 PolarHBondContact O-N 2.8Å; P298-L300 VanDerWaalsContact C-N 3.3Å; P298-L300 PolarHBondContact O-N 3.26Å; L300-Y302 PolarHBondContact O-N 3.24Å; L300-A303 PolarHBondContact O-N 2.72Å; L300-A304 WeakPolarHBondContact O-CB 3.31Å; L300-A304 PolarHBondContact O-N 3.04Å; L300-F327 HydrophobicContact CB-CB 4.12Å; L300-F327 HydrophobicContact CB-CD1 3.59Å; L300-F327 HydrophobicContact CB-CD2 4.07Å; L300-F327 HydrophobicContact CB-CE1 3.96Å; L300-F327 HydrophobicContact CB-CE2 4.39Å; L300-F327 HydrophobicContact CB-CG 3.64Å; L300-F327 HydrophobicContact CB-CZ 4.34Å; L300-F327 HydrophobicContact CD1-CD1 3.87Å; L300-F327 HydrophobicContact CD1-CE1 4.06Å; L300-F327 HydrophobicContact CG-CD1 4.36Å; L300-F337 HydrophobicContact CD1-CE2 3.94Å; L300-F337 HydrophobicContact CD1-CZ 3.78Å; L300-L344 HydrophobicContact CB-CD2 4.46Å; L300-L344 HydrophobicContact CD2-CD2 4.04Å; L300-F368 HydrophobicContact CD2-CE2 4.25Å; L300-F368 HydrophobicContact CD2-CZ 4.33Å
301	A	88.1	Confident	83.4	Confident	14 Å²	14	23.7 Å²	23.7	12%	0.116	13%	0.13	C	C	.	.	H	α-helix	trans	-59.2	-46.7	173.5	0	0	0	0	0	111.5	C297 P298 A304 Q305 P324 F327	C297-A301 PolarHBondContact O-N 2.97Å; C297-A301 VanDerWaalsContact O-N 3.07Å; P298-A301 PolarHBondContact O-N 2.91Å; A301-A304 PolarHBondContact O-N 3.27Å; A301-Q305 PolarHBondContact O-N 3.22Å; A301-P324 HydrophobicContact CB-CB 4.27Å; A301-F327 HydrophobicContact CB-CB 4.07Å
302	Y	89.4	Confident	84.8	Confident	34 Å²	34	23.8 Å²	23.8	13%	0.133	13%	0.125	C	C	.	.	H	α-helix	trans	-66.3	-38.5	176.2	-66.6	-46.3	0	0	0	112.5	F195 F253 V254 P298 L300 A304 Q305 L306	F195-Y302 HydrophobicContact CE1-CD1 4.11Å; F253-Y302 HydrophobicContact CD1-CD2 4.36Å; F253-Y302 HydrophobicContact CD1-CG 4.47Å; V254-Y302 HydrophobicContact CB-CD2 4.18Å; V254-Y302 HydrophobicContact CB-CE2 4.17Å; V254-Y302 HydrophobicContact CG1-CE2 4.18Å; P298-Y302 HydrophobicContact CB-CE2 4.2Å; P298-Y302 WeakPolarHBondContact O-CD2 2.78Å; P298-Y302 PolarHBondContact O-N 2.87Å; L300-Y302 PolarHBondContact O-N 3.24Å; Y302-A304 VanDerWaalsContact C-N 3.34Å; Y302-A304 PolarHBondContact O-N 3.08Å; Y302-Q305 PolarHBondContact O-N 3.13Å; Y302-L306 VanDerWaalsContact O-CB 3.29Å; Y302-L306 WeakPolarHBondContact O-CB 3.47Å; Y302-L306 PolarHBondContact O-N 3.21Å
303	A	90.7	Very high	86.2	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-62.9	-40.2	174.5	0	0	0	0	0	111.8	S299 L300 T307 L344 F368	S299-A303 VanDerWaalsContact O-CB 3.29Å; S299-A303 WeakPolarHBondContact O-CB 3.5Å; S299-A303 PolarHBondContact O-N 3.16Å; L300-A303 PolarHBondContact O-N 2.72Å; A303-T307 VanDerWaalsContact O-CB 3.26Å; A303-T307 WeakPolarHBondContact O-CB 3.42Å; A303-T307 PolarHBondContact O-N 3.35Å; A303-T307 PolarHBondContact O-OG1 3.29Å; A303-L344 HydrophobicContact CB-CD2 4.15Å; A303-F368 HydrophobicContact CB-CE1 3.9Å; A303-F368 HydrophobicContact CB-CZ 3.97Å
304	A	92.3	Very high	87.4	Confident	4 Å²	4	23.7 Å²	23.7	3%	0.033	12%	0.122	C	C	.	.	H	α-helix	trans	-62.3	-45.7	174.5	0	0	0	0	0	111.8	L300 A301 Y302 T307 A308 V322 F327 L344	L300-A304 WeakPolarHBondContact O-CB 3.31Å; L300-A304 PolarHBondContact O-N 3.04Å; A301-A304 PolarHBondContact O-N 3.27Å; Y302-A304 VanDerWaalsContact C-N 3.34Å; Y302-A304 PolarHBondContact O-N 3.08Å; A304-T307 PolarHBondContact O-N 3.38Å; A304-A308 PolarHBondContact O-N 3.26Å; A304-V322 HydrophobicContact CB-CG1 4.09Å; A304-F327 HydrophobicContact CB-CD2 4.29Å; A304-F327 HydrophobicContact CB-CE2 3.92Å; A304-L344 HydrophobicContact CB-CD1 3.98Å; A304-L344 HydrophobicContact CB-CD2 4.46Å
305	Q	92.9	Very high	88.4	Confident	27 Å²	27	27 Å²	27	13%	0.126	14%	0.142	C	C	.	.	H	α-helix	trans	-62.7	-48.3	176.9	-172.3	177.3	16.7	0	0	112.1	F195 A301 Y302 T307 A308 L309 P324 W423	F195-Q305 HydrophobicContact CZ-CB 4.45Å; F195-Q305 HydrophobicContact CZ-CG 3.98Å; A301-Q305 PolarHBondContact O-N 3.22Å; Y302-Q305 PolarHBondContact O-N 3.13Å; Q305-T307 VanDerWaalsContact C-N 3.34Å; Q305-T307 PolarHBondContact O-N 2.98Å; Q305-A308 PolarHBondContact O-N 3.22Å; Q305-L309 HydrophobicContact CG-CD1 4.19Å; Q305-L309 WeakPolarHBondContact O-CG 3.49Å; Q305-L309 PolarHBondContact O-N 2.94Å; Q305-P324 HydrophobicContact CB-CG 4.11Å; Q305-W423 HydrophobicContact CG-CZ3 4.39Å
306	L	94.1	Very high	89.4	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-58.3	-46.9	176.8	172.5	63.2	0	0	0	110.7	L190 L191 F195 I197 F253 Y302 A308 L309 L310 L371	L190-L306 HydrophobicContact CB-CD1 4.06Å; L191-L306 HydrophobicContact CD2-CD1 4.15Å; L191-L306 HydrophobicContact CD2-CD2 3.79Å; L191-L306 HydrophobicContact CD2-CG 4.47Å; F195-L306 HydrophobicContact CB-CB 4.44Å; F195-L306 HydrophobicContact CB-CD1 4.13Å; F195-L306 HydrophobicContact CB-CD2 4.06Å; F195-L306 HydrophobicContact CB-CG 4.44Å; F195-L306 HydrophobicContact CD2-CB 4.12Å; F195-L306 HydrophobicContact CD2-CD1 3.71Å; F195-L306 HydrophobicContact CD2-CG 4.43Å; F195-L306 HydrophobicContact CE2-CD1 4.48Å; F195-L306 HydrophobicContact CG-CB 4.12Å; F195-L306 HydrophobicContact CG-CD1 4.17Å; I197-L306 HydrophobicContact CD1-CD2 4.33Å; F253-L306 HydrophobicContact CZ-CD2 3.83Å; Y302-L306 VanDerWaalsContact O-CB 3.29Å; Y302-L306 WeakPolarHBondContact O-CB 3.47Å; Y302-L306 PolarHBondContact O-N 3.21Å; L306-A308 VanDerWaalsContact C-N 3.34Å; L306-A308 PolarHBondContact O-N 2.79Å; L306-L309 PolarHBondContact O-N 3.3Å; L306-L310 HydrophobicContact CD1-CD1 3.75Å; L306-L310 HydrophobicContact CD1-CD2 4.27Å; L306-L310 HydrophobicContact CD1-CG 3.75Å; L306-L310 HydrophobicContact CD2-CD1 4.4Å; L306-L310 HydrophobicContact CG-CD1 3.75Å; L306-L310 HydrophobicContact CG-CG 4.18Å; L306-L310 WeakPolarHBondContact O-CB 3.17Å; L306-L310 VanDerWaalsContact O-CG 3.26Å; L306-L310 WeakPolarHBondContact O-CG 3.4Å; L306-L310 PolarHBondContact O-N 3.02Å; L306-L371 HydrophobicContact CD2-CD1 4.02Å; L306-L371 HydrophobicContact CD2-CD2 4.43Å
307	T	94.9	Very high	90.1	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.006	18%	0.18	C	C	.	.	H	α-helix	trans	-60.3	-43.9	-179.7	-57.7	0	0	0	0	111.4	A303 A304 Q305 L310 A311 L318 N347 V348 L351	A303-T307 VanDerWaalsContact O-CB 3.26Å; A303-T307 WeakPolarHBondContact O-CB 3.42Å; A303-T307 PolarHBondContact O-N 3.35Å; A303-T307 PolarHBondContact O-OG1 3.29Å; A304-T307 PolarHBondContact O-N 3.38Å; Q305-T307 VanDerWaalsContact C-N 3.34Å; Q305-T307 PolarHBondContact O-N 2.98Å; T307-L310 PolarHBondContact O-N 3.34Å; T307-A311 VanDerWaalsContact O-CB 3.25Å; T307-A311 WeakPolarHBondContact O-CB 3.38Å; T307-A311 PolarHBondContact O-N 3.06Å; T307-L318 HydrophobicContact CG2-CD1 4.09Å; T307-L318 HydrophobicContact CG2-CD2 4.4Å; T307-N347 HydrophobicContact CG2-CB 3.99Å; T307-V348 HydrophobicContact CG2-CG2 4.04Å; T307-V348 WeakPolarHBondContact OG1-CG2 3.48Å; T307-L351 HydrophobicContact CG2-CD2 4.09Å
308	A	94.4	Very high	90.5	Very high	39 Å²	39	40 Å²	40	32%	0.322	19%	0.191	S	C	.	.	H	α-helix	trans	-63.8	-42.5	176.3	0	0	0	0	0	112.5	A304 Q305 L306 A311 R312	A304-A308 PolarHBondContact O-N 3.26Å; Q305-A308 PolarHBondContact O-N 3.22Å; L306-A308 VanDerWaalsContact C-N 3.34Å; L306-A308 PolarHBondContact O-N 2.79Å; A308-A311 PolarHBondContact O-N 2.8Å; A308-R312 PolarHBondContact O-N 2.84Å
309	L	95.1	Very high	90.8	Very high	31 Å²	31	40.3 Å²	40.3	16%	0.162	19%	0.193	C	C	.	.	H	α-helix	trans	-65.3	-45.9	177	-72.5	172	0	0	0	111.8	L190 F195 Q305 L306 R312 V313	L190-L309 HydrophobicContact CD1-CB 4.16Å; L190-L309 HydrophobicContact CD2-CD1 4.1Å; F195-L309 HydrophobicContact CE2-CD1 3.71Å; F195-L309 HydrophobicContact CZ-CD1 4.13Å; Q305-L309 HydrophobicContact CG-CD1 4.19Å; Q305-L309 WeakPolarHBondContact O-CG 3.49Å; Q305-L309 PolarHBondContact O-N 2.94Å; L306-L309 PolarHBondContact O-N 3.3Å; L309-R312 PolarHBondContact O-N 2.79Å; L309-V313 WeakPolarHBondContact O-CG2 3.34Å; L309-V313 PolarHBondContact O-N 2.89Å
310	L	93.8	Very high	91.2	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-61	-45.2	176.7	-71.4	174.7	0	0	0	111.2	V187 L190 L191 L306 T307 R312 V313 L314 L351 L371 L374	V187-L310 HydrophobicContact CB-CD2 4.18Å; V187-L310 HydrophobicContact CG1-CD2 3.72Å; V187-L310 HydrophobicContact CG2-CD2 3.88Å; L190-L310 HydrophobicContact CB-CD2 4.35Å; L190-L310 HydrophobicContact CD1-CD2 3.99Å; L191-L310 HydrophobicContact CD2-CD1 4.32Å; L306-L310 HydrophobicContact CD1-CD1 3.75Å; L306-L310 HydrophobicContact CD1-CD2 4.27Å; L306-L310 HydrophobicContact CD1-CG 3.75Å; L306-L310 HydrophobicContact CD2-CD1 4.4Å; L306-L310 HydrophobicContact CG-CD1 3.75Å; L306-L310 HydrophobicContact CG-CG 4.18Å; L306-L310 WeakPolarHBondContact O-CB 3.17Å; L306-L310 VanDerWaalsContact O-CG 3.26Å; L306-L310 WeakPolarHBondContact O-CG 3.4Å; L306-L310 PolarHBondContact O-N 3.02Å; T307-L310 PolarHBondContact O-N 3.34Å; L310-R312 VanDerWaalsContact C-N 3.29Å; L310-R312 PolarHBondContact O-N 3.16Å; L310-V313 PolarHBondContact O-N 3.41Å; L310-L314 VanDerWaalsContact O-CB 3.27Å; L310-L314 WeakPolarHBondContact O-CB 3.4Å; L310-L314 WeakPolarHBondContact O-CG 2.93Å; L310-L314 PolarHBondContact O-N 2.67Å; L310-L351 HydrophobicContact CB-CD2 3.69Å; L310-L351 HydrophobicContact CD1-CD2 4.02Å; L310-L371 HydrophobicContact CD1-CD2 3.92Å; L310-L374 HydrophobicContact CD1-CD2 4Å
311	A	92.8	Very high	91.4	Very high	6 Å²	6	48.4 Å²	48.4	5%	0.05	24%	0.239	C	C	.	.	H	α-helix	trans	-58.1	-41.4	176.5	0	0	0	0	0	112	T307 A308 D315 V316 L318 L351	T307-A311 VanDerWaalsContact O-CB 3.25Å; T307-A311 WeakPolarHBondContact O-CB 3.38Å; T307-A311 PolarHBondContact O-N 3.06Å; A308-A311 PolarHBondContact O-N 2.8Å; A311-D315 WeakPolarHBondContact O-CA 3.42Å; A311-D315 PolarHBondContact O-N 3.03Å; A311-V316 PolarHBondContact O-N 2.84Å; A311-L318 HydrophobicContact CB-CD1 3.74Å; A311-L318 HydrophobicContact CB-CD2 3.85Å; A311-L318 HydrophobicContact CB-CG 3.65Å; A311-L351 HydrophobicContact CB-CD1 4.28Å
312	R	92.6	Very high	91.5	Very high	196 Å²	196	48.6 Å²	48.6	74%	0.74	24%	0.239	S	C	*	.	H	α-helix	trans	-66.9	-42.5	176.2	-173.3	174	-179.9	94.8	-1.8	112.8	A308 L309 L310	A308-R312 PolarHBondContact O-N 2.84Å; L309-R312 PolarHBondContact O-N 2.79Å; L310-R312 VanDerWaalsContact C-N 3.29Å; L310-R312 PolarHBondContact O-N 3.16Å
313	V	91.8	Very high	91.5	Very high	28 Å²	28	52 Å²	52	17%	0.17	25%	0.252	C	S	.	.	H	α-helix	trans	-66.1	-42.6	178.7	171	0	0	0	0	110.9	R183 M186 V187 L190 L309 L310 D315	R183-V313 HydrophobicContact CB-CG1 4.3Å; R183-V313 WeakPolarHBondContact CD-O 3.26Å; R183-V313 HydrophobicContact CG-CG1 4.19Å; R183-V313 WeakPolarHBondContact CG-O 3.29Å; R183-V313 PolarHBondContact NE-O 3.28Å; M186-V313 HydrophobicContact CB-CG1 3.96Å; M186-V313 HydrophobicContact CG-CB 4.5Å; M186-V313 HydrophobicContact CG-CG1 3.96Å; M186-V313 HydrophobicContact CG-CG2 3.67Å; V187-V313 HydrophobicContact CG2-CG1 4.01Å; L190-V313 HydrophobicContact CD1-CG2 4.18Å; L309-V313 WeakPolarHBondContact O-CG2 3.34Å; L309-V313 PolarHBondContact O-N 2.89Å; L310-V313 PolarHBondContact O-N 3.41Å; V313-D315 VanDerWaalsContact C-N 3.33Å
314	L	90	Very high	91.4	Very high	7 Å²	7	53.5 Å²	53.5	4%	0.037	26%	0.261	C	S	.	.	H	α-helix	trans	-85	-5	-177.4	-65.2	170.1	0	0	0	113.7	V187 L310 V316 L351 Q355 L381	V187-L314 HydrophobicContact CG2-CD1 4.35Å; V187-L314 HydrophobicContact CG2-CD2 3.99Å; V187-L314 HydrophobicContact CG2-CG 4.12Å; L310-L314 VanDerWaalsContact O-CB 3.27Å; L310-L314 WeakPolarHBondContact O-CB 3.4Å; L310-L314 WeakPolarHBondContact O-CG 2.93Å; L310-L314 PolarHBondContact O-N 2.67Å; L314-V316 HydrophobicContact CB-CG2 3.93Å; L314-L351 HydrophobicContact CD1-CD1 3.99Å; L314-Q355 HydrophobicContact CD1-CG 3.94Å; L314-L381 HydrophobicContact CD2-CB 3.92Å
315	D	87.9	Confident	91.2	Very high	116 Å²	116	55.5 Å²	55.5	62%	0.62	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.5	45.3	-177.1	-164.5	30.1	0	0	0	112.8	R183 A311 V313	R183-D315 VanDerWaalsContact NH2-CB 3.31Å; A311-D315 WeakPolarHBondContact O-CA 3.42Å; A311-D315 PolarHBondContact O-N 3.03Å; V313-D315 VanDerWaalsContact C-N 3.33Å
316	V	88.2	Confident	90.8	Very high	14 Å²	14	55.8 Å²	55.8	9%	0.085	28%	0.275	C	S	.	.			trans	-104.1	129.2	178	180	0	0	0	0	109.3	A311 L314 L351 S354	A311-V316 PolarHBondContact O-N 2.84Å; L314-V316 HydrophobicContact CB-CG2 3.93Å; V316-L351 HydrophobicContact CB-CD1 4Å; V316-L351 HydrophobicContact CG1-CD1 4.25Å; V316-L351 HydrophobicContact CG2-CD1 4.04Å; V316-S354 WeakPolarHBondContact CG2-OG 3.21Å
317	R	88.4	Confident	90.4	Very high	228 Å²	228	55.9 Å²	55.9	86%	0.86	28%	0.276	S	S	*	.			trans	-82.8	119.9	172.6	-66	-173	-176.7	-176.2	0.8	109.8
318	L	89.4	Confident	89.7	Confident	48 Å²	48	58.4 Å²	58.4	25%	0.251	29%	0.293	S	S	.	.			trans	-79.8	140.3	174.9	-61.2	-179.3	0	0	0	110.3	T307 A311 F320 N347 L351	T307-L318 HydrophobicContact CG2-CD1 4.09Å; T307-L318 HydrophobicContact CG2-CD2 4.4Å; A311-L318 HydrophobicContact CB-CD1 3.74Å; A311-L318 HydrophobicContact CB-CD2 3.85Å; A311-L318 HydrophobicContact CB-CG 3.65Å; L318-F320 VanDerWaalsContact C-N 3.31Å; L318-F320 PolarHBondContact O-N 2.87Å; L318-N347 HydrophobicContact CB-CB 4.46Å; L318-N347 HydrophobicContact CD1-CB 4.21Å; L318-N347 HydrophobicContact CD2-CB 4Å; L318-N347 HydrophobicContact CG-CB 4.45Å; L318-L351 HydrophobicContact CD2-CB 4.34Å
319	P	87.9	Confident	88.5	Confident	54 Å²	54	57.5 Å²	57.5	35%	0.351	28%	0.283	S	S	.	.	S	Bend	trans	-68.9	-27.7	179.2	26.7	-35.7	0	0	0	113.3	N347 V350 F397	P319-N347 WeakPolarHBondContact CD-OD1 3.3Å; P319-N347 VanDerWaalsContact CG-OD1 3.31Å; P319-N347 WeakPolarHBondContact CG-OD1 3.25Å; P319-V350 HydrophobicContact CG-CB 4.5Å; P319-V350 HydrophobicContact CG-CG2 4.02Å; P319-F397 HydrophobicContact CB-CE2 4.35Å; P319-F397 HydrophobicContact CB-CZ 4.09Å; P319-F397 HydrophobicContact CG-CE2 4.01Å; P319-F397 HydrophobicContact CG-CZ 4.27Å
320	F	92.5	Very high	87.2	Confident	40 Å²	40	60 Å²	60	18%	0.175	29%	0.293	C	S	.	.	S	Bend	trans	-126.4	146.7	-176.5	-55.1	-68.6	0	0	0	112	L318 V322 K343 A346 N347 L401 I404	L318-F320 VanDerWaalsContact C-N 3.31Å; L318-F320 PolarHBondContact O-N 2.87Å; F320-V322 HydrophobicContact CB-CG2 4.42Å; F320-K343 HydrophobicContact CB-CB 3.78Å; F320-K343 HydrophobicContact CB-CD 4.22Å; F320-K343 HydrophobicContact CB-CG 3.89Å; F320-K343 HydrophobicContact CD1-CD 4.3Å; F320-K343 HydrophobicContact CD1-CG 3.95Å; F320-K343 HydrophobicContact CD2-CB 4.12Å; F320-K343 HydrophobicContact CD2-CG 4.07Å; F320-K343 HydrophobicContact CG-CB 3.95Å; F320-K343 HydrophobicContact CG-CD 4.31Å; F320-K343 HydrophobicContact CG-CG 3.69Å; F320-A346 HydrophobicContact CD2-CB 3.66Å; F320-A346 HydrophobicContact CE2-CB 3.48Å; F320-A346 VanDerWaalsContact CE2-CB 3.48Å; F320-N347 PolarHBondContact N-OD1 3.38Å; F320-N347 PolarHBondContact O-ND2 3.1Å; F320-N347 PolarHBondContact O-OD1 2.86Å; F320-L401 HydrophobicContact CZ-CD2 3.71Å; F320-I404 HydrophobicContact CD2-CD1 4.2Å; F320-I404 HydrophobicContact CE1-CD1 4.22Å; F320-I404 HydrophobicContact CE2-CD1 3.46Å; F320-I404 VanDerWaalsContact CE2-CD1 3.46Å; F320-I404 HydrophobicContact CZ-CD1 3.48Å; F320-I404 VanDerWaalsContact CZ-CD1 3.48Å
321	V	91.5	Very high	85.9	Confident	130 Å²	130	64.3 Å²	64.3	79%	0.788	32%	0.317	S	S	*	.			trans	-85.8	123.9	166	-177.5	0	0	0	0	107.5
322	V	91.2	Very high	84.7	Confident	18 Å²	18	64.4 Å²	64.4	11%	0.109	32%	0.316	C	S	.	.			trans	-131.7	122	175.7	-179.3	0	0	0	0	107.3	A304 F320 F327 K343 L344	A304-V322 HydrophobicContact CB-CG1 4.09Å; F320-V322 HydrophobicContact CB-CG2 4.42Å; V322-F327 HydrophobicContact CG1-CE2 3.56Å; V322-F327 HydrophobicContact CG1-CZ 3.97Å; V322-K343 HydrophobicContact CG2-CB 3.52Å; V322-L344 HydrophobicContact CG1-CB 4.29Å
323	R	90	Very high	83.5	Confident	105 Å²	105	57.7 Å²	57.7	40%	0.396	30%	0.299	S	S	.	.			trans	-95.5	142.9	-179.6	-59.2	174.2	-64.5	-164.2	-3.8	109.1	T325 D326	R323-T325 WeakPolarHBondContact CB-OG1 3.49Å; R323-T325 PolarHBondContact O-N 3.5Å; R323-T325 VanDerWaalsContact O-N 3.15Å; R323-D326 IonicContact CZ-OD1 2.87Å; R323-D326 PolarHBondContact N-OD2 3.33Å; R323-D326 IonicContact NE-OD1 2.72Å; R323-D326 PolarHBondContact NE-OD1 3.24Å; R323-D326 IonicContact NH2-OD1 3.81Å; R323-D326 PolarHBondContact NH2-OD1 3.18Å; R323-D326 VanDerWaalsContact O-CB 3.3Å; R323-D326 WeakPolarHBondContact O-CB 3.27Å; R323-D326 PolarHBondContact O-N 2.86Å
324	P	88.1	Confident	82.1	Confident	31 Å²	31	60.4 Å²	60.4	20%	0.201	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-56.4	-30.1	172.2	-25.6	35.3	0	0	0	113	A301 Q305 D326 F327	A301-P324 HydrophobicContact CB-CB 4.27Å; Q305-P324 HydrophobicContact CB-CG 4.11Å; P324-D326 PolarHBondContact O-N 3.07Å; P324-F327 PolarHBondContact O-N 3.43Å
325	T	87.3	Confident	81	Confident	46 Å²	46	63.5 Å²	63.5	28%	0.282	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-65.5	-22.3	176.9	49.4	0	0	0	0	113.8	R323 F327 C328	R323-T325 WeakPolarHBondContact CB-OG1 3.49Å; R323-T325 PolarHBondContact O-N 3.5Å; R323-T325 VanDerWaalsContact O-N 3.15Å; T325-F327 PolarHBondContact O-N 2.83Å; T325-F327 VanDerWaalsContact O-N 3.16Å; T325-C328 WeakPolarHBondContact O-CB 3.12Å; T325-C328 PolarHBondContact O-N 3.03Å; T325-C328 VanDerWaalsContact O-N 3.1Å
326	D	85.9	Confident	80.6	Confident	33 Å²	33	63.3 Å²	63.3	18%	0.176	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-66	-15	175.5	-54.6	-28	0	0	0	111.5	R323 P324 A340	R323-D326 IonicContact CZ-OD1 2.87Å; R323-D326 PolarHBondContact N-OD2 3.33Å; R323-D326 IonicContact NE-OD1 2.72Å; R323-D326 PolarHBondContact NE-OD1 3.24Å; R323-D326 IonicContact NH2-OD1 3.81Å; R323-D326 PolarHBondContact NH2-OD1 3.18Å; R323-D326 VanDerWaalsContact O-CB 3.3Å; R323-D326 WeakPolarHBondContact O-CB 3.27Å; R323-D326 PolarHBondContact O-N 2.86Å; P324-D326 PolarHBondContact O-N 3.07Å; D326-A340 HydrophobicContact CB-CB 3.92Å
327	F	84.7	Confident	80.2	Confident	3 Å²	3	62.9 Å²	62.9	1%	0.013	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-110.8	4	176.4	-54.7	-71.4	0	0	0	113.6	C297 L300 A301 A304 V322 P324 T325 L329 F337 A340 A341 L344	C297-F327 WeakPolarHBondContact CB-O 3.42Å; L300-F327 HydrophobicContact CB-CB 4.12Å; L300-F327 HydrophobicContact CB-CD1 3.59Å; L300-F327 HydrophobicContact CB-CD2 4.07Å; L300-F327 HydrophobicContact CB-CE1 3.96Å; L300-F327 HydrophobicContact CB-CE2 4.39Å; L300-F327 HydrophobicContact CB-CG 3.64Å; L300-F327 HydrophobicContact CB-CZ 4.34Å; L300-F327 HydrophobicContact CD1-CD1 3.87Å; L300-F327 HydrophobicContact CD1-CE1 4.06Å; L300-F327 HydrophobicContact CG-CD1 4.36Å; A301-F327 HydrophobicContact CB-CB 4.07Å; A304-F327 HydrophobicContact CB-CD2 4.29Å; A304-F327 HydrophobicContact CB-CE2 3.92Å; V322-F327 HydrophobicContact CG1-CE2 3.56Å; V322-F327 HydrophobicContact CG1-CZ 3.97Å; P324-F327 PolarHBondContact O-N 3.43Å; T325-F327 PolarHBondContact O-N 2.83Å; T325-F327 VanDerWaalsContact O-N 3.16Å; F327-L329 PolarHBondContact O-N 3.33Å; F327-F337 AromaticContact CD1-CD2 3.98Å; F327-F337 HydrophobicContact CD1-CD2 3.98Å; F327-F337 AromaticContact CD1-CE2 3.75Å; F327-F337 HydrophobicContact CD1-CE2 3.75Å; F327-F337 HydrophobicContact CE1-CD2 4.46Å; F327-F337 HydrophobicContact CE1-CE2 4.31Å; F327-A340 HydrophobicContact CE1-CB 4.1Å; F327-A340 HydrophobicContact CZ-CB 4.01Å; F327-A341 HydrophobicContact CE1-CB 4.26Å; F327-L344 HydrophobicContact CE2-CD2 3.96Å; F327-L344 HydrophobicContact CZ-CB 4.09Å; F327-L344 HydrophobicContact CZ-CD2 3.81Å
328	C	80.3	Confident	79.7	Confident	53 Å²	53	53.3 Å²	53.3	36%	0.358	28%	0.282	S	S	.	.			trans	-76.8	119.6	173.9	-73.6	0	0	0	0	109.7	T325 E330 N331 I332	T325-C328 WeakPolarHBondContact O-CB 3.12Å; T325-C328 PolarHBondContact O-N 3.03Å; T325-C328 VanDerWaalsContact O-N 3.1Å; C328-E330 PolarHBondContact O-N 2.99Å; C328-N331 PolarHBondContact O-N 2.91Å; C328-I332 WeakPolarHBondContact O-CG1 3.19Å; C328-I332 PolarHBondContact O-N 3.44Å
329	L	69.6	Low	79.5	Confident	21 Å²	21	51.6 Å²	51.6	11%	0.11	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-50.2	-29.7	-178.7	-71.5	165.5	0	0	0	114.4	F294 C297 F327 N331 I332	F294-L329 HydrophobicContact CD2-CD1 3.7Å; F294-L329 HydrophobicContact CE1-CD1 4.47Å; F294-L329 HydrophobicContact CE2-CD1 3.19Å; F294-L329 HydrophobicContact CZ-CD1 3.64Å; C297-L329 HydrophobicContact CB-CD2 4.38Å; C297-L329 HydrophobicContact CB-CG 4.21Å; F327-L329 PolarHBondContact O-N 3.33Å; L329-N331 PolarHBondContact O-N 3.49Å; L329-I332 HydrophobicContact CD2-CD1 3.98Å; L329-I332 HydrophobicContact CG-CD1 4.47Å
330	E	68.3	Low	79.5	Confident	83 Å²	83	49.4 Å²	49.4	39%	0.388	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-70.9	-8.2	176.6	-62	-179.1	178.1	0	0	114.5	M279 V282 C328 S427	M279-E330 WeakPolarHBondContact CE-O 3.08Å; V282-E330 HydrophobicContact CG2-CG 4.2Å; C328-E330 PolarHBondContact O-N 2.99Å; E330-S427 PolarHBondContact OE2-OG 3.29Å
331	N	65.9	Low	79.2	Confident	91 Å²	91	47.6 Å²	47.6	49%	0.487	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-132.7	4.4	-177.3	-68.6	-32.5	0	0	0	112.8	C328 L329 C333	C328-N331 PolarHBondContact O-N 2.91Å; L329-N331 PolarHBondContact O-N 3.49Å; N331-C333 PolarHBondContact O-N 2.95Å
332	I	67.5	Low	78.9	Confident	8 Å²	8	41.4 Å²	41.4	4%	0.041	22%	0.215	C	C	.	.			trans	-71.9	102.1	-174.4	-68.9	175.7	0	0	0	110.3	L272 C328 L329 F337	L272-I332 HydrophobicContact CD1-CG2 3.6Å; L272-I332 HydrophobicContact CD2-CB 4.46Å; L272-I332 HydrophobicContact CD2-CG2 3.78Å; L272-I332 HydrophobicContact CG-CG2 4.35Å; C328-I332 WeakPolarHBondContact O-CG1 3.19Å; C328-I332 PolarHBondContact O-N 3.44Å; L329-I332 HydrophobicContact CD2-CD1 3.98Å; L329-I332 HydrophobicContact CG-CD1 4.47Å; I332-F337 HydrophobicContact CD1-CD2 3.94Å; I332-F337 HydrophobicContact CD1-CE2 4.28Å; I332-F337 HydrophobicContact CG1-CD2 4.35Å; I332-F337 HydrophobicContact CG2-CB 3.72Å; I332-F337 HydrophobicContact CG2-CD2 4.3Å; I332-F337 HydrophobicContact CG2-CG 4.23Å
333	C	67	Low	78.8	Confident	55 Å²	55	42.6 Å²	42.6	37%	0.372	22%	0.219	S	C	.	.			trans	-78.7	136.1	159.8	178.8	0	0	0	0	109.7	N331 D335 E336 F337	N331-C333 PolarHBondContact O-N 2.95Å; C333-D335 PolarHBondContact O-N 2.69Å; C333-E336 HydrophobicContact CB-CB 3.98Å; C333-E336 HydrophobicContact CB-CG 3.89Å; C333-E336 VanDerWaalsContact CB-OE2 3.32Å; C333-E336 WeakPolarHBondContact CB-OE2 3.29Å; C333-E336 PolarHBondContact O-N 2.97Å; C333-E336 VanDerWaalsContact O-N 3.13Å; C333-F337 PolarHBondContact O-N 3.46Å
334	K	63.2	Low	78.9	Confident	84 Å²	84	37.7 Å²	37.7	37%	0.365	20%	0.2	S	C	.	.	H	α-helix	trans	-53	-49.3	-172.1	176.9	-175.6	172.6	178.8	0	115	F273 E336	F273-K334 HydrophobicContact CD2-CD 4.36Å; F273-K334 VanDerWaalsContact CD2-CE 3.5Å; F273-K334 HydrophobicContact CD2-CG 4.24Å; F273-K334 HydrophobicContact CE2-CD 4.34Å; F273-K334 HydrophobicContact CE2-CG 4.07Å; F273-K334 VanDerWaalsContact CG-CE 3.48Å; F273-K334 HydrophobicContact CZ-CD 4.44Å; F273-K334 HydrophobicContact CZ-CG 4.5Å; K334-E336 VanDerWaalsContact C-N 3.34Å
335	D	66.7	Low	79	Confident	72 Å²	72	36.4 Å²	36.4	39%	0.385	19%	0.191	S	C	.	.	H	α-helix	trans	-81.8	-18.1	-177.9	-72.4	-8	0	0	0	111.4	C333 T339 K409	C333-D335 PolarHBondContact O-N 2.69Å; D335-T339 PolarHBondContact O-OG1 2.91Å; D335-K409 IonicContact OD2-NZ 2.93Å
336	E	78.6	Confident	79	Confident	113 Å²	113	34.2 Å²	34.2	53%	0.528	18%	0.178	S	C	.	.	H	α-helix	trans	-81.3	-37.1	179.7	-67.3	170.9	-161.9	0	0	112.1	C333 K334 E338 T339 A340	C333-E336 HydrophobicContact CB-CB 3.98Å; C333-E336 HydrophobicContact CB-CG 3.89Å; C333-E336 VanDerWaalsContact CB-OE2 3.32Å; C333-E336 WeakPolarHBondContact CB-OE2 3.29Å; C333-E336 PolarHBondContact O-N 2.97Å; C333-E336 VanDerWaalsContact O-N 3.13Å; K334-E336 VanDerWaalsContact C-N 3.34Å; E336-E338 PolarHBondContact O-N 2.87Å; E336-T339 PolarHBondContact O-N 3.32Å; E336-A340 WeakPolarHBondContact O-CB 3.42Å; E336-A340 PolarHBondContact O-N 2.83Å
337	F	80.7	Confident	79.3	Confident	5 Å²	5	32.9 Å²	32.9	2%	0.022	17%	0.171	C	C	.	.	H	α-helix	trans	-61.7	-46.8	-179.8	176.6	-96.4	0	0	0	113.1	Y265 L268 L272 L300 F327 I332 C333 T339 A340 A341	Y265-F337 HydrophobicContact CD1-CE1 4.15Å; Y265-F337 HydrophobicContact CD1-CZ 4.38Å; L268-F337 HydrophobicContact CD1-CE1 4.34Å; L268-F337 HydrophobicContact CD1-CZ 3.76Å; L272-F337 HydrophobicContact CD1-CB 4.46Å; L272-F337 HydrophobicContact CD1-CD1 4.34Å; L272-F337 HydrophobicContact CD1-CG 4.37Å; L300-F337 HydrophobicContact CD1-CE2 3.94Å; L300-F337 HydrophobicContact CD1-CZ 3.78Å; F327-F337 AromaticContact CD1-CD2 3.98Å; F327-F337 HydrophobicContact CD1-CD2 3.98Å; F327-F337 AromaticContact CD1-CE2 3.75Å; F327-F337 HydrophobicContact CD1-CE2 3.75Å; F327-F337 HydrophobicContact CE1-CD2 4.46Å; F327-F337 HydrophobicContact CE1-CE2 4.31Å; I332-F337 HydrophobicContact CD1-CD2 3.94Å; I332-F337 HydrophobicContact CD1-CE2 4.28Å; I332-F337 HydrophobicContact CG1-CD2 4.35Å; I332-F337 HydrophobicContact CG2-CB 3.72Å; I332-F337 HydrophobicContact CG2-CD2 4.3Å; I332-F337 HydrophobicContact CG2-CG 4.23Å; C333-F337 PolarHBondContact O-N 3.46Å; F337-T339 VanDerWaalsContact C-N 3.32Å; F337-T339 PolarHBondContact O-N 2.8Å; F337-A340 PolarHBondContact O-N 3.47Å; F337-A341 WeakPolarHBondContact O-CB 3.34Å; F337-A341 PolarHBondContact O-N 3.27Å
338	E	77.9	Confident	79.6	Confident	26 Å²	26	32.7 Å²	32.7	12%	0.121	17%	0.17	C	C	.	.	H	α-helix	trans	-62.7	-43.7	178.9	-71.9	-177.5	-156	0	0	111.1	K269 E336 A341 L342	K269-E338 WeakPolarHBondContact CD-OE1 3.29Å; K269-E338 WeakPolarHBondContact CE-OE1 3.26Å; K269-E338 VanDerWaalsContact CG-OE1 3.31Å; K269-E338 WeakPolarHBondContact CG-OE1 3.36Å; K269-E338 IonicContact NZ-OE1 2.87Å; K269-E338 PolarHBondContact NZ-OE1 3.5Å; K269-E338 IonicContact NZ-OE2 2.6Å; K269-E338 PolarHBondContact NZ-OE2 3.02Å; E336-E338 PolarHBondContact O-N 2.87Å; E338-A341 PolarHBondContact O-N 3.13Å; E338-L342 WeakPolarHBondContact O-CG 3.26Å; E338-L342 PolarHBondContact O-N 3.31Å
339	T	84.3	Confident	80	Confident	13 Å²	13	30.3 Å²	30.3	8%	0.08	15%	0.154	C	C	.	.	H	α-helix	trans	-64	-43.1	177.7	-54.4	0	0	0	0	110.9	D335 E336 F337 L342 K343 C407 E408	D335-T339 PolarHBondContact O-OG1 2.91Å; E336-T339 PolarHBondContact O-N 3.32Å; F337-T339 VanDerWaalsContact C-N 3.32Å; F337-T339 PolarHBondContact O-N 2.8Å; T339-L342 PolarHBondContact O-N 3.37Å; T339-K343 HydrophobicContact CG2-CD 4.03Å; T339-K343 WeakPolarHBondContact O-CB 3.4Å; T339-K343 WeakPolarHBondContact O-CG 3.32Å; T339-K343 PolarHBondContact O-N 3Å; T339-C407 WeakPolarHBondContact OG1-CB 3.39Å; T339-E408 HydrophobicContact CG2-CG 3.76Å
340	A	87.8	Confident	80.8	Confident	7 Å²	7	31 Å²	31	6%	0.058	16%	0.159	C	C	.	.	H	α-helix	trans	-66	-42.1	178	0	0	0	0	0	112.1	D326 F327 E336 F337 K343 L344	D326-A340 HydrophobicContact CB-CB 3.92Å; F327-A340 HydrophobicContact CE1-CB 4.1Å; F327-A340 HydrophobicContact CZ-CB 4.01Å; E336-A340 WeakPolarHBondContact O-CB 3.42Å; E336-A340 PolarHBondContact O-N 2.83Å; F337-A340 PolarHBondContact O-N 3.47Å; A340-K343 PolarHBondContact O-N 3.06Å; A340-L344 WeakPolarHBondContact O-CB 3.21Å; A340-L344 PolarHBondContact O-N 2.68Å
341	A	85.9	Confident	81.8	Confident	2 Å²	2	27 Å²	27	2%	0.017	14%	0.14	C	C	.	.	H	α-helix	trans	-62.1	-44.7	175.8	0	0	0	0	0	111.8	Y265 F327 F337 E338 L344 N345	Y265-A341 HydrophobicContact CD1-CB 4.41Å; Y265-A341 HydrophobicContact CE1-CB 3.76Å; F327-A341 HydrophobicContact CE1-CB 4.26Å; F337-A341 WeakPolarHBondContact O-CB 3.34Å; F337-A341 PolarHBondContact O-N 3.27Å; E338-A341 PolarHBondContact O-N 3.13Å; A341-L344 PolarHBondContact O-N 2.86Å; A341-N345 VanDerWaalsContact O-CG 3.26Å; A341-N345 PolarHBondContact O-N 2.72Å; A341-N345 PolarHBondContact O-OD1 3.4Å
342	L	85.5	Confident	82.8	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-62.4	-50.6	173.5	-70.8	170.6	0	0	0	110.5	Y237 E338 T339 L344 N345 A346 M400 L403 I404 C407	Y237-L342 HydrophobicContact CE1-CD1 4.1Å; Y237-L342 HydrophobicContact CE2-CD2 4.25Å; E338-L342 WeakPolarHBondContact O-CG 3.26Å; E338-L342 PolarHBondContact O-N 3.31Å; T339-L342 PolarHBondContact O-N 3.37Å; L342-L344 PolarHBondContact O-N 3.22Å; L342-N345 WeakPolarHBondContact O-CB 3.39Å; L342-N345 PolarHBondContact O-N 2.96Å; L342-A346 PolarHBondContact O-N 2.83Å; L342-M400 HydrophobicContact CB-SD 4.03Å; L342-M400 HydrophobicContact CD2-SD 3.68Å; L342-M400 HydrophobicContact CG-SD 4.45Å; L342-M400 WeakPolarHBondContact O-CE 3.45Å; L342-L403 HydrophobicContact CD1-CB 3.97Å; L342-L403 HydrophobicContact CD2-CB 4.26Å; L342-L403 HydrophobicContact CD2-CD1 4.26Å; L342-I404 HydrophobicContact CB-CD1 4.46Å; L342-I404 HydrophobicContact CB-CG1 3.75Å; L342-I404 HydrophobicContact CD1-CG1 4.47Å; L342-C407 HydrophobicContact CD1-CB 4.45Å
343	K	90.2	Very high	83.6	Confident	44 Å²	44	23.2 Å²	23.2	19%	0.191	12%	0.122	C	C	.	.	H	α-helix	trans	-54.6	-40.6	177	-74.7	173.2	176.8	173	0	112.5	F320 V322 T339 A340 A346 N347 I404 E408	F320-K343 HydrophobicContact CB-CB 3.78Å; F320-K343 HydrophobicContact CB-CD 4.22Å; F320-K343 HydrophobicContact CB-CG 3.89Å; F320-K343 HydrophobicContact CD1-CD 4.3Å; F320-K343 HydrophobicContact CD1-CG 3.95Å; F320-K343 HydrophobicContact CD2-CB 4.12Å; F320-K343 HydrophobicContact CD2-CG 4.07Å; F320-K343 HydrophobicContact CG-CB 3.95Å; F320-K343 HydrophobicContact CG-CD 4.31Å; F320-K343 HydrophobicContact CG-CG 3.69Å; V322-K343 HydrophobicContact CG2-CB 3.52Å; T339-K343 HydrophobicContact CG2-CD 4.03Å; T339-K343 WeakPolarHBondContact O-CB 3.4Å; T339-K343 WeakPolarHBondContact O-CG 3.32Å; T339-K343 PolarHBondContact O-N 3Å; A340-K343 PolarHBondContact O-N 3.06Å; K343-A346 WeakPolarHBondContact O-CB 3.3Å; K343-A346 PolarHBondContact O-N 2.98Å; K343-N347 VanDerWaalsContact O-CG 3.31Å; K343-N347 PolarHBondContact O-N 2.82Å; K343-I404 HydrophobicContact CG-CD1 4.11Å; K343-E408 WeakPolarHBondContact CE-OE1 3.32Å; K343-E408 IonicContact NZ-OE1 3.05Å; K343-E408 PolarHBondContact NZ-OE1 3.5Å
344	L	92.1	Very high	84.4	Confident	1 Å²	1	21.9 Å²	21.9	1%	0.005	11%	0.113	C	C	.	.	H	α-helix	trans	-61.3	-49.9	175.3	175.7	58.3	0	0	0	111.3	L300 A303 A304 V322 F327 A340 A341 L342 A346 N347 V348	L300-L344 HydrophobicContact CB-CD2 4.46Å; L300-L344 HydrophobicContact CD2-CD2 4.04Å; A303-L344 HydrophobicContact CB-CD2 4.15Å; A304-L344 HydrophobicContact CB-CD1 3.98Å; A304-L344 HydrophobicContact CB-CD2 4.46Å; V322-L344 HydrophobicContact CG1-CB 4.29Å; F327-L344 HydrophobicContact CE2-CD2 3.96Å; F327-L344 HydrophobicContact CZ-CB 4.09Å; F327-L344 HydrophobicContact CZ-CD2 3.81Å; A340-L344 WeakPolarHBondContact O-CB 3.21Å; A340-L344 PolarHBondContact O-N 2.68Å; A341-L344 PolarHBondContact O-N 2.86Å; L342-L344 PolarHBondContact O-N 3.22Å; L344-A346 PolarHBondContact O-N 3.16Å; L344-N347 WeakPolarHBondContact O-CB 3.17Å; L344-N347 PolarHBondContact O-N 3.35Å; L344-N347 VanDerWaalsContact O-N 3.16Å; L344-V348 HydrophobicContact CD1-CG2 4.25Å; L344-V348 WeakPolarHBondContact O-CG2 3.09Å; L344-V348 PolarHBondContact O-N 3.34Å
345	N	89.1	Confident	85.4	Confident	4 Å²	4	19 Å²	19	2%	0.021	10%	0.101	C	C	.	.	H	α-helix	trans	-57.5	-38.8	178.3	-73.8	2.4	0	0	0	111.8	A341 L342 V348 V349 L364 P367 M400	A341-N345 VanDerWaalsContact O-CG 3.26Å; A341-N345 PolarHBondContact O-N 2.72Å; A341-N345 PolarHBondContact O-OD1 3.4Å; L342-N345 WeakPolarHBondContact O-CB 3.39Å; L342-N345 PolarHBondContact O-N 2.96Å; N345-V348 PolarHBondContact O-N 2.86Å; N345-V349 WeakPolarHBondContact O-CG2 3.34Å; N345-V349 PolarHBondContact O-N 3.01Å; N345-L364 VanDerWaalsContact CB-O 3.26Å; N345-L364 WeakPolarHBondContact CB-O 3.47Å; N345-L364 PolarHBondContact ND2-O 2.8Å; N345-P367 WeakPolarHBondContact OD1-CD 2.9Å; N345-P367 WeakPolarHBondContact OD1-CG 3.37Å; N345-M400 HydrophobicContact CB-CE 3.99Å
346	A	87.7	Confident	86.2	Confident	1 Å²	1	16.2 Å²	16.2	1%	0.008	9%	0.086	C	C	.	.	H	α-helix	trans	-65	-47.8	177.6	0	0	0	0	0	110.5	F320 L342 K343 L344 V348 V349 V350 F397 M400	F320-A346 HydrophobicContact CD2-CB 3.66Å; F320-A346 HydrophobicContact CE2-CB 3.48Å; F320-A346 VanDerWaalsContact CE2-CB 3.48Å; L342-A346 PolarHBondContact O-N 2.83Å; K343-A346 WeakPolarHBondContact O-CB 3.3Å; K343-A346 PolarHBondContact O-N 2.98Å; L344-A346 PolarHBondContact O-N 3.16Å; A346-V348 VanDerWaalsContact C-N 3.26Å; A346-V348 PolarHBondContact O-N 3.3Å; A346-V349 PolarHBondContact O-N 3.47Å; A346-V350 WeakPolarHBondContact O-CG2 3.16Å; A346-V350 PolarHBondContact O-N 3.2Å; A346-F397 HydrophobicContact CB-CE2 4.22Å; A346-M400 HydrophobicContact CB-CE 3.05Å
347	N	91.7	Very high	85.8	Confident	4 Å²	4	12.7 Å²	12.7	2%	0.021	8%	0.08	C	C	.	.	H	α-helix	trans	-57.3	-43.5	177.9	-75.6	-10.5	0	0	0	110.9	T307 L318 P319 F320 K343 L344 L351	T307-N347 HydrophobicContact CG2-CB 3.99Å; L318-N347 HydrophobicContact CB-CB 4.46Å; L318-N347 HydrophobicContact CD1-CB 4.21Å; L318-N347 HydrophobicContact CD2-CB 4Å; L318-N347 HydrophobicContact CG-CB 4.45Å; P319-N347 WeakPolarHBondContact CD-OD1 3.3Å; P319-N347 VanDerWaalsContact CG-OD1 3.31Å; P319-N347 WeakPolarHBondContact CG-OD1 3.25Å; F320-N347 PolarHBondContact N-OD1 3.38Å; F320-N347 PolarHBondContact O-ND2 3.1Å; F320-N347 PolarHBondContact O-OD1 2.86Å; K343-N347 VanDerWaalsContact O-CG 3.31Å; K343-N347 PolarHBondContact O-N 2.82Å; L344-N347 WeakPolarHBondContact O-CB 3.17Å; L344-N347 PolarHBondContact O-N 3.35Å; L344-N347 VanDerWaalsContact O-N 3.16Å; N347-L351 WeakPolarHBondContact O-CB 3.44Å; N347-L351 PolarHBondContact O-N 3.05Å
348	V	92	Very high	85.1	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-64	-45	177.3	174.3	0	0	0	0	111.5	T307 L344 N345 A346 L351 C352 P367 N370 L371	T307-V348 HydrophobicContact CG2-CG2 4.04Å; T307-V348 WeakPolarHBondContact OG1-CG2 3.48Å; L344-V348 HydrophobicContact CD1-CG2 4.25Å; L344-V348 WeakPolarHBondContact O-CG2 3.09Å; L344-V348 PolarHBondContact O-N 3.34Å; N345-V348 PolarHBondContact O-N 2.86Å; A346-V348 VanDerWaalsContact C-N 3.26Å; A346-V348 PolarHBondContact O-N 3.3Å; V348-L351 PolarHBondContact O-N 2.98Å; V348-C352 WeakPolarHBondContact O-CB 3.45Å; V348-C352 PolarHBondContact O-N 2.98Å; V348-C352 PolarHBondContact O-SG 2.84Å; V348-P367 HydrophobicContact CB-CB 4.19Å; V348-P367 HydrophobicContact CG1-CB 4.12Å; V348-P367 WeakPolarHBondContact CG1-O 3.09Å; V348-P367 HydrophobicContact CG2-CB 3.98Å; V348-N370 HydrophobicContact CG1-CB 3.78Å; V348-L371 HydrophobicContact CG1-CD2 4.3Å; V348-L371 HydrophobicContact CG1-CG 4.08Å
349	V	87.5	Confident	84.6	Confident	2 Å²	2	20.8 Å²	20.8	1%	0.012	14%	0.142	C	C	.	.	H	α-helix	trans	-64.2	-44.4	178.4	170.5	0	0	0	0	111.5	N345 A346 L351 C352 S353 L362 L364	N345-V349 WeakPolarHBondContact O-CG2 3.34Å; N345-V349 PolarHBondContact O-N 3.01Å; A346-V349 PolarHBondContact O-N 3.47Å; V349-L351 PolarHBondContact O-N 2.87Å; V349-C352 PolarHBondContact O-N 3.35Å; V349-S353 VanDerWaalsContact O-CB 3.25Å; V349-S353 WeakPolarHBondContact O-CB 3.29Å; V349-S353 PolarHBondContact O-N 3.31Å; V349-S353 PolarHBondContact O-OG 2.63Å; V349-L362 HydrophobicContact CG1-CD1 4.23Å; V349-L364 HydrophobicContact CB-CD2 4.49Å; V349-L364 HydrophobicContact CG1-CD2 4.33Å; V349-L364 HydrophobicContact CG2-CD2 3.93Å
350	V	86.2	Confident	84	Confident	35 Å²	35	23 Å²	23	21%	0.212	15%	0.151	C	C	.	.	H	α-helix	trans	-62.7	-43.5	176.1	170.9	0	0	0	0	111.2	P319 A346 S353 S354 F397	P319-V350 HydrophobicContact CG-CB 4.5Å; P319-V350 HydrophobicContact CG-CG2 4.02Å; A346-V350 WeakPolarHBondContact O-CG2 3.16Å; A346-V350 PolarHBondContact O-N 3.2Å; V350-S353 WeakPolarHBondContact CA-OG 3.37Å; V350-S353 PolarHBondContact O-OG 3.07Å; V350-S353 VanDerWaalsContact O-OG 3.07Å; V350-S354 WeakPolarHBondContact O-CB 3.3Å; V350-S354 PolarHBondContact O-N 3.27Å; V350-S354 VanDerWaalsContact O-N 3.12Å; V350-F397 HydrophobicContact CG2-CD2 3.8Å; V350-F397 HydrophobicContact CG2-CE2 3.66Å
351	L	89.2	Confident	83.4	Confident	0 Å²	0	28 Å²	28	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-59.2	-52.2	175.3	179.2	67.3	0	0	0	111	T307 L310 A311 L314 V316 L318 N347 V348 V349 S354 L374	T307-L351 HydrophobicContact CG2-CD2 4.09Å; L310-L351 HydrophobicContact CB-CD2 3.69Å; L310-L351 HydrophobicContact CD1-CD2 4.02Å; A311-L351 HydrophobicContact CB-CD1 4.28Å; L314-L351 HydrophobicContact CD1-CD1 3.99Å; V316-L351 HydrophobicContact CB-CD1 4Å; V316-L351 HydrophobicContact CG1-CD1 4.25Å; V316-L351 HydrophobicContact CG2-CD1 4.04Å; L318-L351 HydrophobicContact CD2-CB 4.34Å; N347-L351 WeakPolarHBondContact O-CB 3.44Å; N347-L351 PolarHBondContact O-N 3.05Å; V348-L351 PolarHBondContact O-N 2.98Å; V349-L351 PolarHBondContact O-N 2.87Å; L351-S354 PolarHBondContact O-N 3.21Å; L351-S354 PolarHBondContact O-OG 3.34Å; L351-L374 HydrophobicContact CD2-CD2 4.46Å
352	C	88.8	Confident	83.1	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-67.2	-43.5	-176	-65.8	0	0	0	0	111.9	V348 V349 S354 Q355 I356 L362 N370	V348-C352 WeakPolarHBondContact O-CB 3.45Å; V348-C352 PolarHBondContact O-N 2.98Å; V348-C352 PolarHBondContact O-SG 2.84Å; V349-C352 PolarHBondContact O-N 3.35Å; C352-S354 PolarHBondContact O-N 3.36Å; C352-Q355 PolarHBondContact O-N 3.39Å; C352-I356 HydrophobicContact CB-CD1 3.92Å; C352-I356 WeakPolarHBondContact O-CB 3.37Å; C352-I356 WeakPolarHBondContact O-CG1 3.47Å; C352-I356 PolarHBondContact O-N 3.02Å; C352-L362 HydrophobicContact CB-CD1 4.05Å; C352-L362 HydrophobicContact CB-CD2 3.94Å; C352-N370 HydrophobicContact CB-CB 4.39Å; C352-N370 PolarHBondContact SG-O 3.41Å
353	S	83.5	Confident	82.8	Confident	19 Å²	19	29.9 Å²	29.9	13%	0.133	19%	0.193	C	C	.	.	H	α-helix	trans	-63.7	-26.3	176.9	57.5	0	0	0	0	113.2	V349 V350 Q355	V349-S353 VanDerWaalsContact O-CB 3.25Å; V349-S353 WeakPolarHBondContact O-CB 3.29Å; V349-S353 PolarHBondContact O-N 3.31Å; V349-S353 PolarHBondContact O-OG 2.63Å; V350-S353 WeakPolarHBondContact CA-OG 3.37Å; V350-S353 PolarHBondContact O-OG 3.07Å; V350-S353 VanDerWaalsContact O-OG 3.07Å; S353-Q355 PolarHBondContact O-N 3.47Å
354	S	83.7	Confident	82	Confident	28 Å²	28	28.5 Å²	28.5	20%	0.196	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-17.7	174	77.8	0	0	0	0	113.7	V316 V350 L351 C352	V316-S354 WeakPolarHBondContact CG2-OG 3.21Å; V350-S354 WeakPolarHBondContact O-CB 3.3Å; V350-S354 PolarHBondContact O-N 3.27Å; V350-S354 VanDerWaalsContact O-N 3.12Å; L351-S354 PolarHBondContact O-N 3.21Å; L351-S354 PolarHBondContact O-OG 3.34Å; C352-S354 PolarHBondContact O-N 3.36Å
355	Q	85.1	Confident	81.3	Confident	22 Å²	22	29.4 Å²	29.4	10%	0.103	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.3	-39.3	-173.4	-56	-53.5	-57.5	0	0	113.4	L314 C352 S353 L374 L381	L314-Q355 HydrophobicContact CD1-CG 3.94Å; C352-Q355 PolarHBondContact O-N 3.39Å; S353-Q355 PolarHBondContact O-N 3.47Å; Q355-L374 HydrophobicContact CB-CD1 3.65Å; Q355-L374 HydrophobicContact CG-CD1 3.96Å; Q355-L381 HydrophobicContact CB-CD2 3.73Å; Q355-L381 HydrophobicContact CG-CD2 4.18Å
356	I	81.9	Confident	80.8	Confident	14 Å²	14	30.8 Å²	30.8	7%	0.072	20%	0.198	C	C	.	.	S	Bend	trans	-84.2	128.7	-175.8	-58.8	176.2	0	0	0	108.7	C352 K360 L362 L373 L374 E377	C352-I356 HydrophobicContact CB-CD1 3.92Å; C352-I356 WeakPolarHBondContact O-CB 3.37Å; C352-I356 WeakPolarHBondContact O-CG1 3.47Å; C352-I356 PolarHBondContact O-N 3.02Å; I356-K360 HydrophobicContact CG2-CB 3.73Å; I356-K360 HydrophobicContact CG2-CD 3.82Å; I356-K360 HydrophobicContact CG2-CG 3.96Å; I356-L362 HydrophobicContact CD1-CD2 4.06Å; I356-L373 HydrophobicContact CD1-CB 3.87Å; I356-L374 HydrophobicContact CD1-CB 4.33Å; I356-L374 HydrophobicContact CG1-CD1 4.29Å; I356-E377 HydrophobicContact CG1-CG 4.29Å; I356-E377 HydrophobicContact CG2-CG 4.47Å
357	G	70.3	Confident	80.7	Confident	40 Å²	40	30.9 Å²	30.9	41%	0.412	20%	0.198	S	C	.	.			trans	-70	169.5	-179.5	0	0	0	0	0	114.1	G359	G357-G359 PolarHBondContact O-N 3.4Å
358	D	66.1	Low	80.4	Confident	124 Å²	124	31 Å²	31	66%	0.663	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.2	4.8	-172.2	-60.7	-36.1	0	0	0	117.3
359	G	67	Low	80.1	Confident	76 Å²	76	34.3 Å²	34.3	78%	0.784	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.7	-9.8	-174.6	0	0	0	0	0	116.3	G357	G357-G359 PolarHBondContact O-N 3.4Å
360	K	72.1	Confident	80.1	Confident	60 Å²	60	34.2 Å²	34.2	26%	0.261	21%	0.21	S	C	.	.	S	Bend	trans	-111.6	128.3	-178.9	-62	-166.9	179.5	-179.6	0	110.9	I356 L362 L373 E376 E377	I356-K360 HydrophobicContact CG2-CB 3.73Å; I356-K360 HydrophobicContact CG2-CD 3.82Å; I356-K360 HydrophobicContact CG2-CG 3.96Å; K360-L362 PolarHBondContact O-N 3.01Å; K360-L373 HydrophobicContact CD-CD2 4.21Å; K360-E376 IonicContact NZ-OE2 3.5Å; K360-E376 PolarHBondContact NZ-OE2 3.24Å; K360-E377 WeakPolarHBondContact CE-OE1 3.49Å; K360-E377 IonicContact NZ-OE1 3.4Å; K360-E377 PolarHBondContact NZ-OE1 3.49Å
361	T	75.1	Confident	80.3	Confident	112 Å²	112	32.5 Å²	32.5	69%	0.687	20%	0.2	S	C	*	.			trans	-75.8	116.8	174.1	-42.6	0	0	0	0	109
362	L	80.5	Confident	80.3	Confident	7 Å²	7	33.1 Å²	33.1	4%	0.037	20%	0.204	C	C	.	.			trans	-77.7	162.1	169.2	-61.4	179.7	0	0	0	109	V349 C352 I356 K360 N370 L373 E396	V349-L362 HydrophobicContact CG1-CD1 4.23Å; C352-L362 HydrophobicContact CB-CD1 4.05Å; C352-L362 HydrophobicContact CB-CD2 3.94Å; I356-L362 HydrophobicContact CD1-CD2 4.06Å; K360-L362 PolarHBondContact O-N 3.01Å; L362-N370 HydrophobicContact CD2-CB 4.4Å; L362-L373 HydrophobicContact CD2-CD1 4.32Å; L362-E396 VanDerWaalsContact O-OE1 3.05Å
363	S	78.3	Confident	80.2	Confident	34 Å²	34	33.6 Å²	33.6	24%	0.238	21%	0.206	C	C	.	.			trans	-132.4	123.9	174.4	176.9	0	0	0	0	110.3	L365 R366 N370	S363-L365 VanDerWaalsContact C-N 3.27Å; S363-L365 PolarHBondContact O-N 3.25Å; S363-R366 PolarHBondContact O-N 3.25Å; S363-N370 PolarHBondContact N-OD1 3.15Å; S363-N370 PolarHBondContact O-ND2 3.45Å
364	L	74.1	Confident	80.4	Confident	16 Å²	16	32.7 Å²	32.7	8%	0.084	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-40.4	179.7	-67.2	176.8	0	0	0	113.7	N345 V349 E396 E399 M400	N345-L364 VanDerWaalsContact CB-O 3.26Å; N345-L364 WeakPolarHBondContact CB-O 3.47Å; N345-L364 PolarHBondContact ND2-O 2.8Å; V349-L364 HydrophobicContact CB-CD2 4.49Å; V349-L364 HydrophobicContact CG1-CD2 4.33Å; V349-L364 HydrophobicContact CG2-CD2 3.93Å; L364-E396 HydrophobicContact CD1-CB 3.87Å; L364-E396 HydrophobicContact CD1-CG 4.07Å; L364-E396 VanDerWaalsContact CD1-O 3.22Å; L364-E396 WeakPolarHBondContact CD1-O 3.3Å; L364-E396 HydrophobicContact CD2-CB 3.62Å; L364-E396 HydrophobicContact CD2-CG 4.31Å; L364-E396 HydrophobicContact CG-CB 3.73Å; L364-E396 HydrophobicContact CG-CG 3.9Å; L364-E399 HydrophobicContact CD1-CB 4.25Å; L364-E399 HydrophobicContact CD1-CG 4.42Å; L364-M400 HydrophobicContact CB-CG 4.32Å; L364-M400 HydrophobicContact CD1-CG 3.95Å; L364-M400 HydrophobicContact CD2-CB 4.3Å; L364-M400 HydrophobicContact CD2-CG 3.67Å; L364-M400 HydrophobicContact CG-CG 4.19Å
365	L	77.2	Confident	80.5	Confident	19 Å²	19	35.8 Å²	35.8	10%	0.099	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	6.5	-173.4	-60	-179.8	0	0	0	113.2	I241 M243 S363 P367	I241-L365 HydrophobicContact CD1-CD1 3.92Å; I241-L365 HydrophobicContact CG2-CD1 4.38Å; M243-L365 HydrophobicContact SD-CD1 4.23Å; S363-L365 VanDerWaalsContact C-N 3.27Å; S363-L365 PolarHBondContact O-N 3.25Å; L365-P367 VanDerWaalsContact C-CD 3.45Å; L365-P367 WeakPolarHBondContact O-CD 3.38Å
366	R	78	Confident	80.4	Confident	34 Å²	34	39.9 Å²	39.9	13%	0.128	23%	0.226	C	C	.	.			trans	-125.8	64.6	-176.5	-55.2	179.7	69.6	-156.3	1.2	111.1	A246 S363 F368 W369 N370	A246-R366 PolarHBondContact O-NH2 3.41Å; S363-R366 PolarHBondContact O-N 3.25Å; R366-F368 PolarHBondContact O-N 3.44Å; R366-W369 HydrophobicContact CB-CB 3.73Å; R366-W369 WeakPolarHBondContact O-CB 3.33Å; R366-W369 PolarHBondContact O-N 2.91Å; R366-W369 VanDerWaalsContact O-N 3.13Å; R366-N370 PolarHBondContact O-N 2.75Å; R366-N370 PolarHBondContact O-ND2 3.47Å
367	P	85.6	Confident	80.3	Confident	3 Å²	3	42.5 Å²	42.5	2%	0.019	24%	0.239	C	C	.	.	H	α-helix	trans	-55.7	-40.6	-178.7	25.4	-36.8	0	0	0	112	N345 V348 L365 N370 L371	N345-P367 WeakPolarHBondContact OD1-CD 2.9Å; N345-P367 WeakPolarHBondContact OD1-CG 3.37Å; V348-P367 HydrophobicContact CB-CB 4.19Å; V348-P367 HydrophobicContact CG1-CB 4.12Å; V348-P367 WeakPolarHBondContact CG1-O 3.09Å; V348-P367 HydrophobicContact CG2-CB 3.98Å; L365-P367 VanDerWaalsContact C-CD 3.45Å; L365-P367 WeakPolarHBondContact O-CD 3.38Å; P367-N370 PolarHBondContact O-N 2.72Å; P367-L371 WeakPolarHBondContact O-CG 3.39Å; P367-L371 PolarHBondContact O-N 2.91Å
368	F	87.1	Confident	80.6	Confident	5 Å²	5	41.2 Å²	41.2	2%	0.022	22%	0.223	C	C	.	.	H	α-helix	trans	-67.1	-38.3	179.8	-60.1	-83.2	0	0	0	113.2	F251 F253 A259 P260 L300 A303 R366 L371 V372	F251-F368 HydrophobicContact CB-CB 4.11Å; F251-F368 HydrophobicContact CD1-CB 4.3Å; F251-F368 HydrophobicContact CD2-CB 3.59Å; F251-F368 HydrophobicContact CD2-CG 4.49Å; F251-F368 HydrophobicContact CE2-CB 4.09Å; F251-F368 HydrophobicContact CG-CB 3.72Å; F253-F368 AromaticContact CD2-CD1 3.68Å; F253-F368 HydrophobicContact CD2-CD1 3.68Å; F253-F368 AromaticContact CD2-CE1 3.65Å; F253-F368 HydrophobicContact CD2-CE1 3.65Å; F253-F368 AromaticContact CE2-CD1 3.63Å; F253-F368 HydrophobicContact CE2-CD1 3.63Å; F253-F368 AromaticContact CE2-CE1 3.7Å; F253-F368 HydrophobicContact CE2-CE1 3.7Å; F253-F368 HydrophobicContact CG-CE1 4.33Å; F253-F368 HydrophobicContact CZ-CE1 4.45Å; A259-F368 HydrophobicContact CB-CB 4.35Å; A259-F368 HydrophobicContact CB-CD1 3.98Å; A259-F368 HydrophobicContact CB-CD2 3.5Å; A259-F368 HydrophobicContact CB-CE1 4.13Å; A259-F368 HydrophobicContact CB-CE2 3.7Å; A259-F368 HydrophobicContact CB-CG 3.66Å; A259-F368 HydrophobicContact CB-CZ 4Å; P260-F368 HydrophobicContact CG-CE2 4.08Å; L300-F368 HydrophobicContact CD2-CE2 4.25Å; L300-F368 HydrophobicContact CD2-CZ 4.33Å; A303-F368 HydrophobicContact CB-CE1 3.9Å; A303-F368 HydrophobicContact CB-CZ 3.97Å; R366-F368 PolarHBondContact O-N 3.44Å; F368-L371 PolarHBondContact O-N 3.29Å; F368-V372 WeakPolarHBondContact O-CG2 3.22Å; F368-V372 PolarHBondContact O-N 3.23Å
369	W	84.9	Confident	81	Confident	70 Å²	70	44 Å²	44	27%	0.265	23%	0.231	S	C	.	.	H	α-helix	trans	-62.1	-46.4	173.1	177.9	-108.1	0	0	0	110.7	F251 R366 L371 V372 L373	F251-W369 HydrophobicContact CE1-CE3 4.03Å; F251-W369 HydrophobicContact CE2-CB 4.27Å; F251-W369 HydrophobicContact CZ-CB 3.75Å; F251-W369 HydrophobicContact CZ-CD2 4.4Å; F251-W369 AromaticContact CZ-CE3 3.71Å; F251-W369 HydrophobicContact CZ-CE3 3.71Å; F251-W369 HydrophobicContact CZ-CG 4.48Å; R366-W369 HydrophobicContact CB-CB 3.73Å; R366-W369 WeakPolarHBondContact O-CB 3.33Å; R366-W369 PolarHBondContact O-N 2.91Å; R366-W369 VanDerWaalsContact O-N 3.13Å; W369-L371 VanDerWaalsContact C-N 3.3Å; W369-L371 PolarHBondContact O-N 2.9Å; W369-V372 WeakPolarHBondContact O-CB 3.47Å; W369-V372 PolarHBondContact O-N 3.17Å; W369-V372 VanDerWaalsContact O-N 3.1Å; W369-L373 HydrophobicContact CZ2-CD2 4.04Å; W369-L373 WeakPolarHBondContact O-CG 3.31Å; W369-L373 PolarHBondContact O-N 3.46Å
370	N	87.9	Confident	81.3	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-61	-39.2	178.2	-60.9	-22	0	0	0	111.8	V348 C352 L362 S363 R366 P367 L373 L374	V348-N370 HydrophobicContact CG1-CB 3.78Å; C352-N370 HydrophobicContact CB-CB 4.39Å; C352-N370 PolarHBondContact SG-O 3.41Å; L362-N370 HydrophobicContact CD2-CB 4.4Å; S363-N370 PolarHBondContact N-OD1 3.15Å; S363-N370 PolarHBondContact O-ND2 3.45Å; R366-N370 PolarHBondContact O-N 2.75Å; R366-N370 PolarHBondContact O-ND2 3.47Å; P367-N370 PolarHBondContact O-N 2.72Å; N370-L373 WeakPolarHBondContact O-CB 3.43Å; N370-L373 PolarHBondContact O-N 2.91Å; N370-L374 PolarHBondContact O-N 3.06Å
371	L	90.3	Very high	81.5	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-66.4	-35.6	174.8	-69.6	170.5	0	0	0	112.7	I197 L306 L310 V348 P367 F368 W369 L374 R375	I197-L371 HydrophobicContact CD1-CB 3.66Å; I197-L371 HydrophobicContact CD1-CD1 4.29Å; L306-L371 HydrophobicContact CD2-CD1 4.02Å; L306-L371 HydrophobicContact CD2-CD2 4.43Å; L310-L371 HydrophobicContact CD1-CD2 3.92Å; V348-L371 HydrophobicContact CG1-CD2 4.3Å; V348-L371 HydrophobicContact CG1-CG 4.08Å; P367-L371 WeakPolarHBondContact O-CG 3.39Å; P367-L371 PolarHBondContact O-N 2.91Å; F368-L371 PolarHBondContact O-N 3.29Å; W369-L371 VanDerWaalsContact C-N 3.3Å; W369-L371 PolarHBondContact O-N 2.9Å; L371-L374 WeakPolarHBondContact O-CB 3.36Å; L371-L374 PolarHBondContact O-N 3.21Å; L371-R375 PolarHBondContact O-N 3.2Å
372	V	88.2	Confident	81.2	Confident	12 Å²	12	36.3 Å²	36.3	7%	0.073	17%	0.171	C	C	.	.	H	α-helix	trans	-67.5	-42.4	171.9	171.9	0	0	0	0	110.9	I197 V199 F251 F368 W369 L374 R375 E376	I197-V372 HydrophobicContact CB-CG2 4.11Å; I197-V372 HydrophobicContact CG2-CG2 3.64Å; V199-V372 HydrophobicContact CG2-CG1 4.23Å; V199-V372 HydrophobicContact CG2-CG2 4.4Å; F251-V372 HydrophobicContact CD1-CG2 3.97Å; F251-V372 HydrophobicContact CE1-CG2 3.9Å; F368-V372 WeakPolarHBondContact O-CG2 3.22Å; F368-V372 PolarHBondContact O-N 3.23Å; W369-V372 WeakPolarHBondContact O-CB 3.47Å; W369-V372 PolarHBondContact O-N 3.17Å; W369-V372 VanDerWaalsContact O-N 3.1Å; V372-L374 PolarHBondContact O-N 3.37Å; V372-R375 WeakPolarHBondContact O-CA 3.31Å; V372-R375 VanDerWaalsContact O-CB 3.23Å; V372-R375 WeakPolarHBondContact O-CB 3.2Å; V372-R375 PolarHBondContact O-N 3.47Å; V372-E376 PolarHBondContact O-N 3.11Å; V372-E376 VanDerWaalsContact O-N 3.12Å
373	L	86.6	Confident	80.5	Confident	11 Å²	11	40.1 Å²	40.1	6%	0.058	19%	0.185	C	C	.	.	H	α-helix	trans	-60.3	-37.3	174	-67.3	-177.9	0	0	0	111.9	I356 K360 L362 W369 N370 R375 E376 E377	I356-L373 HydrophobicContact CD1-CB 3.87Å; K360-L373 HydrophobicContact CD-CD2 4.21Å; L362-L373 HydrophobicContact CD2-CD1 4.32Å; W369-L373 HydrophobicContact CZ2-CD2 4.04Å; W369-L373 WeakPolarHBondContact O-CG 3.31Å; W369-L373 PolarHBondContact O-N 3.46Å; N370-L373 WeakPolarHBondContact O-CB 3.43Å; N370-L373 PolarHBondContact O-N 2.91Å; L373-R375 VanDerWaalsContact C-N 3.31Å; L373-E376 PolarHBondContact O-N 3.2Å; L373-E377 PolarHBondContact O-N 2.56Å
374	L	88.3	Confident	79.5	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-63.8	-38.1	173.9	-175.7	68.8	0	0	0	111.4	L310 L351 Q355 I356 N370 L371 V372 E376 E377 V378 L381	L310-L374 HydrophobicContact CD1-CD2 4Å; L351-L374 HydrophobicContact CD2-CD2 4.46Å; Q355-L374 HydrophobicContact CB-CD1 3.65Å; Q355-L374 HydrophobicContact CG-CD1 3.96Å; I356-L374 HydrophobicContact CD1-CB 4.33Å; I356-L374 HydrophobicContact CG1-CD1 4.29Å; N370-L374 PolarHBondContact O-N 3.06Å; L371-L374 WeakPolarHBondContact O-CB 3.36Å; L371-L374 PolarHBondContact O-N 3.21Å; V372-L374 PolarHBondContact O-N 3.37Å; L374-E376 VanDerWaalsContact C-N 3.31Å; L374-E376 PolarHBondContact O-N 2.84Å; L374-E377 PolarHBondContact O-N 2.71Å; L374-V378 PolarHBondContact O-N 3.33Å; L374-L381 HydrophobicContact CD1-CD2 3.73Å
375	R	85.1	Confident	78.4	Confident	92 Å²	92	49.9 Å²	49.9	35%	0.347	23%	0.229	S	C	.	.	H	α-helix	trans	-61.2	-38.7	175.2	-170.8	-177	169.8	-172.2	-1.8	112.2	L191 E192 L371 V372 L373 E377 V378	L191-R375 HydrophobicContact CB-CG 4.37Å; L191-R375 HydrophobicContact CD1-CB 3.91Å; L191-R375 HydrophobicContact CD1-CG 4.26Å; E192-R375 IonicContact OE1-CZ 3.6Å; E192-R375 IonicContact OE1-NE 3.29Å; E192-R375 PolarHBondContact OE1-NE 3.07Å; E192-R375 IonicContact OE1-NH2 3.06Å; E192-R375 PolarHBondContact OE1-NH2 3.12Å; L371-R375 PolarHBondContact O-N 3.2Å; V372-R375 WeakPolarHBondContact O-CA 3.31Å; V372-R375 VanDerWaalsContact O-CB 3.23Å; V372-R375 WeakPolarHBondContact O-CB 3.2Å; V372-R375 PolarHBondContact O-N 3.47Å; L373-R375 VanDerWaalsContact C-N 3.31Å; R375-E377 PolarHBondContact O-N 2.86Å; R375-V378 HydrophobicContact CG-CG2 4.47Å; R375-V378 WeakPolarHBondContact O-CB 3.39Å; R375-V378 WeakPolarHBondContact O-CG2 3.12Å; R375-V378 PolarHBondContact O-N 3.04Å
376	E	83.9	Confident	77.2	Confident	108 Å²	108	54 Å²	54	51%	0.505	26%	0.259	S	S	.	.	H	α-helix	trans	-66.5	-27.4	178.2	-65.8	176.2	171.7	0	0	112.7	K360 V372 L373 L374	K360-E376 IonicContact NZ-OE2 3.5Å; K360-E376 PolarHBondContact NZ-OE2 3.24Å; V372-E376 PolarHBondContact O-N 3.11Å; V372-E376 VanDerWaalsContact O-N 3.12Å; L373-E376 PolarHBondContact O-N 3.2Å; L374-E376 VanDerWaalsContact C-N 3.31Å; L374-E376 PolarHBondContact O-N 2.84Å
377	E	80.4	Confident	76	Confident	70 Å²	70	60.4 Å²	60.4	33%	0.327	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	13.5	-179.5	-62.1	-58.7	140.3	0	0	113.3	I356 K360 L373 L374 R375 H379 D380	I356-E377 HydrophobicContact CG1-CG 4.29Å; I356-E377 HydrophobicContact CG2-CG 4.47Å; K360-E377 WeakPolarHBondContact CE-OE1 3.49Å; K360-E377 IonicContact NZ-OE1 3.4Å; K360-E377 PolarHBondContact NZ-OE1 3.49Å; L373-E377 PolarHBondContact O-N 2.56Å; L374-E377 PolarHBondContact O-N 2.71Å; R375-E377 PolarHBondContact O-N 2.86Å; E377-H379 PolarHBondContact O-N 3.26Å; E377-D380 PolarHBondContact O-N 3.49Å; E377-D380 VanDerWaalsContact O-N 3.12Å
378	V	76.6	Confident	74.4	Confident	13 Å²	13	63.4 Å²	63.4	8%	0.079	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-57.5	-22.9	-174.1	164.4	0	0	0	0	114.2	C184 V187 T188 L191 L374 R375 D380 L381	C184-V378 WeakPolarHBondContact CB-O 3.38Å; C184-V378 PolarHBondContact SG-O 3.05Å; V187-V378 HydrophobicContact CG1-CG2 4.22Å; T188-V378 WeakPolarHBondContact OG1-CG1 3.34Å; L191-V378 HydrophobicContact CD1-CG2 4.4Å; L374-V378 PolarHBondContact O-N 3.33Å; R375-V378 HydrophobicContact CG-CG2 4.47Å; R375-V378 WeakPolarHBondContact O-CB 3.39Å; R375-V378 WeakPolarHBondContact O-CG2 3.12Å; R375-V378 PolarHBondContact O-N 3.04Å; V378-D380 PolarHBondContact O-N 3.15Å; V378-L381 HydrophobicContact CB-CD1 4.34Å; V378-L381 HydrophobicContact CG2-CD1 3.99Å
379	H	73.6	Confident	73.1	Confident	182 Å²	182	66.4 Å²	66.4	84%	0.843	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-68.5	-16.9	-179.5	-60	-57.9	0	0	0	114.2	E377	E377-H379 PolarHBondContact O-N 3.26Å
380	D	73.6	Confident	72	Confident	79 Å²	79	64.6 Å²	64.6	42%	0.422	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-141.2	46.5	-172.4	-160.3	-12.3	0	0	0	112.3	E377 V378 R383	E377-D380 PolarHBondContact O-N 3.49Å; E377-D380 VanDerWaalsContact O-N 3.12Å; V378-D380 PolarHBondContact O-N 3.15Å; D380-R383 IonicContact OD1-CZ 2.7Å; D380-R383 IonicContact OD1-NE 3.51Å; D380-R383 PolarHBondContact OD1-NE 2.87Å; D380-R383 IonicContact OD1-NH2 2.85Å; D380-R383 IonicContact OD2-CZ 3.23Å; D380-R383 VanDerWaalsContact OD2-CZ 3.29Å; D380-R383 IonicContact OD2-NE 2.7Å; D380-R383 PolarHBondContact OD2-NE 3.14Å; D380-R383 IonicContact OD2-NH2 2.74Å; D380-R383 PolarHBondContact OD2-NH2 3.35Å
381	L	76.8	Confident	71	Confident	5 Å²	5	68.4 Å²	68.4	3%	0.026	36%	0.357	C	S	.	.			trans	-94.4	153.9	178.5	-60.6	179.7	0	0	0	112.8	V187 L314 Q355 L374 V378	V187-L381 HydrophobicContact CB-CD1 3.86Å; V187-L381 HydrophobicContact CG1-CD1 3.48Å; V187-L381 VanDerWaalsContact CG1-CD1 3.48Å; V187-L381 HydrophobicContact CG2-CD1 4.06Å; L314-L381 HydrophobicContact CD2-CB 3.92Å; Q355-L381 HydrophobicContact CB-CD2 3.73Å; Q355-L381 HydrophobicContact CG-CD2 4.18Å; L374-L381 HydrophobicContact CD1-CD2 3.73Å; V378-L381 HydrophobicContact CB-CD1 4.34Å; V378-L381 HydrophobicContact CG2-CD1 3.99Å
382	G	68.1	Low	69.8	Low	2 Å²	2	73.8 Å²	73.8	2%	0.021	39%	0.386	C	S	.	.			trans	87.9	20.9	173.3	0	0	0	0	0	114.9	R183	R183-G382 PolarHBondContact NH1-O 3.36Å
383	R	66.1	Low	68.7	Low	87 Å²	87	73.8 Å²	73.8	33%	0.328	39%	0.386	S	S	.	.			trans	-60.5	136.2	176.7	-70	-179.7	172.1	179	-10.1	111.6	D380 R385	D380-R383 IonicContact OD1-CZ 2.7Å; D380-R383 IonicContact OD1-NE 3.51Å; D380-R383 PolarHBondContact OD1-NE 2.87Å; D380-R383 IonicContact OD1-NH2 2.85Å; D380-R383 IonicContact OD2-CZ 3.23Å; D380-R383 VanDerWaalsContact OD2-CZ 3.29Å; D380-R383 IonicContact OD2-NE 2.7Å; D380-R383 PolarHBondContact OD2-NE 3.14Å; D380-R383 IonicContact OD2-NH2 2.74Å; D380-R383 PolarHBondContact OD2-NH2 3.35Å; R383-R385 HydrophobicContact CB-CB 4.28Å; R383-R385 HydrophobicContact CB-CG 4.03Å; R383-R385 PolarHBondContact O-N 3.45Å; R383-R385 VanDerWaalsContact O-N 3.08Å
384	P	56.5	Low	67.9	Low	100 Å²	100	77.2 Å²	77.2	65%	0.649	41%	0.408	S	S	*	.			trans	-86.7	52.3	165.2	37.7	-28	0	0	0	106.7	H176	H176-P384 WeakPolarHBondContact CE1-CD 3.48Å; H176-P384 WeakPolarHBondContact CE1-CG 3.22Å; H176-P384 WeakPolarHBondContact NE2-CD 3.48Å; H176-P384 WeakPolarHBondContact NE2-CG 3.46Å
385	R	51.9	Low	67	Low	156 Å²	156	80.2 Å²	80.2	59%	0.589	43%	0.432	S	S	*	.			trans	-76.4	145	172.6	-86.7	-174.1	165.7	-160.5	-7.6	107.7	R383 Y387	R383-R385 HydrophobicContact CB-CB 4.28Å; R383-R385 HydrophobicContact CB-CG 4.03Å; R383-R385 PolarHBondContact O-N 3.45Å; R383-R385 VanDerWaalsContact O-N 3.08Å; R385-Y387 PolarHBondContact O-N 3.47Å; R385-Y387 VanDerWaalsContact O-N 3.14Å
386	S	50.9	Low	66.2	Low	106 Å²	106	77.5 Å²	77.5	74%	0.741	42%	0.424	S	S	*	.			trans	-52	122.5	155	51.8	0	0	0	0	106.9	A388	S386-A388 VanDerWaalsContact C-N 3.28Å; S386-A388 PolarHBondContact O-N 2.7Å
387	Y	54.8	Low	65.6	Low	167 Å²	167	74.9 Å²	74.9	66%	0.655	41%	0.411	S	S	*	.			trans	-52.6	91.9	176.8	-54.3	-88.4	0	0	0	109.3	R385 V389	R385-Y387 PolarHBondContact O-N 3.47Å; R385-Y387 VanDerWaalsContact O-N 3.14Å; Y387-V389 VanDerWaalsContact C-N 3.29Å; Y387-V389 PolarHBondContact O-N 2.76Å
388	A	51.4	Low	65.4	Low	66 Å²	66	74.1 Å²	74.1	55%	0.545	42%	0.417	S	S	.	.			trans	-84.2	89	167.8	0	0	0	0	0	104.4	S386	S386-A388 VanDerWaalsContact C-N 3.28Å; S386-A388 PolarHBondContact O-N 2.7Å
389	V	58.8	Low	65.2	Low	69 Å²	69	77.2 Å²	77.2	42%	0.418	43%	0.43	S	S	.	.			trans	-78.3	123.7	172.5	-173.7	0	0	0	0	106.1	Y387 C393 V394	Y387-V389 VanDerWaalsContact C-N 3.29Å; Y387-V389 PolarHBondContact O-N 2.76Å; V389-C393 HydrophobicContact CG1-CB 3.5Å; V389-V394 HydrophobicContact CB-CG2 4.18Å; V389-V394 HydrophobicContact CG1-CG2 3.63Å
390	S	62.4	Low	65	Low	31 Å²	31	68.6 Å²	68.6	22%	0.217	39%	0.39	C	S	.	.			trans	-59.5	149.9	173.4	69.4	0	0	0	0	110.1	D392 C393 V394	S390-D392 PolarHBondContact O-N 2.78Å; S390-C393 WeakPolarHBondContact O-CB 3.42Å; S390-C393 PolarHBondContact O-N 3.06Å; S390-C393 VanDerWaalsContact O-N 3.15Å; S390-C393 WeakPolarHBondContact OG-CB 3.46Å; S390-C393 PolarHBondContact OG-N 3.21Å; S390-C393 PolarHBondContact OG-SG 3.07Å; S390-V394 PolarHBondContact O-N 2.91Å
391	A	67.1	Low	65.2	Low	80 Å²	80	67.8 Å²	67.8	66%	0.661	39%	0.386	S	S	*	.	H	α-helix	trans	-57.4	-33.6	178.1	0	0	0	0	0	112	V394 A395	A391-V394 PolarHBondContact O-N 2.86Å; A391-A395 PolarHBondContact O-N 3.32Å
392	D	65.3	Low	65.2	Low	114 Å²	114	69.5 Å²	69.5	61%	0.61	40%	0.398	S	S	*	.	H	α-helix	trans	-64.8	-45	177.4	-57.2	-26.4	0	0	0	111.4	S390 V394 A395 E396	S390-D392 PolarHBondContact O-N 2.78Å; D392-V394 VanDerWaalsContact C-N 3.28Å; D392-V394 PolarHBondContact O-N 3.5Å; D392-A395 PolarHBondContact O-N 3.04Å; D392-E396 WeakPolarHBondContact O-CB 3.31Å; D392-E396 PolarHBondContact O-N 2.63Å
393	C	64.5	Low	65.4	Low	11 Å²	11	69.9 Å²	69.9	7%	0.074	40%	0.399	C	S	.	.	H	α-helix	trans	-60.9	-35.9	174.9	-75.4	0	0	0	0	112.4	V389 S390 F397	V389-C393 HydrophobicContact CG1-CB 3.5Å; S390-C393 WeakPolarHBondContact O-CB 3.42Å; S390-C393 PolarHBondContact O-N 3.06Å; S390-C393 VanDerWaalsContact O-N 3.15Å; S390-C393 WeakPolarHBondContact OG-CB 3.46Å; S390-C393 PolarHBondContact OG-N 3.21Å; S390-C393 PolarHBondContact OG-SG 3.07Å; C393-F397 VanDerWaalsContact O-CB 3.26Å; C393-F397 WeakPolarHBondContact O-CB 3.42Å; C393-F397 PolarHBondContact O-N 3.28Å
394	V	69.9	Low	65.9	Low	84 Å²	84	65.8 Å²	65.8	51%	0.509	38%	0.384	S	S	.	.	H	α-helix	trans	-68.5	-42.9	176.1	178.5	0	0	0	0	111.1	V389 S390 A391 D392 F397 A398	V389-V394 HydrophobicContact CB-CG2 4.18Å; V389-V394 HydrophobicContact CG1-CG2 3.63Å; S390-V394 PolarHBondContact O-N 2.91Å; A391-V394 PolarHBondContact O-N 2.86Å; D392-V394 VanDerWaalsContact C-N 3.28Å; D392-V394 PolarHBondContact O-N 3.5Å; V394-F397 PolarHBondContact O-N 3.46Å; V394-A398 WeakPolarHBondContact O-CB 3.35Å; V394-A398 PolarHBondContact O-N 3.42Å
395	A	69.8	Low	66.7	Low	62 Å²	62	66.3 Å²	66.3	51%	0.512	38%	0.381	S	S	.	.	H	α-helix	trans	-63.1	-46.1	177.1	0	0	0	0	0	111.1	A391 D392 F397 A398 E399	A391-A395 PolarHBondContact O-N 3.32Å; D392-A395 PolarHBondContact O-N 3.04Å; A395-F397 PolarHBondContact O-N 3.34Å; A395-A398 PolarHBondContact O-N 3.17Å; A395-E399 PolarHBondContact O-N 3.46Å
396	E	67.5	Low	67.4	Low	35 Å²	35	67.2 Å²	67.2	16%	0.164	39%	0.385	C	S	.	.	H	α-helix	trans	-58.5	-47.6	174.4	-83.5	-171.3	-153.3	0	0	111.7	L362 L364 D392 A398 E399 M400	L362-E396 VanDerWaalsContact O-OE1 3.05Å; L364-E396 HydrophobicContact CD1-CB 3.87Å; L364-E396 HydrophobicContact CD1-CG 4.07Å; L364-E396 VanDerWaalsContact CD1-O 3.22Å; L364-E396 WeakPolarHBondContact CD1-O 3.3Å; L364-E396 HydrophobicContact CD2-CB 3.62Å; L364-E396 HydrophobicContact CD2-CG 4.31Å; L364-E396 HydrophobicContact CG-CB 3.73Å; L364-E396 HydrophobicContact CG-CG 3.9Å; D392-E396 WeakPolarHBondContact O-CB 3.31Å; D392-E396 PolarHBondContact O-N 2.63Å; E396-A398 VanDerWaalsContact C-N 3.34Å; E396-A398 PolarHBondContact O-N 3.16Å; E396-E399 WeakPolarHBondContact O-CB 3.02Å; E396-E399 PolarHBondContact O-N 3.34Å; E396-M400 PolarHBondContact O-N 3.11Å
397	F	72.8	Confident	68.1	Low	53 Å²	53	63.3 Å²	63.3	23%	0.232	36%	0.357	C	S	.	.	H	α-helix	trans	-63.6	-39.2	178.3	-173.3	-103.4	0	0	0	112.6	P319 A346 V350 C393 V394 A395 E399 M400 L401	P319-F397 HydrophobicContact CB-CE2 4.35Å; P319-F397 HydrophobicContact CB-CZ 4.09Å; P319-F397 HydrophobicContact CG-CE2 4.01Å; P319-F397 HydrophobicContact CG-CZ 4.27Å; A346-F397 HydrophobicContact CB-CE2 4.22Å; V350-F397 HydrophobicContact CG2-CD2 3.8Å; V350-F397 HydrophobicContact CG2-CE2 3.66Å; C393-F397 VanDerWaalsContact O-CB 3.26Å; C393-F397 WeakPolarHBondContact O-CB 3.42Å; C393-F397 PolarHBondContact O-N 3.28Å; V394-F397 PolarHBondContact O-N 3.46Å; A395-F397 PolarHBondContact O-N 3.34Å; F397-E399 VanDerWaalsContact C-N 3.35Å; F397-M400 WeakPolarHBondContact O-CB 3.14Å; F397-M400 PolarHBondContact O-N 2.87Å; F397-L401 HydrophobicContact CD1-CD1 3.91Å; F397-L401 HydrophobicContact CD1-CG 4.23Å; F397-L401 HydrophobicContact CE1-CD1 3.51Å; F397-L401 HydrophobicContact CE1-CD2 4.3Å; F397-L401 HydrophobicContact CE1-CG 3.85Å; F397-L401 HydrophobicContact CZ-CD1 4.26Å; F397-L401 HydrophobicContact CZ-CD2 4.25Å; F397-L401 HydrophobicContact CZ-CG 4.18Å; F397-L401 PolarHBondContact O-N 3.13Å
398	A	75.8	Confident	68.7	Low	55 Å²	55	59.5 Å²	59.5	46%	0.455	35%	0.346	S	S	.	.	H	α-helix	trans	-64.5	-39.3	175.6	0	0	0	0	0	112	V394 A395 E396 M400 L401 S402	V394-A398 WeakPolarHBondContact O-CB 3.35Å; V394-A398 PolarHBondContact O-N 3.42Å; A395-A398 PolarHBondContact O-N 3.17Å; E396-A398 VanDerWaalsContact C-N 3.34Å; E396-A398 PolarHBondContact O-N 3.16Å; A398-M400 VanDerWaalsContact C-N 3.3Å; A398-M400 PolarHBondContact O-N 3.06Å; A398-L401 PolarHBondContact O-N 3.05Å; A398-S402 PolarHBondContact O-N 3.1Å
399	E	70.8	Confident	68.8	Low	78 Å²	78	63.3 Å²	63.3	36%	0.364	35%	0.35	S	S	.	.	H	α-helix	trans	-60.5	-42.8	172.5	-177.1	171.4	-163.1	0	0	111.1	L364 A395 E396 F397 S402 L403	L364-E399 HydrophobicContact CD1-CB 4.25Å; L364-E399 HydrophobicContact CD1-CG 4.42Å; A395-E399 PolarHBondContact O-N 3.46Å; E396-E399 WeakPolarHBondContact O-CB 3.02Å; E396-E399 PolarHBondContact O-N 3.34Å; F397-E399 VanDerWaalsContact C-N 3.35Å; E399-S402 VanDerWaalsContact O-CB 3.3Å; E399-S402 WeakPolarHBondContact O-CB 3.31Å; E399-S402 PolarHBondContact O-N 3.4Å; E399-S402 VanDerWaalsContact O-N 3.16Å; E399-L403 WeakPolarHBondContact O-CG 3.31Å; E399-L403 PolarHBondContact O-N 3.43Å
400	M	71.4	Confident	67.7	Low	1 Å²	1	66.3 Å²	66.3	1%	0.005	37%	0.371	C	S	.	.	H	α-helix	trans	-65.4	-41.6	176.8	-104.3	-82.5	-80.2	0	0	114.2	L342 N345 A346 L364 E396 F397 A398 S402 L403 I404	L342-M400 HydrophobicContact CB-SD 4.03Å; L342-M400 HydrophobicContact CD2-SD 3.68Å; L342-M400 HydrophobicContact CG-SD 4.45Å; L342-M400 WeakPolarHBondContact O-CE 3.45Å; N345-M400 HydrophobicContact CB-CE 3.99Å; A346-M400 HydrophobicContact CB-CE 3.05Å; L364-M400 HydrophobicContact CB-CG 4.32Å; L364-M400 HydrophobicContact CD1-CG 3.95Å; L364-M400 HydrophobicContact CD2-CB 4.3Å; L364-M400 HydrophobicContact CD2-CG 3.67Å; L364-M400 HydrophobicContact CG-CG 4.19Å; E396-M400 PolarHBondContact O-N 3.11Å; F397-M400 WeakPolarHBondContact O-CB 3.14Å; F397-M400 PolarHBondContact O-N 2.87Å; A398-M400 VanDerWaalsContact C-N 3.3Å; A398-M400 PolarHBondContact O-N 3.06Å; M400-S402 PolarHBondContact O-N 3.37Å; M400-L403 PolarHBondContact O-N 3.09Å; M400-L403 VanDerWaalsContact O-N 3.1Å; M400-I404 HydrophobicContact CE-CD1 4.26Å; M400-I404 WeakPolarHBondContact O-CG1 2.86Å; M400-I404 PolarHBondContact O-N 2.72Å; M400-I404 HydrophobicContact SD-CD1 4.5Å
401	L	77.8	Confident	66.7	Low	62 Å²	62	69.8 Å²	69.8	33%	0.325	40%	0.395	S	S	.	.	H	α-helix	trans	-60.3	-37.4	171.3	-74.3	176.6	0	0	0	111.9	F320 F397 A398 L403 N405	F320-L401 HydrophobicContact CZ-CD2 3.71Å; F397-L401 HydrophobicContact CD1-CD1 3.91Å; F397-L401 HydrophobicContact CD1-CG 4.23Å; F397-L401 HydrophobicContact CE1-CD1 3.51Å; F397-L401 HydrophobicContact CE1-CD2 4.3Å; F397-L401 HydrophobicContact CE1-CG 3.85Å; F397-L401 HydrophobicContact CZ-CD1 4.26Å; F397-L401 HydrophobicContact CZ-CD2 4.25Å; F397-L401 HydrophobicContact CZ-CG 4.18Å; F397-L401 PolarHBondContact O-N 3.13Å; A398-L401 PolarHBondContact O-N 3.05Å; L401-L403 VanDerWaalsContact C-N 3.34Å; L401-N405 VanDerWaalsContact O-CB 3.3Å; L401-N405 WeakPolarHBondContact O-CB 3.41Å; L401-N405 VanDerWaalsContact O-CG 3.22Å; L401-N405 PolarHBondContact O-N 2.84Å; L401-N405 PolarHBondContact O-ND2 2.78Å
402	S	75.9	Confident	65.5	Low	41 Å²	41	71.5 Å²	71.5	29%	0.287	40%	0.399	S	S	.	.	H	α-helix	trans	-63.1	-40.2	173.2	179.1	0	0	0	0	111.8	A398 E399 M400 W406	A398-S402 PolarHBondContact O-N 3.1Å; E399-S402 VanDerWaalsContact O-CB 3.3Å; E399-S402 WeakPolarHBondContact O-CB 3.31Å; E399-S402 PolarHBondContact O-N 3.4Å; E399-S402 VanDerWaalsContact O-N 3.16Å; M400-S402 PolarHBondContact O-N 3.37Å; S402-W406 WeakPolarHBondContact O-CB 3.11Å; S402-W406 VanDerWaalsContact O-CD1 3.25Å; S402-W406 PolarHBondContact O-N 2.84Å
403	L	72.4	Confident	64.1	Low	9 Å²	9	73.6 Å²	73.6	5%	0.047	41%	0.41	C	S	.	.	H	α-helix	trans	-69.5	-44.2	178.5	-69.7	170.6	0	0	0	111.8	Y237 L342 E399 M400 L401 W406 C407	Y237-L403 HydrophobicContact CD1-CD2 4.43Å; Y237-L403 HydrophobicContact CD2-CD1 4.43Å; Y237-L403 HydrophobicContact CD2-CD2 3.87Å; Y237-L403 HydrophobicContact CG-CD2 3.74Å; L342-L403 HydrophobicContact CD1-CB 3.97Å; L342-L403 HydrophobicContact CD2-CB 4.26Å; L342-L403 HydrophobicContact CD2-CD1 4.26Å; E399-L403 WeakPolarHBondContact O-CG 3.31Å; E399-L403 PolarHBondContact O-N 3.43Å; M400-L403 PolarHBondContact O-N 3.09Å; M400-L403 VanDerWaalsContact O-N 3.1Å; L401-L403 VanDerWaalsContact C-N 3.34Å; L403-W406 VanDerWaalsContact O-CB 3.31Å; L403-W406 WeakPolarHBondContact O-CB 3.44Å; L403-W406 PolarHBondContact O-N 3.44Å; L403-W406 VanDerWaalsContact O-N 3.11Å; L403-C407 PolarHBondContact O-N 3.31Å
404	I	75.7	Confident	62.8	Low	2 Å²	2	81 Å²	81	1%	0.01	44%	0.443	C	S	.	.	H	α-helix	trans	-61.2	-48.3	177.3	-67.5	168.1	0	0	0	110.5	F320 L342 K343 M400 W406 C407 E408	F320-I404 HydrophobicContact CD2-CD1 4.2Å; F320-I404 HydrophobicContact CE1-CD1 4.22Å; F320-I404 HydrophobicContact CE2-CD1 3.46Å; F320-I404 VanDerWaalsContact CE2-CD1 3.46Å; F320-I404 HydrophobicContact CZ-CD1 3.48Å; F320-I404 VanDerWaalsContact CZ-CD1 3.48Å; L342-I404 HydrophobicContact CB-CD1 4.46Å; L342-I404 HydrophobicContact CB-CG1 3.75Å; L342-I404 HydrophobicContact CD1-CG1 4.47Å; K343-I404 HydrophobicContact CG-CD1 4.11Å; M400-I404 HydrophobicContact CE-CD1 4.26Å; M400-I404 WeakPolarHBondContact O-CG1 2.86Å; M400-I404 PolarHBondContact O-N 2.72Å; M400-I404 HydrophobicContact SD-CD1 4.5Å; I404-W406 PolarHBondContact O-N 2.86Å; I404-C407 PolarHBondContact O-N 2.84Å; I404-E408 HydrophobicContact CG2-CG 4.25Å; I404-E408 PolarHBondContact O-N 2.88Å
405	N	74.7	Confident	61	Low	110 Å²	110	85.8 Å²	85.8	59%	0.588	47%	0.465	S	S	*	.	H	α-helix	trans	-62.1	-25.1	176.8	-74.8	-17.5	0	0	0	113	L401	L401-N405 VanDerWaalsContact O-CB 3.3Å; L401-N405 WeakPolarHBondContact O-CB 3.41Å; L401-N405 VanDerWaalsContact O-CG 3.22Å; L401-N405 PolarHBondContact O-N 2.84Å; L401-N405 PolarHBondContact O-ND2 2.78Å
406	W	65	Low	59.3	Low	175 Å²	175	86.2 Å²	86.2	66%	0.663	48%	0.476	S	S	*	.	H	α-helix	trans	-74.9	-38.6	173.8	-103.9	79.1	0	0	0	112.3	S402 L403 I404	S402-W406 WeakPolarHBondContact O-CB 3.11Å; S402-W406 VanDerWaalsContact O-CD1 3.25Å; S402-W406 PolarHBondContact O-N 2.84Å; L403-W406 VanDerWaalsContact O-CB 3.31Å; L403-W406 WeakPolarHBondContact O-CB 3.44Å; L403-W406 PolarHBondContact O-N 3.44Å; L403-W406 VanDerWaalsContact O-N 3.11Å; I404-W406 PolarHBondContact O-N 2.86Å
407	C	65.6	Low	57.8	Low	24 Å²	24	92 Å²	92	16%	0.162	50%	0.503	C	S	.	.	H	α-helix	trans	-76.6	-35.8	177.8	-68.7	0	0	0	0	112.5	T339 L342 L403 I404 K409	T339-C407 WeakPolarHBondContact OG1-CB 3.39Å; L342-C407 HydrophobicContact CD1-CB 4.45Å; L403-C407 PolarHBondContact O-N 3.31Å; I404-C407 PolarHBondContact O-N 2.84Å; C407-K409 VanDerWaalsContact C-N 3.29Å; C407-K409 PolarHBondContact O-N 3.05Å
408	E	67.5	Low	55.8	Low	87 Å²	87	95 Å²	95	41%	0.407	53%	0.526	S	S	.	.			trans	-70.4	82.6	173.4	-72.4	-170.6	170.5	0	0	110.5	T339 K343 I404	T339-E408 HydrophobicContact CG2-CG 3.76Å; K343-E408 WeakPolarHBondContact CE-OE1 3.32Å; K343-E408 IonicContact NZ-OE1 3.05Å; K343-E408 PolarHBondContact NZ-OE1 3.5Å; I404-E408 HydrophobicContact CG2-CG 4.25Å; I404-E408 PolarHBondContact O-N 2.88Å
409	K	53.5	Low	54	Low	147 Å²	147	100.7 Å²	100.7	64%	0.639	55%	0.548	S	S	*	.			trans	-62.1	138.6	155.9	-70.5	176.3	-171.1	153.9	0	107.5	D335 C407 S411	D335-K409 IonicContact OD2-NZ 2.93Å; C407-K409 VanDerWaalsContact C-N 3.29Å; C407-K409 PolarHBondContact O-N 3.05Å; K409-S411 PolarHBondContact O-N 3.13Å
410	P	36.7	Very low	52.3	Low	132 Å²	132	101.8 Å²	101.8	86%	0.857	56%	0.56	S	S	*	*			trans	-61.2	101.1	176.7	24.1	-31.8	0	0	0	108.8	P412	P410-P412 WeakPolarHBondContact O-CD 3.13Å
411	S	42	Very low	50.7	Low	103 Å²	103	108.1 Å²	108.1	72%	0.72	59%	0.594	S	S	*	*			trans	-78.6	114.5	169.5	-175	0	0	0	0	107.3	K409 L413	K409-S411 PolarHBondContact O-N 3.13Å; S411-L413 PolarHBondContact O-N 3.38Å; S411-L413 VanDerWaalsContact O-N 3.11Å
412	P	40	Very low	48.9	Very low	116 Å²	116	109.6 Å²	109.6	75%	0.753	60%	0.602	S	S	*	*	S	Bend	trans	-84.7	82.2	177.9	31.8	-25.8	0	0	0	107.6	P410	P410-P412 WeakPolarHBondContact O-CD 3.13Å
413	L	36.2	Very low	47.3	Very low	159 Å²	159	115.1 Å²	115.1	83%	0.832	62%	0.617	S	S	*	*			trans	169.3	79.8	161.5	-92.1	155.3	0	0	0	111.2	S411	S411-L413 PolarHBondContact O-N 3.38Å; S411-L413 VanDerWaalsContact O-N 3.11Å
414	E	38.4	Very low	45.5	Very low	167 Å²	167	123.4 Å²	123.4	78%	0.78	66%	0.655	S	S	*	*			trans	-142.4	71.4	154.4	-74.2	-157.9	164.1	0	0	109.8
415	L	31.2	Very low	43.6	Very low	183 Å²	183	127.1 Å²	127.1	96%	0.958	68%	0.681	S	S	*	*	S	Bend	trans	-117.7	88.8	163	-152.5	92.7	0	0	0	106.1
416	G	35.1	Very low	41.7	Very low	72 Å²	72	126.1 Å²	126.1	74%	0.742	68%	0.679	S	S	*	*			trans	138.9	19.4	163.8	0	0	0	0	0	120.1	T418	G416-T418 PolarHBondContact O-N 3.11Å
417	Q	35.4	Very low	40.5	Very low	156 Å²	156	120.7 Å²	120.7	73%	0.729	67%	0.668	S	S	*	*			trans	-84.3	108.7	164.6	-75.9	-174.1	-8	0	0	109.5
418	T	31.1	Very low	39.1	Very low	117 Å²	117	129.2 Å²	129.2	72%	0.718	71%	0.705	S	S	*	*			trans	-65.1	136.6	174.5	43.5	0	0	0	0	110.6	G416 V420	G416-T418 PolarHBondContact O-N 3.11Å; T418-V420 PolarHBondContact O-N 3.16Å
419	D	37.8	Very low	37.5	Very low	174 Å²	174	129.7 Å²	129.7	93%	0.93	72%	0.719	S	S	*	*			trans	-53.2	74.1	166.3	-84.1	-35.1	0	0	0	111.4
420	V	35.4	Very low	36.5	Very low	101 Å²	101	127.6 Å²	127.6	61%	0.612	71%	0.714	S	S	*	*			trans	-96	123.8	164.6	-178.8	0	0	0	0	105.9	T418 D422	T418-V420 PolarHBondContact O-N 3.16Å; V420-D422 PolarHBondContact O-N 3.08Å
421	D	37.4	Very low	36.3	Very low	133 Å²	133	125.8 Å²	125.8	71%	0.711	70%	0.702	S	S	*	*			trans	-58.4	82.8	176.3	-72.5	-55.5	0	0	0	110.8	W423	D421-W423 PolarHBondContact O-N 2.95Å
422	D	38.9	Very low	35.6	Very low	93 Å²	93	127.8 Å²	127.8	50%	0.497	71%	0.71	S	S	.	*	G	3₁₀ helix	trans	-65.9	10.9	175.4	-94.3	-6.5	0	0	0	113.4	V420 E424 S425	V420-D422 PolarHBondContact O-N 3.08Å; D422-E424 PolarHBondContact O-N 3.07Å; D422-S425 PolarHBondContact O-OG 3.32Å
423	W	43.6	Very low	35.2	Very low	158 Å²	158	132.3 Å²	132.3	60%	0.598	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-65.8	-19.3	174.8	-69.2	92.2	0	0	0	113.2	Q305 D421	Q305-W423 HydrophobicContact CG-CZ3 4.39Å; D421-W423 PolarHBondContact O-N 2.95Å
424	E	34.7	Very low	34.9	Very low	182 Å²	182	132.4 Å²	132.4	85%	0.85	71%	0.713	S	S	*	*	G	3₁₀ helix	trans	-105	-7	-176.6	-67.7	-167	159.3	0	0	115.3	D422 V426	D422-E424 PolarHBondContact O-N 3.07Å; E424-V426 PolarHBondContact O-N 2.82Å; E424-V426 VanDerWaalsContact O-N 3.11Å
425	S	35.9	Very low	34.4	Very low	80 Å²	80	131.4 Å²	131.4	56%	0.559	72%	0.719	S	S	*	*			trans	-82.4	95.5	-178.1	61	0	0	0	0	111.7	D422	D422-S425 PolarHBondContact O-OG 3.32Å
426	V	35.1	Very low	34.3	Very low	89 Å²	89	125.9 Å²	125.9	54%	0.539	71%	0.706	S	S	.	*			trans	-83.1	125.1	163.4	-180	0	0	0	0	108.2	E424 E428	E424-V426 PolarHBondContact O-N 2.82Å; E424-V426 VanDerWaalsContact O-N 3.11Å; V426-E428 PolarHBondContact O-N 2.95Å
427	S	39.2	Very low	34	Very low	61 Å²	61	129.7 Å²	129.7	43%	0.427	71%	0.709	S	S	.	*			trans	-53.4	120.6	177.5	-49.5	0	0	0	0	111.3	E330 S429	E330-S427 PolarHBondContact OE2-OG 3.29Å; S427-S429 PolarHBondContact O-N 3.33Å
428	E	36	Very low	33.9	Very low	203 Å²	203	131.7 Å²	131.7	95%	0.949	72%	0.716	S	S	*	*	S	Bend	trans	-71.5	-10.2	-178.5	-72.1	-173.5	159.5	0	0	113.9	V426 L430	V426-E428 PolarHBondContact O-N 2.95Å; E428-L430 PolarHBondContact O-N 3.47Å
429	S	34.3	Very low	33.8	Very low	98 Å²	98	129.5 Å²	129.5	69%	0.685	72%	0.716	S	S	*	*			trans	-99.4	63.8	-178.3	61.9	0	0	0	0	112.9	S427	S427-S429 PolarHBondContact O-N 3.33Å
430	L	32.8	Very low	33.8	Very low	103 Å²	103	126.1 Å²	126.1	54%	0.539	70%	0.702	S	S	.	*			trans	-91.7	121.2	170.6	-80.7	159.8	0	0	0	110.4	E428 T432	E428-L430 PolarHBondContact O-N 3.47Å; L430-T432 PolarHBondContact O-N 3.26Å
431	P	31.4	Very low	33.7	Very low	93 Å²	93	126.5 Å²	126.5	60%	0.604	71%	0.705	S	S	*	*			trans	-63.4	131.1	174.9	-16.6	28.4	0	0	0	110.9	W433	P431-W433 VanDerWaalsContact O-CD1 3.26Å; P431-W433 PolarHBondContact O-N 3.22Å; P431-W433 VanDerWaalsContact O-N 3.13Å
432	T	27.6	Very low	33.4	Very low	145 Å²	145	126.7 Å²	126.7	89%	0.89	71%	0.705	S	S	*	*			trans	-78	93.6	177.4	44.8	0	0	0	0	110.1	L430	L430-T432 PolarHBondContact O-N 3.26Å
433	W	31.3	Very low	33.2	Very low	211 Å²	211	124.5 Å²	124.5	80%	0.799	69%	0.693	S	S	*	*			trans	-83.4	123	179	-74.9	85.5	0	0	0	112.1	P431 V435	P431-W433 VanDerWaalsContact O-CD1 3.26Å; P431-W433 PolarHBondContact O-N 3.22Å; P431-W433 VanDerWaalsContact O-N 3.13Å; W433-V435 PolarHBondContact O-N 3.38Å
434	N	29.6	Very low	32.7	Very low	161 Å²	161	121.9 Å²	121.9	86%	0.861	69%	0.69	S	S	*	*			trans	-76.1	111.5	177.2	-107.3	-31.1	0	0	0	111.4	G436	N434-G436 PolarHBondContact O-N 3.34Å
435	V	29.2	Very low	32.5	Very low	147 Å²	147	116.9 Å²	116.9	89%	0.891	67%	0.669	S	S	*	*			trans	1.3	99.6	157.1	-165.6	0	0	0	0	116.5	W433	W433-V435 PolarHBondContact O-N 3.38Å
436	G	29.5	Very low	32.6	Very low	67 Å²	67	116.6 Å²	116.6	69%	0.691	67%	0.667	S	S	*	*			trans	-167	88.4	165.3	0	0	0	0	0	111	N434	N434-G436 PolarHBondContact O-N 3.34Å
437	N	28.6	Very low	32.7	Very low	151 Å²	151	114 Å²	114	81%	0.807	65%	0.654	S	S	*	*	S	Bend	trans	71.4	114	170.4	-70.2	-12.5	0	0	0	119.1
438	F	31.8	Very low	32.7	Very low	199 Å²	199	114.3 Å²	114.3	87%	0.873	65%	0.654	S	S	*	*			trans	64.9	95	165.2	-65.4	-80.4	0	0	0	117.3
439	G	30.7	Very low	32.9	Very low	71 Å²	71	108.1 Å²	108.1	73%	0.732	63%	0.633	S	S	*	*			trans	-74.6	124.9	-175.9	0	0	0	0	0	113.8
440	V	36.2	Very low	33.1	Very low	103 Å²	103	106.4 Å²	106.4	62%	0.624	62%	0.621	S	S	*	*			trans	-116.7	-10.1	171.2	-178.3	0	0	0	0	111.5	N442 I443	V440-N442 PolarHBondContact O-N 2.87Å; V440-I443 HydrophobicContact CG1-CD1 4.44Å; V440-I443 PolarHBondContact O-N 2.84Å
441	T	33.9	Very low	33.5	Very low	109 Å²	109	102.2 Å²	102.2	67%	0.669	60%	0.6	S	S	*	*	H	α-helix	trans	-81.8	-8.3	-178.2	46	0	0	0	0	115.4	I443	T441-I443 VanDerWaalsContact C-N 3.34Å
442	N	30.2	Very low	34	Very low	136 Å²	136	100.5 Å²	100.5	73%	0.727	59%	0.593	S	S	*	*	H	α-helix	trans	-83.9	-9.6	170.7	-83.5	-10.1	0	0	0	113.5	V440 S446	V440-N442 PolarHBondContact O-N 2.87Å; N442-S446 WeakPolarHBondContact O-CB 3.33Å; N442-S446 PolarHBondContact O-N 3.44Å
443	I	35.6	Very low	34.5	Very low	47 Å²	47	101 Å²	101	24%	0.241	58%	0.584	C	S	.	*	H	α-helix	trans	-80.6	-47	-170.4	-67.7	176.5	0	0	0	111.7	D255 V440 T441 N445 S446 A447	D255-I443 HydrophobicContact CB-CD1 4.27Å; D255-I443 HydrophobicContact CB-CG2 4.33Å; D255-I443 WeakPolarHBondContact OD2-CG2 3.37Å; V440-I443 HydrophobicContact CG1-CD1 4.44Å; V440-I443 PolarHBondContact O-N 2.84Å; T441-I443 VanDerWaalsContact C-N 3.34Å; I443-N445 PolarHBondContact O-N 3.21Å; I443-S446 PolarHBondContact O-N 3.3Å; I443-A447 WeakPolarHBondContact O-CB 3.26Å; I443-A447 PolarHBondContact O-N 2.99Å
444	I	33	Very low	34.9	Very low	103 Å²	103	95.7 Å²	95.7	53%	0.528	57%	0.57	S	S	.	*	H	α-helix	trans	-64.9	-43.6	-178.2	-60.5	174.4	0	0	0	110.4	S446 A447 T448	I444-S446 PolarHBondContact O-N 3.16Å; I444-A447 PolarHBondContact O-N 3.28Å; I444-T448 HydrophobicContact CG2-CG2 4.39Å; I444-T448 WeakPolarHBondContact O-CG2 3.32Å; I444-T448 PolarHBondContact O-N 3.34Å; I444-T448 PolarHBondContact O-OG1 2.85Å
445	N	31.1	Very low	35.3	Very low	78 Å²	78	91.4 Å²	91.4	42%	0.417	55%	0.547	S	S	.	.	H	α-helix	trans	-68.4	-31.6	176.8	-71.5	-21.3	0	0	0	113.2	I443 S449	I443-N445 PolarHBondContact O-N 3.21Å; N445-S449 WeakPolarHBondContact O-CB 3.33Å; N445-S449 PolarHBondContact O-N 3.15Å; N445-S449 VanDerWaalsContact O-N 3.13Å
446	S	37.2	Very low	35.7	Very low	74 Å²	74	92.2 Å²	92.2	52%	0.517	54%	0.539	S	S	.	.	H	α-helix	trans	-71	-42.2	176.3	179.2	0	0	0	0	111.6	N442 I443 I444 S450	N442-S446 WeakPolarHBondContact O-CB 3.33Å; N442-S446 PolarHBondContact O-N 3.44Å; I443-S446 PolarHBondContact O-N 3.3Å; I444-S446 PolarHBondContact O-N 3.16Å; S446-S450 VanDerWaalsContact O-CB 3.25Å; S446-S450 WeakPolarHBondContact O-CB 3.36Å; S446-S450 PolarHBondContact O-N 3.3Å; S446-S450 PolarHBondContact O-OG 2.97Å
447	A	38.1	Very low	36.2	Very low	33 Å²	33	91.7 Å²	91.7	27%	0.273	53%	0.528	S	S	.	.	H	α-helix	trans	-72.7	-44.8	-179.3	0	0	0	0	0	111.9	I443 I444 S449 S450 V451	I443-A447 WeakPolarHBondContact O-CB 3.26Å; I443-A447 PolarHBondContact O-N 2.99Å; I444-A447 PolarHBondContact O-N 3.28Å; A447-S449 PolarHBondContact O-N 3.32Å; A447-S450 PolarHBondContact O-N 3.37Å; A447-V451 VanDerWaalsContact O-CG2 3.3Å; A447-V451 WeakPolarHBondContact O-CG2 3.45Å; A447-V451 PolarHBondContact O-N 3.28Å
448	T	39.6	Very low	36.7	Very low	68 Å²	68	89.6 Å²	89.6	42%	0.417	51%	0.514	S	S	.	.	H	α-helix	trans	-65.9	-38.8	177.1	56.2	0	0	0	0	111.9	I444 V451 A452	I444-T448 HydrophobicContact CG2-CG2 4.39Å; I444-T448 WeakPolarHBondContact O-CG2 3.32Å; I444-T448 PolarHBondContact O-N 3.34Å; I444-T448 PolarHBondContact O-OG1 2.85Å; T448-V451 PolarHBondContact O-N 3.36Å; T448-A452 VanDerWaalsContact O-CB 3.27Å; T448-A452 WeakPolarHBondContact O-CB 3.4Å; T448-A452 PolarHBondContact O-N 3.41Å
449	S	40.3	Very low	36.9	Very low	73 Å²	73	88.1 Å²	88.1	51%	0.51	51%	0.51	S	S	.	.	H	α-helix	trans	-66.6	-39.3	174	-171.7	0	0	0	0	112.2	N445 A447 A452 F453	N445-S449 WeakPolarHBondContact O-CB 3.33Å; N445-S449 PolarHBondContact O-N 3.15Å; N445-S449 VanDerWaalsContact O-N 3.13Å; A447-S449 PolarHBondContact O-N 3.32Å; S449-A452 PolarHBondContact O-N 3.44Å; S449-F453 VanDerWaalsContact O-CB 3.29Å; S449-F453 WeakPolarHBondContact O-CB 3.45Å; S449-F453 PolarHBondContact O-N 2.9Å
450	S	38.4	Very low	37.1	Very low	62 Å²	62	94.7 Å²	94.7	43%	0.434	53%	0.527	S	S	.	.	H	α-helix	trans	-67	-39.2	176.9	-61.3	0	0	0	0	112.2	S446 A447 F453 L454	S446-S450 VanDerWaalsContact O-CB 3.25Å; S446-S450 WeakPolarHBondContact O-CB 3.36Å; S446-S450 PolarHBondContact O-N 3.3Å; S446-S450 PolarHBondContact O-OG 2.97Å; A447-S450 PolarHBondContact O-N 3.37Å; S450-F453 PolarHBondContact O-N 3.42Å; S450-L454 WeakPolarHBondContact O-CB 3.48Å; S450-L454 WeakPolarHBondContact O-CG 3.42Å; S450-L454 PolarHBondContact O-N 3.09Å
451	V	41.1	Very low	37.1	Very low	16 Å²	16	94.3 Å²	94.3	10%	0.097	52%	0.523	C	S	.	.	H	α-helix	trans	-70.5	-41.6	175.5	175.5	0	0	0	0	111.1	A447 T448 F453 L454 L455	A447-V451 VanDerWaalsContact O-CG2 3.3Å; A447-V451 WeakPolarHBondContact O-CG2 3.45Å; A447-V451 PolarHBondContact O-N 3.28Å; T448-V451 PolarHBondContact O-N 3.36Å; V451-F453 VanDerWaalsContact C-N 3.29Å; V451-F453 PolarHBondContact O-N 3.47Å; V451-L454 PolarHBondContact O-N 3.39Å; V451-L455 HydrophobicContact CG1-CD1 3.88Å; V451-L455 HydrophobicContact CG1-CG 4.28Å; V451-L455 WeakPolarHBondContact O-CB 3.49Å; V451-L455 VanDerWaalsContact O-CG 3.31Å; V451-L455 WeakPolarHBondContact O-CG 2.88Å; V451-L455 PolarHBondContact O-N 3.05Å
452	A	40.6	Very low	37.3	Very low	56 Å²	56	93.5 Å²	93.5	46%	0.463	52%	0.515	S	S	.	.	H	α-helix	trans	-61.3	-38.6	172.5	0	0	0	0	0	111.6	T448 S449 L455 K456	T448-A452 VanDerWaalsContact O-CB 3.27Å; T448-A452 WeakPolarHBondContact O-CB 3.4Å; T448-A452 PolarHBondContact O-N 3.41Å; S449-A452 PolarHBondContact O-N 3.44Å; A452-L455 PolarHBondContact O-N 3.13Å; A452-K456 VanDerWaalsContact O-CB 3.23Å; A452-K456 WeakPolarHBondContact O-CB 3.48Å; A452-K456 PolarHBondContact O-N 3.41Å
453	F	37.8	Very low	37.7	Very low	156 Å²	156	91.2 Å²	91.2	68%	0.684	50%	0.503	S	S	*	.	H	α-helix	trans	-68	-40	175.9	-152.1	-85.8	0	0	0	112	S449 S450 V451 K456 A457	S449-F453 VanDerWaalsContact O-CB 3.29Å; S449-F453 WeakPolarHBondContact O-CB 3.45Å; S449-F453 PolarHBondContact O-N 2.9Å; S450-F453 PolarHBondContact O-N 3.42Å; V451-F453 VanDerWaalsContact C-N 3.29Å; V451-F453 PolarHBondContact O-N 3.47Å; F453-K456 PolarHBondContact O-N 3.24Å; F453-A457 WeakPolarHBondContact O-CB 3.46Å; F453-A457 PolarHBondContact O-N 2.68Å
454	L	39.6	Very low	37.8	Very low	99 Å²	99	93.8 Å²	93.8	52%	0.518	52%	0.519	S	S	.	.	H	α-helix	trans	-66.4	-41.7	174.6	-76.2	164.6	0	0	0	111.9	S450 V451 A457 M458	S450-L454 WeakPolarHBondContact O-CB 3.48Å; S450-L454 WeakPolarHBondContact O-CG 3.42Å; S450-L454 PolarHBondContact O-N 3.09Å; V451-L454 PolarHBondContact O-N 3.39Å; L454-A457 CarbonylContact O-C 3.57Å; L454-A457 WeakPolarHBondContact O-CB 2.92Å; L454-A457 PolarHBondContact O-N 3.35Å; L454-M458 WeakPolarHBondContact O-CG 3.48Å; L454-M458 PolarHBondContact O-N 2.96Å
455	L	39	Very low	38.1	Very low	72 Å²	72	93.2 Å²	93.2	38%	0.377	52%	0.518	S	S	.	.	H	α-helix	trans	-67.7	-37.6	175.9	-71.3	171.5	0	0	0	111.9	V451 A452 A457 M458 H459	V451-L455 HydrophobicContact CG1-CD1 3.88Å; V451-L455 HydrophobicContact CG1-CG 4.28Å; V451-L455 WeakPolarHBondContact O-CB 3.49Å; V451-L455 VanDerWaalsContact O-CG 3.31Å; V451-L455 WeakPolarHBondContact O-CG 2.88Å; V451-L455 PolarHBondContact O-N 3.05Å; A452-L455 PolarHBondContact O-N 3.13Å; L455-A457 VanDerWaalsContact C-N 3.29Å; L455-A457 PolarHBondContact O-N 3.38Å; L455-M458 HydrophobicContact CD2-SD 4.08Å; L455-M458 WeakPolarHBondContact O-CA 3.48Å; L455-M458 WeakPolarHBondContact O-CB 3.18Å; L455-M458 PolarHBondContact O-N 2.59Å; L455-H459 PolarHBondContact O-N 3.06Å
456	K	38.4	Very low	38.6	Very low	163 Å²	163	94.2 Å²	94.2	71%	0.709	53%	0.525	S	S	*	.	H	α-helix	trans	-67.3	-31.9	173.5	-155.5	167.4	-167.3	165.9	0	111.9	A452 F453 M458 H459	A452-K456 VanDerWaalsContact O-CB 3.23Å; A452-K456 WeakPolarHBondContact O-CB 3.48Å; A452-K456 PolarHBondContact O-N 3.41Å; F453-K456 PolarHBondContact O-N 3.24Å; K456-M458 VanDerWaalsContact C-N 3.28Å; K456-H459 PolarHBondContact O-N 3.25Å
457	A	38.3	Very low	38.7	Very low	57 Å²	57	95.6 Å²	95.6	47%	0.471	53%	0.525	S	S	.	.	H	α-helix	trans	-72.9	-17	170.1	0	0	0	0	0	113.5	F453 L454 L455	F453-A457 WeakPolarHBondContact O-CB 3.46Å; F453-A457 PolarHBondContact O-N 2.68Å; L454-A457 CarbonylContact O-C 3.57Å; L454-A457 WeakPolarHBondContact O-CB 2.92Å; L454-A457 PolarHBondContact O-N 3.35Å; L455-A457 VanDerWaalsContact C-N 3.29Å; L455-A457 PolarHBondContact O-N 3.38Å
458	M	39.4	Very low	38.8	Very low	106 Å²	106	100.5 Å²	100.5	52%	0.522	55%	0.545	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-8.8	172.3	-69.2	175.8	65.6	0	0	113.5	L454 L455 K456	L454-M458 WeakPolarHBondContact O-CG 3.48Å; L454-M458 PolarHBondContact O-N 2.96Å; L455-M458 HydrophobicContact CD2-SD 4.08Å; L455-M458 WeakPolarHBondContact O-CA 3.48Å; L455-M458 WeakPolarHBondContact O-CB 3.18Å; L455-M458 PolarHBondContact O-N 2.59Å; K456-M458 VanDerWaalsContact C-N 3.28Å
459	H	36.2	Very low	38.7	Very low	168 Å²	168	103.2 Å²	103.2	78%	0.778	56%	0.555	S	S	*	*			trans	-99.7	6	173.6	-85.9	0.7	0	0	0	113.8	L455 K456	L455-H459 PolarHBondContact O-N 3.06Å; K456-H459 PolarHBondContact O-N 3.25Å
460	L	35.1	Very low	38.5	Very low	210 Å²	210	105.9 Å²	105.9	100%	1.099	56%	0.559	S	S	*	*			trans	-115.1	0	165.2	-74.4	166	0	0	0	108.6

Retrieved 460 of 460 residues in 1569.8 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).