A0A096MQ22_PAPAN Loading...

Cytochrome P450 family 27 subfamily A member 1

AlphaFold DB , UniProt , Accession A0A096MQ22, Species PAPAN (Papio anubis, Olive baboon), Gene CYP27A1, Length 531 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29.6	Very low	26.3	Very low	248 Å²	248	163.1 Å²	163.1	100%	1.222	89%	0.89	S	S	*	*				0	124.4	0	-83.1	-177.7	-125.9	0	0	108.5
2	A	27.7	Very low	26.3	Very low	101 Å²	101	157.3 Å²	157.3	84%	0.835	88%	0.881	S	S	*	*			trans	44.5	109.9	166.1	0	0	0	0	0	118.6
3	A	26.6	Very low	26.5	Very low	94 Å²	94	158.2 Å²	158.2	78%	0.777	88%	0.881	S	S	*	*				72.5	122.3	58.8	0	0	0	0	0	115.2
4	L	28.4	Very low	26.4	Very low	187 Å²	187	164.9 Å²	164.9	98%	0.979	89%	0.886	S	S	*	*			trans	140.4	127.9	156	-77.2	158.6	0	0	0	108.7
5	G	23.8	Very low	26.3	Very low	74 Å²	74	159.2 Å²	159.2	76%	0.763	88%	0.881	S	S	*	*			cis	-178.6	147	4.4	0	0	0	0	0	109.1
6	C	26.1	Very low	26.3	Very low	135 Å²	135	156.1 Å²	156.1	91%	0.912	88%	0.882	S	S	*	*			trans	-67.2	146.9	-178.1	-90.6	0	0	0	0	114.7
7	A	24.8	Very low	26.1	Very low	104 Å²	104	151.6 Å²	151.6	86%	0.86	88%	0.879	S	S	*	*			trans	-153.3	102.9	141.5	0	0	0	0	0	111.1
8	R	27.7	Very low	26	Very low	233 Å²	233	157.5 Å²	157.5	88%	0.879	88%	0.884	S	S	*	*			trans	-99.1	126.8	163.7	-80.3	179	170.6	-179.8	-3.5	107.8
9	L	25	Very low	25.8	Very low	156 Å²	156	152.6 Å²	152.6	82%	0.817	87%	0.873	S	S	*	*			trans	-96.2	106.5	168.1	-101.5	137.8	0	0	0	109.7
10	R	25.5	Very low	25.8	Very low	223 Å²	223	153.6 Å²	153.6	84%	0.842	87%	0.874	S	S	*	*			trans	-86.3	136	159.6	-74.7	178.9	171.9	-171.1	-2.4	107.6
11	W	24.7	Very low	25.9	Very low	239 Å²	239	152.1 Å²	152.1	91%	0.905	87%	0.872	S	S	*	*			trans	-113.8	123.4	158.1	-90.3	75.1	0	0	0	108.7
12	A	25.7	Very low	25.8	Very low	94 Å²	94	146.2 Å²	146.2	78%	0.777	85%	0.852	S	S	*	*			trans	-97.3	145	-177.7	0	0	0	0	0	110.9
13	L	28.8	Very low	25.6	Very low	169 Å²	169	150 Å²	150	89%	0.885	85%	0.852	S	S	*	*			trans	-71.6	149	167.4	-76.9	145.9	0	0	0	112.6
14	R	25.5	Very low	25.6	Very low	252 Å²	252	150.2 Å²	150.2	95%	0.951	85%	0.854	S	S	*	*			trans	160.7	130.1	139.1	-92.7	172.7	173.3	-156.5	-2	106.3
15	G	25	Very low	25.5	Very low	79 Å²	79	146 Å²	146	81%	0.814	85%	0.846	S	S	*	*			cis	138.5	155.9	36.9	0	0	0	0	0	103.5
16	A	25.2	Very low	25.6	Very low	109 Å²	109	154.2 Å²	154.2	90%	0.901	85%	0.854	S	S	*	*			cis	-163.6	159	6.8	0	0	0	0	0	105.7
17	G	23.5	Very low	25.5	Very low	80 Å²	80	152.4 Å²	152.4	83%	0.825	85%	0.849	S	S	*	*			trans	-170.2	100.9	172.6	0	0	0	0	0	111.6
18	R	24.8	Very low	25.6	Very low	258 Å²	258	157 Å²	157	97%	0.974	85%	0.849	S	S	*	*			trans	-59.5	152.6	178.2	-67.9	171.4	168.3	-159.1	-3	112.1
19	G	22.9	Very low	25.5	Very low	65 Å²	65	150.2 Å²	150.2	67%	0.67	84%	0.843	S	S	*	*			trans	141.1	110.9	145.2	0	0	0	0	0	116.2
20	L	24.9	Very low	25.5	Very low	171 Å²	171	149.3 Å²	149.3	90%	0.895	84%	0.844	S	S	*	*			trans	83.9	108	140.9	-61.6	156.2	0	0	0	118.4
21	C	27.6	Very low	25.7	Very low	124 Å²	124	145.9 Å²	145.9	84%	0.838	84%	0.841	S	S	*	*			trans	-49.8	151.1	148.7	-74.2	0	0	0	0	110.8
22	P	27.6	Very low	25.8	Very low	123 Å²	123	140.1 Å²	140.1	80%	0.799	84%	0.835	S	S	*	*			trans	-127.7	136.1	133	28.1	-13.5	0	0	0	112.7
23	H	23.2	Very low	25.9	Very low	181 Å²	181	142.1 Å²	142.1	84%	0.838	84%	0.837	S	S	*	*			trans	-34.7	141.9	159.4	-86.3	-69.9	0	0	0	115.2
24	A	27.8	Very low	25.9	Very low	98 Å²	98	138.5 Å²	138.5	81%	0.81	83%	0.832	S	S	*	*			trans	26.3	101.8	131.9	0	0	0	0	0	117
25	A	24.6	Very low	26.1	Very low	98 Å²	98	134.4 Å²	134.4	81%	0.81	83%	0.828	S	S	*	*			trans	-130.6	92.1	153	0	0	0	0	0	108.7	A27	A25-A27 VanDerWaalsContact C-N 3.33Å; A25-A27 PolarHBondContact O-N 2.75Å
26	R	27.1	Very low	26.3	Very low	248 Å²	248	135.8 Å²	135.8	94%	0.936	82%	0.823	S	S	*	*			trans	-66.1	92.6	165.6	-125	178.4	-180	176.6	-0.2	107	K28	R26-K28 PolarHBondContact O-N 3.03Å; R26-K28 VanDerWaalsContact O-N 3.15Å
27	A	24.3	Very low	26.6	Very low	97 Å²	97	136.1 Å²	136.1	80%	0.802	82%	0.818	S	S	*	*			trans	-75.5	100	168.7	0	0	0	0	0	108.4	A25 A29	A25-A27 VanDerWaalsContact C-N 3.33Å; A25-A27 PolarHBondContact O-N 2.75Å; A27-A29 PolarHBondContact O-N 3.02Å; A27-A29 VanDerWaalsContact O-N 3.07Å
28	K	26.2	Very low	26.9	Very low	199 Å²	199	139.9 Å²	139.9	87%	0.865	82%	0.819	S	S	*	*			trans	-64	101.5	164.7	-78.5	179.7	175.2	179.6	0	107.6	R26 T30	R26-K28 PolarHBondContact O-N 3.03Å; R26-K28 VanDerWaalsContact O-N 3.15Å; K28-T30 PolarHBondContact O-N 3.2Å
29	A	25.2	Very low	27.2	Very low	91 Å²	91	137.1 Å²	137.1	75%	0.752	81%	0.814	S	S	*	*			trans	-78.4	107.4	162	0	0	0	0	0	107.7	A27 I31	A27-A29 PolarHBondContact O-N 3.02Å; A27-A29 VanDerWaalsContact O-N 3.07Å; A29-I31 PolarHBondContact O-N 3.04Å
30	T	24.5	Very low	27.6	Very low	138 Å²	138	138.6 Å²	138.6	85%	0.847	82%	0.821	S	S	*	*			trans	-63.2	108.8	174.4	-10.9	0	0	0	0	108.8	K28	K28-T30 PolarHBondContact O-N 3.2Å
31	I	31.8	Very low	27.8	Very low	151 Å²	151	136.6 Å²	136.6	77%	0.774	82%	0.815	S	S	*	*			trans	-73.5	128.4	168.8	-60.7	169.9	0	0	0	106.8	A29 T33	A29-I31 PolarHBondContact O-N 3.04Å; I31-T33 PolarHBondContact O-N 3.48Å
32	P	26.7	Very low	27.8	Very low	118 Å²	118	139.6 Å²	139.6	77%	0.766	82%	0.817	S	S	*	*			trans	-65.3	129.7	172.5	-13.6	28	0	0	0	109.5
33	T	25.9	Very low	28	Very low	136 Å²	136	138.2 Å²	138.2	83%	0.834	82%	0.816	S	S	*	*			trans	-41.5	132.5	-179.4	-36.1	0	0	0	0	113.1	I31 L35	I31-T33 PolarHBondContact O-N 3.48Å; T33-L35 PolarHBondContact O-N 3.04Å
34	A	29.5	Very low	28.7	Very low	93 Å²	93	136 Å²	136	77%	0.769	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-50.5	130.1	169.1	0	0	0	0	0	111
35	L	30.4	Very low	28.7	Very low	166 Å²	166	134.9 Å²	134.9	87%	0.869	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-67.3	134.3	165.7	-77.8	157.8	0	0	0	108.6	T33	T33-L35 PolarHBondContact O-N 3.04Å
36	P	29.2	Very low	29.7	Very low	108 Å²	108	135.8 Å²	135.8	70%	0.701	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-68.8	139.1	-175.9	27.3	-32.2	0	0	0	111.2	D38	P36-D38 PolarHBondContact O-N 3.42Å
37	S	30.5	Very low	30.1	Very low	115 Å²	115	126.6 Å²	126.6	80%	0.804	81%	0.806	S	S	*	*			trans	-67.5	108	169.9	56.3	0	0	0	0	109.9
38	D	29.5	Very low	30.9	Very low	160 Å²	160	128.1 Å²	128.1	86%	0.856	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-80	131.6	169.9	-86	-30.1	0	0	0	111.4	P36	P36-D38 PolarHBondContact O-N 3.42Å
39	K	31.3	Very low	31.5	Very low	199 Å²	199	122 Å²	122	87%	0.865	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-62.2	139.4	-179.3	-71.6	172.2	171.8	176.9	0	111.2
40	A	31.2	Very low	32.5	Very low	97 Å²	97	125.6 Å²	125.6	80%	0.802	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-70.6	129	166.1	0	0	0	0	0	110.9
41	T	29.6	Very low	33.7	Very low	128 Å²	128	130.3 Å²	130.3	79%	0.785	81%	0.808	S	S	*	*			trans	-157.9	131.8	140.6	2.2	0	0	0	0	111.2
42	E	27.3	Very low	35.1	Very low	188 Å²	188	133.3 Å²	133.3	88%	0.879	81%	0.809	S	S	*	*			trans	79	118.6	156.9	-62.6	-177.2	168.4	0	0	120.9
43	A	32.2	Very low	37	Very low	93 Å²	93	138.9 Å²	138.9	77%	0.769	82%	0.815	S	S	*	*			trans	-88.9	147.5	157.8	0	0	0	0	0	108.3
44	P	38.2	Very low	39.5	Very low	135 Å²	135	137.9 Å²	137.9	88%	0.877	80%	0.801	S	S	*	*				-148.7	153.2	80.5	35.6	-16.8	0	0	0	115.2
45	G	27.9	Very low	42.4	Very low	74 Å²	74	138.3 Å²	138.3	76%	0.763	78%	0.782	S	S	*	*			trans	147	101.2	164.3	0	0	0	0	0	113.4	G47	G45-G47 PolarHBondContact O-N 2.69Å
46	A	44.3	Very low	45.3	Very low	118 Å²	118	133.1 Å²	133.1	98%	0.975	76%	0.76	S	S	*	*			trans	-67.2	91.9	170.5	0	0	0	0	0	110.1
47	G	35.8	Very low	48.4	Very low	55 Å²	55	130.3 Å²	130.3	57%	0.567	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-93.1	158.4	165.2	0	0	0	0	0	111.4	G45 G49	G45-G47 PolarHBondContact O-N 2.69Å; G47-G49 PolarHBondContact O-N 3.18Å; G47-G49 VanDerWaalsContact O-N 3.14Å
48	P	40.9	Very low	51.3	Low	129 Å²	129	133.4 Å²	133.4	84%	0.838	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-61.2	120.9	-173.6	27.3	-33.7	0	0	0	109.6	I50	P48-I50 PolarHBondContact O-N 3.39Å
49	G	40.3	Very low	54.3	Low	69 Å²	69	130.8 Å²	130.8	71%	0.711	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-51.1	123.8	-173.4	0	0	0	0	0	111.7	G47 R51	G47-G49 PolarHBondContact O-N 3.18Å; G47-G49 VanDerWaalsContact O-N 3.14Å; G49-R51 PolarHBondContact O-N 3.2Å
50	I	45.7	Very low	57.4	Low	167 Å²	167	121.6 Å²	121.6	86%	0.856	68%	0.681	S	S	*	*			trans	-61.4	91.2	165.2	-60.7	169.6	0	0	0	105.9	P48 R52	P48-I50 PolarHBondContact O-N 3.39Å; I50-R52 PolarHBondContact O-N 2.93Å
51	R	49.2	Very low	60.5	Low	238 Å²	238	119.4 Å²	119.4	90%	0.898	66%	0.658	S	S	*	*			trans	-57.8	111.1	165.9	-87.8	-177.3	172.6	-178.4	-2.4	105.7	G49 R53	G49-R51 PolarHBondContact O-N 3.2Å; R51-R53 PolarHBondContact O-N 3.13Å
52	R	60.5	Low	63.6	Low	213 Å²	213	119.7 Å²	119.7	80%	0.804	65%	0.645	S	S	*	*			trans	-47.2	121.9	166	-94.7	-178.7	172.5	179.6	-2.3	106.9	I50 Q54	I50-R52 PolarHBondContact O-N 2.93Å; R52-Q54 PolarHBondContact O-N 3.49Å
53	R	67.6	Low	66.8	Low	236 Å²	236	111 Å²	111	89%	0.891	60%	0.604	S	S	*	*			trans	-56.8	115.9	177.6	-176.6	178.4	179.8	-176.2	0.4	107.8	R51 R55	R51-R53 PolarHBondContact O-N 3.13Å; R53-R55 PolarHBondContact O-N 3.13Å
54	Q	78.1	Confident	69.5	Low	115 Å²	115	108.5 Å²	108.5	54%	0.537	59%	0.588	S	S	.	*	P	Polyproline II helix	trans	-59.8	127.1	176.7	-79.4	178.7	-29.7	0	0	109.3	R52	R52-Q54 PolarHBondContact O-N 3.49Å
55	R	91.3	Very high	71.9	Confident	102 Å²	102	105.9 Å²	105.9	39%	0.385	56%	0.564	S	S	.	*	B	Isolated β-bridge	trans	-79.4	147.1	-179.2	-65	173.5	68	-169.9	4.9	110	R53 E59 D414 G415 F416	R53-R55 PolarHBondContact O-N 3.13Å; R55-E59 IonicContact CZ-OE2 3.66Å; R55-E59 IonicContact NE-OE2 2.85Å; R55-E59 PolarHBondContact NE-OE2 3Å; R55-E59 IonicContact NH2-OE2 2.81Å; R55-D414 PolarHBondContact NH1-O 2.87Å; R55-D414 IonicContact NH1-OD2 3.26Å; R55-D414 PolarHBondContact NH1-OD2 3.39Å; R55-G415 PolarHBondContact N-O 2.97Å; R55-F416 HydrophobicContact CB-CD1 3.53Å; R55-F416 HydrophobicContact CB-CE1 3.42Å; R55-F416 VanDerWaalsContact CB-CE1 3.42Å; R55-F416 HydrophobicContact CB-CG 4.2Å; R55-F416 HydrophobicContact CB-CZ 4.03Å; R55-F416 HydrophobicContact CG-CE1 4.49Å; R55-F416 VanDerWaalsContact CZ-CE2 3.44Å; R55-F416 VanDerWaalsContact NH1-CE2 3.25Å
56	S	91.6	Very high	74.9	Confident	57 Å²	57	109.7 Å²	109.7	40%	0.399	57%	0.566	S	S	.	*	P	Polyproline II helix	trans	-81.3	135.6	-179.8	-172.6	0	0	0	0	111	K58 E59 F416	S56-K58 PolarHBondContact O-N 3.28Å; S56-K58 PolarHBondContact OG-N 2.98Å; S56-E59 PolarHBondContact N-OE1 2.89Å; S56-E59 VanDerWaalsContact O-CB 3.3Å; S56-E59 WeakPolarHBondContact O-CB 3.29Å; S56-E59 WeakPolarHBondContact O-CG 3.44Å; S56-E59 PolarHBondContact O-N 3.06Å; S56-F416 WeakPolarHBondContact O-CE1 3.48Å
57	L	93.1	Very high	77.1	Confident	49 Å²	49	109.2 Å²	109.2	26%	0.257	54%	0.539	S	S	.	.	G	3₁₀ helix	trans	-57.1	-18	171.5	-62.5	-177.8	0	0	0	113.3	E59 I60 M97 F416 F418	L57-E59 PolarHBondContact O-N 3.42Å; L57-I60 HydrophobicContact CD2-CD1 3.81Å; L57-I60 PolarHBondContact O-N 3.15Å; L57-M97 WeakPolarHBondContact O-CE 3.47Å; L57-F416 HydrophobicContact CD2-CB 3.93Å; L57-F416 HydrophobicContact CD2-CD1 4.24Å; L57-F416 HydrophobicContact CD2-CG 4.43Å; L57-F418 HydrophobicContact CD1-CD1 4.45Å; L57-F418 HydrophobicContact CD2-CD1 3.76Å; L57-F418 HydrophobicContact CD2-CE1 3.48Å; L57-F418 VanDerWaalsContact CD2-CE1 3.48Å; L57-F418 HydrophobicContact CD2-CE2 4.37Å; L57-F418 HydrophobicContact CD2-CG 4.32Å; L57-F418 HydrophobicContact CD2-CZ 3.83Å
58	K	91.5	Very high	79.7	Confident	179 Å²	179	108.1 Å²	108.1	78%	0.778	52%	0.518	S	S	*	.	G	3₁₀ helix	trans	-66.2	-20.7	173.2	-64.7	-177.1	-178.8	178.7	0	113.1	S56 I60	S56-K58 PolarHBondContact O-N 3.28Å; S56-K58 PolarHBondContact OG-N 2.98Å; K58-I60 VanDerWaalsContact C-N 3.32Å
59	E	93.1	Very high	82.1	Confident	106 Å²	106	104.8 Å²	104.8	50%	0.495	49%	0.491	S	S	.	.	G	3₁₀ helix	trans	-75.9	-20.4	177.3	-61.4	166.6	-143.3	0	0	112.5	R55 S56 L57 F416	R55-E59 IonicContact CZ-OE2 3.66Å; R55-E59 IonicContact NE-OE2 2.85Å; R55-E59 PolarHBondContact NE-OE2 3Å; R55-E59 IonicContact NH2-OE2 2.81Å; S56-E59 PolarHBondContact N-OE1 2.89Å; S56-E59 VanDerWaalsContact O-CB 3.3Å; S56-E59 WeakPolarHBondContact O-CB 3.29Å; S56-E59 WeakPolarHBondContact O-CG 3.44Å; S56-E59 PolarHBondContact O-N 3.06Å; L57-E59 PolarHBondContact O-N 3.42Å; E59-F416 HydrophobicContact CB-CE1 4.15Å
60	I	95.6	Very high	84.6	Confident	6 Å²	6	106.4 Å²	106.4	3%	0.031	48%	0.479	C	S	.	.	S	Bend	trans	-75.9	127	-177.8	-58.3	170.6	0	0	0	109.5	L57 K58 M95 M97 F416 F418	L57-I60 HydrophobicContact CD2-CD1 3.81Å; L57-I60 PolarHBondContact O-N 3.15Å; K58-I60 VanDerWaalsContact C-N 3.32Å; I60-M95 HydrophobicContact CD1-SD 3.78Å; I60-M95 HydrophobicContact CG1-SD 4.31Å; I60-M95 HydrophobicContact CG2-CG 4.29Å; I60-M97 HydrophobicContact CB-CE 3.83Å; I60-M97 HydrophobicContact CB-CG 4.4Å; I60-M97 HydrophobicContact CB-SD 4.44Å; I60-M97 HydrophobicContact CG2-CE 4.18Å; I60-M97 HydrophobicContact CG2-CG 3.83Å; I60-M97 HydrophobicContact CG2-SD 4.49Å; I60-M97 WeakPolarHBondContact O-CE 3.08Å; I60-F416 HydrophobicContact CD1-CD1 3.96Å; I60-F416 HydrophobicContact CD1-CD2 4.26Å; I60-F416 HydrophobicContact CD1-CE1 4.11Å; I60-F416 HydrophobicContact CD1-CE2 4.38Å; I60-F416 HydrophobicContact CD1-CG 4.03Å; I60-F416 HydrophobicContact CD1-CZ 4.29Å; I60-F416 HydrophobicContact CG1-CD1 4.07Å; I60-F416 HydrophobicContact CG1-CD2 4.49Å; I60-F416 HydrophobicContact CG1-CE1 3.68Å; I60-F416 HydrophobicContact CG1-CE2 4.13Å; I60-F416 HydrophobicContact CG1-CG 4.44Å; I60-F416 HydrophobicContact CG1-CZ 3.68Å; I60-F418 HydrophobicContact CD1-CE1 3.94Å; I60-F418 HydrophobicContact CD1-CZ 3.61Å
61	P	96.5	Very high	86.9	Confident	51 Å²	51	99 Å²	99	33%	0.331	44%	0.44	S	S	.	.			trans	-59.7	147.6	179.3	-22.8	32.6	0	0	0	112.8	Y92 M97	P61-Y92 HydrophobicContact CB-CD1 3.43Å; P61-Y92 VanDerWaalsContact CB-CD1 3.43Å; P61-Y92 HydrophobicContact CB-CE1 4.19Å; P61-Y92 HydrophobicContact CB-CG 4.03Å; P61-Y92 HydrophobicContact CG-CD1 4.34Å; P61-M97 PolarHBondContact O-N 3.41Å
62	R	95.5	Very high	88.8	Confident	133 Å²	133	87.7 Å²	87.7	50%	0.502	40%	0.398	S	S	.	.	B	Isolated β-bridge	trans	-115.9	131.7	-178.2	-61.9	-178.6	-174.7	-169.3	-3.9	111.6	M97	R62-M97 CarbonylContact C-O 3.59Å; R62-M97 WeakPolarHBondContact CA-O 3.24Å; R62-M97 HydrophobicContact CG-CB 4.34Å; R62-M97 HydrophobicContact CG-CE 3.79Å
63	L	93.1	Very high	90.2	Very high	6 Å²	6	81.4 Å²	81.4	3%	0.031	38%	0.376	C	S	.	.			trans	-82.4	119.8	168.1	177.9	63.2	0	0	0	109.4	F68 Y88 Y92 M97	L63-F68 HydrophobicContact CD2-CB 4.02Å; L63-F68 HydrophobicContact CD2-CD2 3.83Å; L63-F68 HydrophobicContact CD2-CG 4.16Å; L63-F68 HydrophobicContact CG-CB 4.23Å; L63-Y88 HydrophobicContact CD1-CD1 4.34Å; L63-Y88 HydrophobicContact CD1-CE1 3.71Å; L63-Y88 HydrophobicContact CD1-CE2 4.4Å; L63-Y88 HydrophobicContact CD2-CD2 4.08Å; L63-Y88 HydrophobicContact CD2-CE1 4.29Å; L63-Y88 HydrophobicContact CD2-CE2 3.46Å; L63-Y88 VanDerWaalsContact CD2-CE2 3.46Å; L63-Y92 HydrophobicContact CB-CE2 4.49Å; L63-Y92 HydrophobicContact CD1-CE2 4.19Å; L63-M97 PolarHBondContact N-O 3.47Å
64	G	90.3	Very high	91.4	Very high	40 Å²	40	75 Å²	75	41%	0.412	36%	0.363	S	S	.	.			trans	-69.2	134.2	175.6	0	0	0	0	0	112	L66 R67 F68	G64-L66 PolarHBondContact O-N 2.98Å; G64-R67 WeakPolarHBondContact O-CB 3.47Å; G64-R67 PolarHBondContact O-N 3.49Å; G64-F68 PolarHBondContact O-N 3.27Å
65	Q	88.8	Confident	92	Very high	81 Å²	81	74.3 Å²	74.3	38%	0.379	36%	0.36	S	S	.	.	H	α-helix	trans	-59.7	-46.2	-177.3	-65.2	-172.9	8.5	0	0	112.6	R67 F68 F69 G101	Q65-R67 VanDerWaalsContact C-N 3.28Å; Q65-R67 PolarHBondContact O-N 2.93Å; Q65-F68 WeakPolarHBondContact O-CB 3.46Å; Q65-F68 PolarHBondContact O-N 3Å; Q65-F68 VanDerWaalsContact O-N 3.09Å; Q65-F69 HydrophobicContact CB-CD2 4.45Å; Q65-F69 HydrophobicContact CB-CE2 4.42Å; Q65-F69 WeakPolarHBondContact O-CD2 3.41Å; Q65-F69 PolarHBondContact O-N 3.04Å; Q65-G101 PolarHBondContact NE2-O 3.29Å
66	L	89.8	Confident	91.9	Very high	154 Å²	154	71.5 Å²	71.5	81%	0.806	36%	0.363	S	S	*	.	H	α-helix	trans	-59.4	-40.5	178.5	-68.1	175.5	0	0	0	112.1	G64 F69 F70	G64-L66 PolarHBondContact O-N 2.98Å; L66-F69 PolarHBondContact O-N 3.01Å; L66-F70 VanDerWaalsContact O-CB 3.25Å; L66-F70 WeakPolarHBondContact O-CB 3.5Å; L66-F70 PolarHBondContact O-N 3.34Å
67	R	90.7	Very high	91.8	Very high	108 Å²	108	71 Å²	71	41%	0.408	35%	0.352	S	S	.	.	H	α-helix	trans	-62.8	-47.6	174.9	-179.4	-174	173	128.6	0.7	110.3	G64 Q65 F69 F70 Q71	G64-R67 WeakPolarHBondContact O-CB 3.47Å; G64-R67 PolarHBondContact O-N 3.49Å; Q65-R67 VanDerWaalsContact C-N 3.28Å; Q65-R67 PolarHBondContact O-N 2.93Å; R67-F69 PolarHBondContact O-N 3.49Å; R67-F70 PolarHBondContact O-N 3.42Å; R67-Q71 HydrophobicContact CG-CG 4.45Å; R67-Q71 VanDerWaalsContact O-CG 3.23Å; R67-Q71 WeakPolarHBondContact O-CG 3.45Å; R67-Q71 PolarHBondContact O-N 3.06Å
68	F	91.4	Very high	91.5	Very high	31 Å²	31	69.5 Å²	69.5	14%	0.136	35%	0.347	C	S	.	.	H	α-helix	trans	-57.4	-50	178.2	179.9	-116.8	0	0	0	111.6	L63 G64 Q65 F70 Q71 L72 L84 Y88 F256	L63-F68 HydrophobicContact CD2-CB 4.02Å; L63-F68 HydrophobicContact CD2-CD2 3.83Å; L63-F68 HydrophobicContact CD2-CG 4.16Å; L63-F68 HydrophobicContact CG-CB 4.23Å; G64-F68 PolarHBondContact O-N 3.27Å; Q65-F68 WeakPolarHBondContact O-CB 3.46Å; Q65-F68 PolarHBondContact O-N 3Å; Q65-F68 VanDerWaalsContact O-N 3.09Å; F68-F70 PolarHBondContact O-N 3.31Å; F68-Q71 PolarHBondContact O-N 3.35Å; F68-Q71 VanDerWaalsContact O-N 3.16Å; F68-L72 HydrophobicContact CD1-CD1 4Å; F68-L72 HydrophobicContact CD2-CG 4.45Å; F68-L72 HydrophobicContact CE1-CD1 3.5Å; F68-L72 HydrophobicContact CE1-CG 4.27Å; F68-L72 HydrophobicContact CE2-CD1 4.22Å; F68-L72 HydrophobicContact CE2-CD2 4.11Å; F68-L72 HydrophobicContact CE2-CG 4.17Å; F68-L72 HydrophobicContact CZ-CD1 3.63Å; F68-L72 HydrophobicContact CZ-CD2 4.13Å; F68-L72 HydrophobicContact CZ-CG 4.08Å; F68-L72 WeakPolarHBondContact O-CG 3.35Å; F68-L72 PolarHBondContact O-N 2.88Å; F68-L84 HydrophobicContact CD2-CD1 4.37Å; F68-L84 HydrophobicContact CE2-CD1 3.98Å; F68-Y88 HydrophobicContact CD2-CE2 4.3Å; F68-Y88 WeakPolarHBondContact CD2-OH 3.47Å; F68-F256 AromaticContact CE1-CD1 3.98Å; F68-F256 HydrophobicContact CE1-CD1 3.98Å; F68-F256 AromaticContact CE1-CE1 3.6Å; F68-F256 HydrophobicContact CE1-CE1 3.6Å; F68-F256 HydrophobicContact CE1-CZ 4.41Å; F68-F256 HydrophobicContact CZ-CD1 4.5Å; F68-F256 AromaticContact CZ-CE1 3.77Å; F68-F256 HydrophobicContact CZ-CE1 3.77Å; F68-F256 HydrophobicContact CZ-CZ 4.15Å
69	F	90.9	Very high	91.2	Very high	60 Å²	60	64.4 Å²	64.4	26%	0.263	33%	0.328	S	S	.	.	H	α-helix	trans	-62.6	-40.6	177.7	-76	-63	0	0	0	113.6	Q65 L66 R67 Q71 L72 F73 F256	Q65-F69 HydrophobicContact CB-CD2 4.45Å; Q65-F69 HydrophobicContact CB-CE2 4.42Å; Q65-F69 WeakPolarHBondContact O-CD2 3.41Å; Q65-F69 PolarHBondContact O-N 3.04Å; L66-F69 PolarHBondContact O-N 3.01Å; R67-F69 PolarHBondContact O-N 3.49Å; F69-Q71 VanDerWaalsContact C-N 3.31Å; F69-Q71 PolarHBondContact O-N 3.13Å; F69-L72 HydrophobicContact CD1-CD1 4.49Å; F69-L72 PolarHBondContact O-N 3.12Å; F69-F73 HydrophobicContact CD1-CD2 4.12Å; F69-F73 AromaticContact CD1-CE2 3.73Å; F69-F73 HydrophobicContact CD1-CE2 3.73Å; F69-F73 HydrophobicContact CE1-CE2 4.26Å; F69-F73 PolarHBondContact O-N 3.35Å; F69-F256 HydrophobicContact CE1-CB 4.33Å; F69-F256 WeakPolarHBondContact CE1-O 3.47Å
70	F	92.4	Very high	91.1	Very high	103 Å²	103	62.5 Å²	62.5	45%	0.452	32%	0.319	S	S	.	.	H	α-helix	trans	-59.8	-43.3	173.6	178.6	-99.7	0	0	0	111.4	L66 R67 F68 V74 Q75	L66-F70 VanDerWaalsContact O-CB 3.25Å; L66-F70 WeakPolarHBondContact O-CB 3.5Å; L66-F70 PolarHBondContact O-N 3.34Å; R67-F70 PolarHBondContact O-N 3.42Å; F68-F70 PolarHBondContact O-N 3.31Å; F70-V74 HydrophobicContact CD2-CB 3.7Å; F70-V74 HydrophobicContact CD2-CG1 4.05Å; F70-V74 HydrophobicContact CD2-CG2 3.71Å; F70-V74 HydrophobicContact CE2-CB 3.73Å; F70-V74 HydrophobicContact CE2-CG1 3.54Å; F70-V74 HydrophobicContact CE2-CG2 4.07Å; F70-V74 HydrophobicContact CG-CB 4.3Å; F70-V74 HydrophobicContact CG-CG2 4.5Å; F70-V74 HydrophobicContact CZ-CB 4.36Å; F70-V74 HydrophobicContact CZ-CG1 4.05Å; F70-V74 WeakPolarHBondContact O-CA 3.46Å; F70-V74 VanDerWaalsContact O-CB 3.26Å; F70-V74 WeakPolarHBondContact O-CB 3.38Å; F70-V74 PolarHBondContact O-N 2.78Å; F70-Q75 HydrophobicContact CD1-CG 3.99Å; F70-Q75 HydrophobicContact CE1-CG 3.65Å; F70-Q75 HydrophobicContact CZ-CG 4.32Å; F70-Q75 PolarHBondContact O-N 2.84Å
71	Q	93.4	Very high	90.8	Very high	10 Å²	10	64.1 Å²	64.1	5%	0.047	33%	0.328	C	S	.	.	H	α-helix	trans	-64.5	-43.6	176.5	-66.4	-176.5	-82	0	0	111.5	R67 F68 F69 G76 Y77 L84 Y88	R67-Q71 HydrophobicContact CG-CG 4.45Å; R67-Q71 VanDerWaalsContact O-CG 3.23Å; R67-Q71 WeakPolarHBondContact O-CG 3.45Å; R67-Q71 PolarHBondContact O-N 3.06Å; F68-Q71 PolarHBondContact O-N 3.35Å; F68-Q71 VanDerWaalsContact O-N 3.16Å; F69-Q71 VanDerWaalsContact C-N 3.31Å; F69-Q71 PolarHBondContact O-N 3.13Å; Q71-G76 PolarHBondContact O-N 3.3Å; Q71-Y77 HydrophobicContact CB-CD2 4.21Å; Q71-Y77 WeakPolarHBondContact O-CB 3.47Å; Q71-Y77 WeakPolarHBondContact O-CD2 3.44Å; Q71-Y77 PolarHBondContact O-N 3.3Å; Q71-L84 HydrophobicContact CB-CD2 4.15Å; Q71-Y88 VanDerWaalsContact OE1-CE1 3.28Å; Q71-Y88 PolarHBondContact OE1-OH 2.78Å
72	L	90.4	Very high	90.7	Very high	2 Å²	2	61.7 Å²	61.7	1%	0.01	31%	0.312	C	S	.	.	H	α-helix	trans	-61.2	-55.3	179.1	-69.8	-176.5	0	0	0	112.8	F68 F69 Y77 A78 L81 L84 F256	F68-L72 HydrophobicContact CD1-CD1 4Å; F68-L72 HydrophobicContact CD2-CG 4.45Å; F68-L72 HydrophobicContact CE1-CD1 3.5Å; F68-L72 HydrophobicContact CE1-CG 4.27Å; F68-L72 HydrophobicContact CE2-CD1 4.22Å; F68-L72 HydrophobicContact CE2-CD2 4.11Å; F68-L72 HydrophobicContact CE2-CG 4.17Å; F68-L72 HydrophobicContact CZ-CD1 3.63Å; F68-L72 HydrophobicContact CZ-CD2 4.13Å; F68-L72 HydrophobicContact CZ-CG 4.08Å; F68-L72 WeakPolarHBondContact O-CG 3.35Å; F68-L72 PolarHBondContact O-N 2.88Å; F69-L72 HydrophobicContact CD1-CD1 4.49Å; F69-L72 PolarHBondContact O-N 3.12Å; L72-Y77 PolarHBondContact O-N 3.39Å; L72-A78 PolarHBondContact O-N 2.87Å; L72-A78 VanDerWaalsContact O-N 3.09Å; L72-L81 HydrophobicContact CD2-CD2 3.24Å; L72-L84 HydrophobicContact CD2-CD1 3.87Å; L72-F256 HydrophobicContact CD1-CB 4.37Å; L72-F256 HydrophobicContact CD1-CD1 3.82Å; L72-F256 HydrophobicContact CD1-CD2 4.04Å; L72-F256 HydrophobicContact CD1-CE1 4.11Å; L72-F256 HydrophobicContact CD1-CE2 4.31Å; L72-F256 HydrophobicContact CD1-CG 3.81Å; L72-F256 HydrophobicContact CD1-CZ 4.35Å
73	F	89.9	Confident	90.7	Very high	80 Å²	80	58.2 Å²	58.2	35%	0.351	30%	0.301	S	S	.	.	H	α-helix	trans	-99.8	-27	-165.5	-64.2	-61.9	0	0	0	114.3	F69 Y253 F256 L257	F69-F73 HydrophobicContact CD1-CD2 4.12Å; F69-F73 AromaticContact CD1-CE2 3.73Å; F69-F73 HydrophobicContact CD1-CE2 3.73Å; F69-F73 HydrophobicContact CE1-CE2 4.26Å; F69-F73 PolarHBondContact O-N 3.35Å; F73-Y253 HydrophobicContact CE1-CD1 4.11Å; F73-Y253 HydrophobicContact CE1-CE1 4.29Å; F73-F256 HydrophobicContact CE2-CB 4.22Å; F73-F256 HydrophobicContact CZ-CB 3.79Å; F73-L257 HydrophobicContact CE1-CD2 4.11Å; F73-L257 HydrophobicContact CE2-CD2 3.97Å; F73-L257 HydrophobicContact CZ-CD2 3.59Å; F73-L257 HydrophobicContact CZ-CG 4.12Å
74	V	91.3	Very high	90.8	Very high	101 Å²	101	58.1 Å²	58.1	61%	0.612	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.7	-42.2	-178.8	-173.1	0	0	0	0	111.3	F70 G76	F70-V74 HydrophobicContact CD2-CB 3.7Å; F70-V74 HydrophobicContact CD2-CG1 4.05Å; F70-V74 HydrophobicContact CD2-CG2 3.71Å; F70-V74 HydrophobicContact CE2-CB 3.73Å; F70-V74 HydrophobicContact CE2-CG1 3.54Å; F70-V74 HydrophobicContact CE2-CG2 4.07Å; F70-V74 HydrophobicContact CG-CB 4.3Å; F70-V74 HydrophobicContact CG-CG2 4.5Å; F70-V74 HydrophobicContact CZ-CB 4.36Å; F70-V74 HydrophobicContact CZ-CG1 4.05Å; F70-V74 WeakPolarHBondContact O-CA 3.46Å; F70-V74 VanDerWaalsContact O-CB 3.26Å; F70-V74 WeakPolarHBondContact O-CB 3.38Å; F70-V74 PolarHBondContact O-N 2.78Å; V74-G76 VanDerWaalsContact C-N 3.33Å
75	Q	91.1	Very high	91	Very high	101 Å²	101	56.6 Å²	56.6	47%	0.472	28%	0.283	S	S	.	.	S	Bend	trans	-87.1	-0.5	177.8	-59.1	-170.2	-30.5	0	0	114	F70 Y77	F70-Q75 HydrophobicContact CD1-CG 3.99Å; F70-Q75 HydrophobicContact CE1-CG 3.65Å; F70-Q75 HydrophobicContact CZ-CG 4.32Å; F70-Q75 PolarHBondContact O-N 2.84Å; Q75-Y77 HydrophobicContact CB-CD2 3.77Å; Q75-Y77 HydrophobicContact CB-CE2 3.86Å
76	G	88.9	Confident	91.4	Very high	43 Å²	43	55.8 Å²	55.8	44%	0.443	28%	0.283	S	S	.	.	S	Bend	trans	79	21	173.3	0	0	0	0	0	115.6	Q71 V74 A78	Q71-G76 PolarHBondContact O-N 3.3Å; V74-G76 VanDerWaalsContact C-N 3.33Å; G76-A78 VanDerWaalsContact C-N 3.3Å; G76-A78 PolarHBondContact O-N 3.46Å
77	Y	89.8	Confident	91.7	Very high	47 Å²	47	52 Å²	52	18%	0.184	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-81.2	-0.5	178.8	-74.2	-87.6	0	0	0	114.8	Q71 L72 Q75 L79 Q80 L81 Q83 L84 L87	Q71-Y77 HydrophobicContact CB-CD2 4.21Å; Q71-Y77 WeakPolarHBondContact O-CB 3.47Å; Q71-Y77 WeakPolarHBondContact O-CD2 3.44Å; Q71-Y77 PolarHBondContact O-N 3.3Å; L72-Y77 PolarHBondContact O-N 3.39Å; Q75-Y77 HydrophobicContact CB-CD2 3.77Å; Q75-Y77 HydrophobicContact CB-CE2 3.86Å; Y77-L79 PolarHBondContact O-N 2.85Å; Y77-Q80 HydrophobicContact CD1-CB 4.04Å; Y77-Q80 CarbonylContact O-C 3.59Å; Y77-Q80 VanDerWaalsContact O-C 3.28Å; Y77-Q80 WeakPolarHBondContact O-CA 3.28Å; Y77-Q80 PolarHBondContact O-N 3.26Å; Y77-L81 PolarHBondContact O-N 2.52Å; Y77-Q83 HydrophobicContact CD1-CB 4.31Å; Y77-Q83 HydrophobicContact CE1-CB 4.06Å; Y77-L84 HydrophobicContact CD1-CD2 3.56Å; Y77-L84 HydrophobicContact CD1-CG 3.78Å; Y77-L84 HydrophobicContact CD2-CD2 4.01Å; Y77-L84 HydrophobicContact CE1-CD2 4.07Å; Y77-L84 HydrophobicContact CE2-CD2 4.46Å; Y77-L84 HydrophobicContact CG-CD1 4.45Å; Y77-L84 HydrophobicContact CG-CD2 3.53Å; Y77-L84 HydrophobicContact CG-CG 3.91Å; Y77-L87 HydrophobicContact CE1-CD1 3.85Å; Y77-L87 WeakPolarHBondContact OH-CD1 3.43Å
78	A	86.8	Confident	92	Very high	18 Å²	18	47.3 Å²	47.3	15%	0.149	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-52.1	-40.6	179.7	0	0	0	0	0	113.5	L72 G76 L252	L72-A78 PolarHBondContact O-N 2.87Å; L72-A78 VanDerWaalsContact O-N 3.09Å; G76-A78 VanDerWaalsContact C-N 3.3Å; G76-A78 PolarHBondContact O-N 3.46Å; A78-L252 WeakPolarHBondContact O-CD1 3.49Å
79	L	85.9	Confident	92.2	Very high	71 Å²	71	47.8 Å²	47.8	37%	0.372	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-98.8	11.5	175.4	-63.2	176.5	0	0	0	113.3	Y77 L252 V511 A512 R513	Y77-L79 PolarHBondContact O-N 2.85Å; L79-L252 HydrophobicContact CD2-CD1 3.51Å; L79-V511 CarbonylContact O-C 3.45Å; L79-A512 CarbonylContact C-O 3.23Å; L79-A512 WeakPolarHBondContact CA-O 3.27Å; L79-A512 PolarHBondContact O-N 3.44Å; L79-R513 HydrophobicContact CD2-CB 4.17Å
80	Q	90.2	Very high	92.5	Very high	67 Å²	67	49.1 Å²	49.1	31%	0.313	27%	0.27	S	S	.	.			trans	-132.3	32.6	-176.9	-55.6	-174.1	39.2	0	0	111	Y77 H82 Q83 L84	Y77-Q80 HydrophobicContact CD1-CB 4.04Å; Y77-Q80 CarbonylContact O-C 3.59Å; Y77-Q80 VanDerWaalsContact O-C 3.28Å; Y77-Q80 WeakPolarHBondContact O-CA 3.28Å; Y77-Q80 PolarHBondContact O-N 3.26Å; Q80-H82 PolarHBondContact O-N 2.95Å; Q80-H82 VanDerWaalsContact O-N 3.13Å; Q80-Q83 HydrophobicContact CB-CB 4.44Å; Q80-Q83 HydrophobicContact CB-CG 4.24Å; Q80-Q83 WeakPolarHBondContact O-CB 3.38Å; Q80-Q83 PolarHBondContact O-N 2.75Å; Q80-L84 PolarHBondContact O-N 2.97Å
81	L	90.8	Very high	92.7	Very high	39 Å²	39	49.5 Å²	49.5	20%	0.204	27%	0.272	C	S	.	.	H	α-helix	trans	-54.3	-33.7	179.4	-66.7	-179.5	0	0	0	113.4	L72 Y77 Q83 L84 Q85 L252 F256	L72-L81 HydrophobicContact CD2-CD2 3.24Å; Y77-L81 PolarHBondContact O-N 2.52Å; L81-Q83 VanDerWaalsContact C-N 3.27Å; L81-Q83 PolarHBondContact O-N 3.43Å; L81-L84 HydrophobicContact CD2-CD1 4.05Å; L81-L84 WeakPolarHBondContact O-CB 3.42Å; L81-L84 PolarHBondContact O-N 3.15Å; L81-L84 VanDerWaalsContact O-N 3.15Å; L81-Q85 PolarHBondContact O-N 2.79Å; L81-L252 HydrophobicContact CD1-CD2 3.73Å; L81-F256 HydrophobicContact CD1-CE2 4.26Å; L81-F256 HydrophobicContact CD1-CZ 4.48Å
82	H	94.2	Very high	92.8	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-61.9	-33.7	175.6	63	-80.8	0	0	0	112.3	Q80 Q85 P401 Y429 S510 A512 L516	Q80-H82 PolarHBondContact O-N 2.95Å; Q80-H82 VanDerWaalsContact O-N 3.13Å; H82-Q85 WeakPolarHBondContact O-CB 3.38Å; H82-Q85 PolarHBondContact O-N 3.39Å; H82-P401 HydrophobicContact CB-CB 3.99Å; H82-P401 HydrophobicContact CB-CG 4.47Å; H82-Y429 HydrophobicContact CB-CD1 4.06Å; H82-Y429 HydrophobicContact CB-CD2 4.06Å; H82-Y429 HydrophobicContact CB-CE2 4.49Å; H82-Y429 HydrophobicContact CB-CG 3.82Å; H82-Y429 AromaticContact CD2-CE1 3.9Å; H82-Y429 AromaticContact CD2-CE2 3.72Å; H82-Y429 AromaticContact CD2-CZ 3.6Å; H82-Y429 WeakPolarHBondContact O-CD1 3.25Å; H82-S510 PolarHBondContact CE1-O 2.75Å; H82-S510 VanDerWaalsContact CE1-O 3.26Å; H82-S510 PolarHBondContact NE2-O 3.23Å; H82-S510 PolarHBondContact NE2-OG 3.38Å; H82-S510 VanDerWaalsContact NE2-OG 3.14Å; H82-A512 WeakPolarHBondContact ND1-CB 3.42Å; H82-L516 HydrophobicContact CB-CD2 4.06Å
83	Q	94.6	Very high	93.1	Very high	60 Å²	60	51.9 Å²	51.9	28%	0.28	29%	0.289	S	S	.	.	H	α-helix	trans	-73	-30.1	175	-60	-176.2	8.3	0	0	112.4	Y77 Q80 L81 Q85 V86 L87	Y77-Q83 HydrophobicContact CD1-CB 4.31Å; Y77-Q83 HydrophobicContact CE1-CB 4.06Å; Q80-Q83 HydrophobicContact CB-CB 4.44Å; Q80-Q83 HydrophobicContact CB-CG 4.24Å; Q80-Q83 WeakPolarHBondContact O-CB 3.38Å; Q80-Q83 PolarHBondContact O-N 2.75Å; L81-Q83 VanDerWaalsContact C-N 3.27Å; L81-Q83 PolarHBondContact O-N 3.43Å; Q83-Q85 PolarHBondContact O-N 3.02Å; Q83-V86 WeakPolarHBondContact O-CB 3.3Å; Q83-V86 PolarHBondContact O-N 2.83Å; Q83-V86 VanDerWaalsContact O-N 3.09Å; Q83-L87 PolarHBondContact O-N 2.76Å; Q83-L87 VanDerWaalsContact O-N 3.08Å
84	L	94.7	Very high	93.5	Very high	4 Å²	4	51 Å²	51	2%	0.021	29%	0.291	C	S	.	.	H	α-helix	trans	-61	-32.7	171.7	-68.5	-178.8	0	0	0	111.5	F68 Q71 L72 Y77 Q80 L81 V86 L87 Y88	F68-L84 HydrophobicContact CD2-CD1 4.37Å; F68-L84 HydrophobicContact CE2-CD1 3.98Å; Q71-L84 HydrophobicContact CB-CD2 4.15Å; L72-L84 HydrophobicContact CD2-CD1 3.87Å; Y77-L84 HydrophobicContact CD1-CD2 3.56Å; Y77-L84 HydrophobicContact CD1-CG 3.78Å; Y77-L84 HydrophobicContact CD2-CD2 4.01Å; Y77-L84 HydrophobicContact CE1-CD2 4.07Å; Y77-L84 HydrophobicContact CE2-CD2 4.46Å; Y77-L84 HydrophobicContact CG-CD1 4.45Å; Y77-L84 HydrophobicContact CG-CD2 3.53Å; Y77-L84 HydrophobicContact CG-CG 3.91Å; Q80-L84 PolarHBondContact O-N 2.97Å; L81-L84 HydrophobicContact CD2-CD1 4.05Å; L81-L84 WeakPolarHBondContact O-CB 3.42Å; L81-L84 PolarHBondContact O-N 3.15Å; L81-L84 VanDerWaalsContact O-N 3.15Å; L84-V86 VanDerWaalsContact C-N 3.31Å; L84-V86 PolarHBondContact O-N 2.87Å; L84-L87 HydrophobicContact CD2-CD1 4.23Å; L84-L87 PolarHBondContact O-N 3.42Å; L84-Y88 HydrophobicContact CB-CD2 4.15Å; L84-Y88 HydrophobicContact CB-CE2 3.73Å; L84-Y88 HydrophobicContact CD1-CE2 4.34Å; L84-Y88 HydrophobicContact CD2-CE2 4.47Å; L84-Y88 HydrophobicContact CG-CE2 4.41Å; L84-Y88 VanDerWaalsContact O-CB 3.28Å; L84-Y88 WeakPolarHBondContact O-CB 3.32Å; L84-Y88 WeakPolarHBondContact O-CD2 3.46Å; L84-Y88 PolarHBondContact O-N 2.61Å
85	Q	96	Very high	93.8	Very high	8 Å²	8	46.8 Å²	46.8	4%	0.037	26%	0.264	C	S	.	.	H	α-helix	trans	-60	-42.3	173.1	-56.7	-179.4	12.7	0	0	111.9	L81 H82 Q83 Y88 K89 P401 T402 C427 V430	L81-Q85 PolarHBondContact O-N 2.79Å; H82-Q85 WeakPolarHBondContact O-CB 3.38Å; H82-Q85 PolarHBondContact O-N 3.39Å; Q83-Q85 PolarHBondContact O-N 3.02Å; Q85-Y88 PolarHBondContact O-N 3.4Å; Q85-K89 VanDerWaalsContact O-CB 3.29Å; Q85-K89 WeakPolarHBondContact O-CB 3.49Å; Q85-K89 PolarHBondContact O-N 2.63Å; Q85-P401 PolarHBondContact NE2-O 2.8Å; Q85-T402 PolarHBondContact NE2-OG1 3.29Å; Q85-C427 HydrophobicContact CB-CB 4.25Å; Q85-C427 HydrophobicContact CG-CB 4.05Å; Q85-C427 VanDerWaalsContact OE1-CA 3.29Å; Q85-C427 VanDerWaalsContact OE1-CB 3.27Å; Q85-C427 PolarHBondContact OE1-O 3.11Å; Q85-V430 HydrophobicContact CB-CB 4.21Å; Q85-V430 HydrophobicContact CB-CG1 4.15Å
86	V	95.9	Very high	94.1	Very high	64 Å²	64	42.1 Å²	42.1	39%	0.388	24%	0.242	S	C	.	.	H	α-helix	trans	-63.2	-49.6	178.1	-177.8	0	0	0	0	110.3	Q83 L84 Y88 K89 A90 Y429 V430	Q83-V86 WeakPolarHBondContact O-CB 3.3Å; Q83-V86 PolarHBondContact O-N 2.83Å; Q83-V86 VanDerWaalsContact O-N 3.09Å; L84-V86 VanDerWaalsContact C-N 3.31Å; L84-V86 PolarHBondContact O-N 2.87Å; V86-Y88 VanDerWaalsContact C-N 3.34Å; V86-Y88 PolarHBondContact O-N 3.11Å; V86-K89 PolarHBondContact O-N 3.19Å; V86-A90 WeakPolarHBondContact O-CB 3.37Å; V86-A90 PolarHBondContact O-N 3.4Å; V86-Y429 HydrophobicContact CG2-CD1 4.04Å; V86-Y429 HydrophobicContact CG2-CE1 3.83Å; V86-V430 HydrophobicContact CG2-CG2 4.32Å
87	L	95.9	Very high	94.5	Very high	74 Å²	74	40.3 Å²	40.3	39%	0.387	22%	0.223	S	C	.	.	H	α-helix	trans	-62.2	-41.1	179.4	-67.5	174.9	0	0	0	112.3	Y77 Q83 L84 K91	Y77-L87 HydrophobicContact CE1-CD1 3.85Å; Y77-L87 WeakPolarHBondContact OH-CD1 3.43Å; Q83-L87 PolarHBondContact O-N 2.76Å; Q83-L87 VanDerWaalsContact O-N 3.08Å; L84-L87 HydrophobicContact CD2-CD1 4.23Å; L84-L87 PolarHBondContact O-N 3.42Å; L87-K91 WeakPolarHBondContact O-CB 3.41Å; L87-K91 PolarHBondContact O-N 3.49Å; L87-K91 VanDerWaalsContact O-N 3.09Å
88	Y	96.8	Very high	94.7	Very high	11 Å²	11	38.7 Å²	38.7	4%	0.043	22%	0.218	C	C	.	.	H	α-helix	trans	-75.1	-38.7	-179	-63.3	-23.9	0	0	0	112.5	L63 F68 Q71 L84 Q85 V86 A90 K91 Y92 W96	L63-Y88 HydrophobicContact CD1-CD1 4.34Å; L63-Y88 HydrophobicContact CD1-CE1 3.71Å; L63-Y88 HydrophobicContact CD1-CE2 4.4Å; L63-Y88 HydrophobicContact CD2-CD2 4.08Å; L63-Y88 HydrophobicContact CD2-CE1 4.29Å; L63-Y88 HydrophobicContact CD2-CE2 3.46Å; L63-Y88 VanDerWaalsContact CD2-CE2 3.46Å; F68-Y88 HydrophobicContact CD2-CE2 4.3Å; F68-Y88 WeakPolarHBondContact CD2-OH 3.47Å; Q71-Y88 VanDerWaalsContact OE1-CE1 3.28Å; Q71-Y88 PolarHBondContact OE1-OH 2.78Å; L84-Y88 HydrophobicContact CB-CD2 4.15Å; L84-Y88 HydrophobicContact CB-CE2 3.73Å; L84-Y88 HydrophobicContact CD1-CE2 4.34Å; L84-Y88 HydrophobicContact CD2-CE2 4.47Å; L84-Y88 HydrophobicContact CG-CE2 4.41Å; L84-Y88 VanDerWaalsContact O-CB 3.28Å; L84-Y88 WeakPolarHBondContact O-CB 3.32Å; L84-Y88 WeakPolarHBondContact O-CD2 3.46Å; L84-Y88 PolarHBondContact O-N 2.61Å; Q85-Y88 PolarHBondContact O-N 3.4Å; V86-Y88 VanDerWaalsContact C-N 3.34Å; V86-Y88 PolarHBondContact O-N 3.11Å; Y88-A90 VanDerWaalsContact C-N 3.33Å; Y88-A90 PolarHBondContact O-N 3.39Å; Y88-K91 PolarHBondContact O-N 3.24Å; Y88-Y92 HydrophobicContact CD1-CD2 4.35Å; Y88-Y92 AromaticContact CD1-CE2 3.92Å; Y88-Y92 HydrophobicContact CD1-CE2 3.92Å; Y88-Y92 HydrophobicContact CG-CD2 4.42Å; Y88-Y92 HydrophobicContact CG-CE2 4.36Å; Y88-Y92 WeakPolarHBondContact O-CB 3.3Å; Y88-Y92 WeakPolarHBondContact O-CD2 3.35Å; Y88-Y92 PolarHBondContact O-N 2.94Å; Y88-W96 HydrophobicContact CD2-CZ2 4.16Å; Y88-W96 HydrophobicContact CG-CZ2 4.39Å
89	K	96.9	Very high	94.9	Very high	40 Å²	40	41.2 Å²	41.2	17%	0.174	22%	0.224	C	C	.	.	H	α-helix	trans	-59.7	-45.7	171.5	-176.3	-176.7	-177.8	162.1	0	111.1	Q85 V86 K91 G93 W96 A109 V430 D434	Q85-K89 VanDerWaalsContact O-CB 3.29Å; Q85-K89 WeakPolarHBondContact O-CB 3.49Å; Q85-K89 PolarHBondContact O-N 2.63Å; V86-K89 PolarHBondContact O-N 3.19Å; K89-K91 VanDerWaalsContact C-N 3.28Å; K89-K91 PolarHBondContact O-N 3.46Å; K89-G93 WeakPolarHBondContact CA-O 3.21Å; K89-G93 VanDerWaalsContact O-CA 3.24Å; K89-G93 WeakPolarHBondContact O-CA 3.41Å; K89-G93 PolarHBondContact O-N 3Å; K89-W96 HydrophobicContact CB-CZ3 4.36Å; K89-A109 HydrophobicContact CB-CB 4.15Å; K89-A109 HydrophobicContact CD-CB 3.99Å; K89-A109 VanDerWaalsContact CE-O 3.31Å; K89-A109 WeakPolarHBondContact CE-O 3.22Å; K89-A109 HydrophobicContact CG-CB 3.99Å; K89-A109 PolarHBondContact NZ-O 3.13Å; K89-V430 HydrophobicContact CB-CG1 4.49Å; K89-V430 HydrophobicContact CB-CG2 4.12Å; K89-V430 HydrophobicContact CD-CB 4.29Å; K89-V430 HydrophobicContact CD-CG1 3.97Å; K89-V430 HydrophobicContact CD-CG2 3.32Å; K89-V430 HydrophobicContact CG-CG2 4.35Å; K89-D434 IonicContact NZ-OD2 3.96Å; K89-D434 PolarHBondContact NZ-OD2 3.3Å
90	A	96.6	Very high	94.7	Very high	89 Å²	89	40.1 Å²	40.1	74%	0.736	22%	0.219	S	C	*	.	H	α-helix	trans	-62.1	-35.9	178.6	0	0	0	0	0	112.6	V86 Y88	V86-A90 WeakPolarHBondContact O-CB 3.37Å; V86-A90 PolarHBondContact O-N 3.4Å; Y88-A90 VanDerWaalsContact C-N 3.33Å; Y88-A90 PolarHBondContact O-N 3.39Å
91	K	96.2	Very high	94.2	Very high	111 Å²	111	38.9 Å²	38.9	48%	0.483	22%	0.224	S	C	.	.	H	α-helix	trans	-83.5	-42	-178	177.7	168.6	173.2	153.7	0	114.1	L87 Y88 K89	L87-K91 WeakPolarHBondContact O-CB 3.41Å; L87-K91 PolarHBondContact O-N 3.49Å; L87-K91 VanDerWaalsContact O-N 3.09Å; Y88-K91 PolarHBondContact O-N 3.24Å; K89-K91 VanDerWaalsContact C-N 3.28Å; K89-K91 PolarHBondContact O-N 3.46Å
92	Y	96.8	Very high	93.6	Very high	36 Å²	36	43.7 Å²	43.7	14%	0.141	26%	0.258	C	S	.	.	H	α-helix	trans	-111.4	-7.3	-167.9	-58.6	-62.4	0	0	0	113.4	P61 L63 Y88 W96	P61-Y92 HydrophobicContact CB-CD1 3.43Å; P61-Y92 VanDerWaalsContact CB-CD1 3.43Å; P61-Y92 HydrophobicContact CB-CE1 4.19Å; P61-Y92 HydrophobicContact CB-CG 4.03Å; P61-Y92 HydrophobicContact CG-CD1 4.34Å; L63-Y92 HydrophobicContact CB-CE2 4.49Å; L63-Y92 HydrophobicContact CD1-CE2 4.19Å; Y88-Y92 HydrophobicContact CD1-CD2 4.35Å; Y88-Y92 AromaticContact CD1-CE2 3.92Å; Y88-Y92 HydrophobicContact CD1-CE2 3.92Å; Y88-Y92 HydrophobicContact CG-CD2 4.42Å; Y88-Y92 HydrophobicContact CG-CE2 4.36Å; Y88-Y92 WeakPolarHBondContact O-CB 3.3Å; Y88-Y92 WeakPolarHBondContact O-CD2 3.35Å; Y88-Y92 PolarHBondContact O-N 2.94Å; Y92-W96 HydrophobicContact CD2-CB 4.28Å; Y92-W96 HydrophobicContact CD2-CG 4.14Å; Y92-W96 HydrophobicContact CG-CB 4.1Å; Y92-W96 HydrophobicContact CG-CG 4.44Å
93	G	96.6	Very high	93.2	Very high	26 Å²	26	46.5 Å²	46.5	27%	0.268	27%	0.271	S	S	.	.			trans	83.9	-161.2	-175.9	0	0	0	0	0	112.9	K89 M95	K89-G93 WeakPolarHBondContact CA-O 3.21Å; K89-G93 VanDerWaalsContact O-CA 3.24Å; K89-G93 WeakPolarHBondContact O-CA 3.41Å; K89-G93 PolarHBondContact O-N 3Å; G93-M95 PolarHBondContact O-N 2.99Å
94	P	97	Very high	93	Very high	62 Å²	62	45.8 Å²	45.8	40%	0.403	27%	0.268	S	S	.	.	S	Bend	trans	-74.9	-9.2	-170.3	31.6	-36.9	0	0	0	114.2	A109 L113	P94-A109 PolarHBondContact O-N 3.39Å; P94-L113 HydrophobicContact CB-CD1 3.95Å; P94-L113 HydrophobicContact CG-CD1 4.45Å; P94-L113 WeakPolarHBondContact O-CD1 3.49Å
95	M	98.1	Very high	93	Very high	11 Å²	11	46.4 Å²	46.4	5%	0.054	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	131	-179	-173.8	-175.3	-63.8	0	0	111.3	I60 G93 V106 N107 L108 L113 V413 D414 F416 F418	I60-M95 HydrophobicContact CD1-SD 3.78Å; I60-M95 HydrophobicContact CG1-SD 4.31Å; I60-M95 HydrophobicContact CG2-CG 4.29Å; G93-M95 PolarHBondContact O-N 2.99Å; M95-V106 HydrophobicContact CG-CG1 4Å; M95-V106 HydrophobicContact SD-CG1 4.22Å; M95-N107 WeakPolarHBondContact CA-O 3.47Å; M95-L108 HydrophobicContact CE-CD2 3.86Å; M95-L108 HydrophobicContact CG-CD2 3.97Å; M95-L108 HydrophobicContact SD-CD2 4.5Å; M95-L113 HydrophobicContact CB-CD1 4.09Å; M95-L113 HydrophobicContact CE-CD1 3.92Å; M95-L113 HydrophobicContact CE-CD2 3.76Å; M95-L113 HydrophobicContact CE-CG 4.42Å; M95-V413 HydrophobicContact CE-CG1 3.9Å; M95-D414 HydrophobicContact CE-CB 4.05Å; M95-F416 HydrophobicContact SD-CD2 4.22Å; M95-F416 HydrophobicContact SD-CE2 4.36Å; M95-F418 HydrophobicContact SD-CE2 4.47Å; M95-F418 HydrophobicContact SD-CZ 3.9Å
96	W	97.9	Very high	93.1	Very high	3 Å²	3	46 Å²	46	1%	0.011	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	155.7	172.5	69.5	92.8	0	0	0	112.3	Y88 K89 Y92 N107 A109	Y88-W96 HydrophobicContact CD2-CZ2 4.16Å; Y88-W96 HydrophobicContact CG-CZ2 4.39Å; K89-W96 HydrophobicContact CB-CZ3 4.36Å; Y92-W96 HydrophobicContact CD2-CB 4.28Å; Y92-W96 HydrophobicContact CD2-CG 4.14Å; Y92-W96 HydrophobicContact CG-CB 4.1Å; Y92-W96 HydrophobicContact CG-CG 4.44Å; W96-N107 HydrophobicContact CD2-CB 3.68Å; W96-N107 HydrophobicContact CE3-CB 4.19Å; W96-N107 HydrophobicContact CG-CB 4.17Å; W96-N107 HydrophobicContact CH2-CB 3.94Å; W96-N107 HydrophobicContact CZ2-CB 3.39Å; W96-N107 HydrophobicContact CZ3-CB 4.31Å; W96-N107 PolarHBondContact N-O 3.01Å; W96-N107 VanDerWaalsContact N-O 3.16Å; W96-N107 PolarHBondContact NE1-ND2 3.26Å; W96-N107 VanDerWaalsContact NE1-ND2 3.16Å; W96-N107 PolarHBondContact O-N 3.48Å; W96-N107 PolarHBondContact O-ND2 2.9Å; W96-A109 HydrophobicContact CH2-CB 3.98Å; W96-A109 HydrophobicContact CZ3-CB 3.58Å
97	M	97	Very high	93.2	Very high	5 Å²	5	43.8 Å²	43.8	3%	0.025	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	140.4	175.4	-68.3	-178.9	-59.6	0	0	111.4	L57 I60 P61 R62 L63 M104 H105 V106	L57-M97 WeakPolarHBondContact O-CE 3.47Å; I60-M97 HydrophobicContact CB-CE 3.83Å; I60-M97 HydrophobicContact CB-CG 4.4Å; I60-M97 HydrophobicContact CB-SD 4.44Å; I60-M97 HydrophobicContact CG2-CE 4.18Å; I60-M97 HydrophobicContact CG2-CG 3.83Å; I60-M97 HydrophobicContact CG2-SD 4.49Å; I60-M97 WeakPolarHBondContact O-CE 3.08Å; P61-M97 PolarHBondContact O-N 3.41Å; R62-M97 CarbonylContact C-O 3.59Å; R62-M97 WeakPolarHBondContact CA-O 3.24Å; R62-M97 HydrophobicContact CG-CB 4.34Å; R62-M97 HydrophobicContact CG-CE 3.79Å; L63-M97 PolarHBondContact N-O 3.47Å; M97-M104 HydrophobicContact CG-SD 4.15Å; M97-M104 HydrophobicContact SD-SD 4.19Å; M97-H105 CarbonylContact C-O 3.55Å; M97-H105 VanDerWaalsContact CA-O 3.31Å; M97-H105 WeakPolarHBondContact CA-O 3.45Å; M97-V106 HydrophobicContact CG-CG2 4.45Å
98	S	94.4	Very high	93.3	Very high	14 Å²	14	40.2 Å²	40.2	10%	0.098	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	161.3	171.3	60.3	0	0	0	0	110.3	H105 N107	S98-H105 PolarHBondContact N-O 3.35Å; S98-H105 PolarHBondContact O-N 2.79Å; S98-N107 PolarHBondContact OG-ND2 2.89Å
99	Y	89.6	Confident	93.4	Very high	70 Å²	70	39.7 Å²	39.7	28%	0.275	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	134.4	177	-64.9	-93.9	0	0	0	110.3	Q103 M104	Y99-Q103 WeakPolarHBondContact CA-O 3.28Å; Y99-M104 HydrophobicContact CD1-CB 4.04Å; Y99-M104 HydrophobicContact CD1-CG 4.36Å; Y99-M104 HydrophobicContact CE1-CB 3.73Å; Y99-M104 HydrophobicContact CE1-CG 3.79Å
100	L	82.2	Confident	93.4	Very high	48 Å²	48	38.6 Å²	38.6	25%	0.251	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	106.8	168.3	-177.4	61.5	0	0	0	107.4	Q103 T255 F256	L100-Q103 PolarHBondContact N-O 2.9Å; L100-Q103 PolarHBondContact O-N 2.98Å; L100-Q103 VanDerWaalsContact O-N 3.12Å; L100-T255 HydrophobicContact CD2-CG2 4.14Å; L100-F256 HydrophobicContact CD1-CD1 3.56Å; L100-F256 HydrophobicContact CD1-CE1 3.76Å; L100-F256 HydrophobicContact CD2-CE1 4.23Å
101	G	79.3	Confident	93.4	Very high	42 Å²	42	34.4 Å²	34.4	43%	0.433	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.6	-130.7	-167.9	0	0	0	0	0	111.2	Q65 Q103	Q65-G101 PolarHBondContact NE2-O 3.29Å; G101-Q103 VanDerWaalsContact C-N 3.31Å
102	P	79.6	Confident	93.5	Very high	139 Å²	139	32 Å²	32	90%	0.903	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-13.1	177.9	33.7	-34.9	0	0	0	113.4
103	Q	84.5	Confident	93.5	Very high	60 Å²	60	30.6 Å²	30.6	28%	0.28	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	132.7	-171.2	-163.8	174.2	9.4	0	0	111.7	Y99 L100 G101	Y99-Q103 WeakPolarHBondContact CA-O 3.28Å; L100-Q103 PolarHBondContact N-O 2.9Å; L100-Q103 PolarHBondContact O-N 2.98Å; L100-Q103 VanDerWaalsContact O-N 3.12Å; G101-Q103 VanDerWaalsContact C-N 3.31Å
104	M	90.8	Very high	93.5	Very high	44 Å²	44	29.3 Å²	29.3	22%	0.217	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	132.5	175.7	-174	-80.7	-66.6	0	0	110.2	M97 Y99 V106 T422	M97-M104 HydrophobicContact CG-SD 4.15Å; M97-M104 HydrophobicContact SD-SD 4.19Å; Y99-M104 HydrophobicContact CD1-CB 4.04Å; Y99-M104 HydrophobicContact CD1-CG 4.36Å; Y99-M104 HydrophobicContact CE1-CB 3.73Å; Y99-M104 HydrophobicContact CE1-CG 3.79Å; M104-V106 HydrophobicContact CE-CG2 3.97Å; M104-V106 HydrophobicContact SD-CG2 3.59Å; M104-V106 VanDerWaalsContact SD-CG2 3.59Å; M104-T422 HydrophobicContact CE-CG2 3.91Å
105	H	95.1	Very high	93.5	Very high	18 Å²	18	28.4 Å²	28.4	8%	0.083	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	135	176.5	-60.2	153.7	0	0	0	110.7	M97 S98 Q423 V425	M97-H105 CarbonylContact C-O 3.55Å; M97-H105 VanDerWaalsContact CA-O 3.31Å; M97-H105 WeakPolarHBondContact CA-O 3.45Å; S98-H105 PolarHBondContact N-O 3.35Å; S98-H105 PolarHBondContact O-N 2.79Å; H105-Q423 WeakPolarHBondContact CA-O 3.25Å; H105-Q423 PolarHBondContact NE2-NE2 3.35Å; H105-V425 HydrophobicContact CB-CG2 3.85Å
106	V	97.7	Very high	93.5	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	107.7	171.7	-174.5	0	0	0	0	108.4	M95 M97 M104 L108 F418 T422 Q423 F424 V425	M95-V106 HydrophobicContact CG-CG1 4Å; M95-V106 HydrophobicContact SD-CG1 4.22Å; M97-V106 HydrophobicContact CG-CG2 4.45Å; M104-V106 HydrophobicContact CE-CG2 3.97Å; M104-V106 HydrophobicContact SD-CG2 3.59Å; M104-V106 VanDerWaalsContact SD-CG2 3.59Å; V106-L108 HydrophobicContact CG1-CD2 3.93Å; V106-F418 HydrophobicContact CB-CE1 4.32Å; V106-F418 HydrophobicContact CG1-CE1 3.9Å; V106-F418 HydrophobicContact CG1-CZ 3.92Å; V106-F418 HydrophobicContact CG2-CD1 3.87Å; V106-F418 HydrophobicContact CG2-CE1 3.49Å; V106-F418 VanDerWaalsContact CG2-CE1 3.49Å; V106-F418 HydrophobicContact CG2-CZ 4.35Å; V106-T422 HydrophobicContact CB-CG2 4.43Å; V106-T422 HydrophobicContact CG2-CG2 3.54Å; V106-Q423 PolarHBondContact N-O 2.89Å; V106-F424 HydrophobicContact CB-CD1 3.65Å; V106-F424 HydrophobicContact CB-CE1 3.9Å; V106-F424 HydrophobicContact CB-CG 4.42Å; V106-F424 HydrophobicContact CG1-CD1 3.8Å; V106-F424 HydrophobicContact CG1-CE1 3.85Å; V106-F424 HydrophobicContact CG2-CD1 4.37Å; V106-F424 HydrophobicContact CG2-CE1 4.21Å; V106-F424 CarbonylContact O-C 3.6Å; V106-F424 VanDerWaalsContact O-CA 3.3Å; V106-F424 WeakPolarHBondContact O-CA 3.26Å; V106-V425 PolarHBondContact O-N 2.81Å
107	N	98.2	Very high	93.4	Very high	16 Å²	16	31.2 Å²	31.2	9%	0.086	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	130.5	-177.9	-56.6	-92.6	0	0	0	109.8	M95 W96 S98 V425	M95-N107 WeakPolarHBondContact CA-O 3.47Å; W96-N107 HydrophobicContact CD2-CB 3.68Å; W96-N107 HydrophobicContact CE3-CB 4.19Å; W96-N107 HydrophobicContact CG-CB 4.17Å; W96-N107 HydrophobicContact CH2-CB 3.94Å; W96-N107 HydrophobicContact CZ2-CB 3.39Å; W96-N107 HydrophobicContact CZ3-CB 4.31Å; W96-N107 PolarHBondContact N-O 3.01Å; W96-N107 VanDerWaalsContact N-O 3.16Å; W96-N107 PolarHBondContact NE1-ND2 3.26Å; W96-N107 VanDerWaalsContact NE1-ND2 3.16Å; W96-N107 PolarHBondContact O-N 3.48Å; W96-N107 PolarHBondContact O-ND2 2.9Å; S98-N107 PolarHBondContact OG-ND2 2.89Å; N107-V425 CarbonylContact C-O 3.57Å; N107-V425 WeakPolarHBondContact CA-O 3.22Å
108	L	98.3	Very high	93.4	Very high	0 Å²	0	31 Å²	31	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	125.2	-177.3	-51.9	-176.9	0	0	0	109.8	M95 V106 L113 L114 V117 F424 V425 F426 C427	M95-L108 HydrophobicContact CE-CD2 3.86Å; M95-L108 HydrophobicContact CG-CD2 3.97Å; M95-L108 HydrophobicContact SD-CD2 4.5Å; V106-L108 HydrophobicContact CG1-CD2 3.93Å; L108-L113 HydrophobicContact CB-CB 4.24Å; L108-L113 HydrophobicContact CD1-CB 4.26Å; L108-L113 HydrophobicContact CD2-CB 4.27Å; L108-L113 HydrophobicContact CD2-CD1 4.33Å; L108-L114 HydrophobicContact CB-CD1 3.61Å; L108-L114 WeakPolarHBondContact O-CD1 3.43Å; L108-V117 HydrophobicContact CD1-CB 4.25Å; L108-V117 HydrophobicContact CD1-CG2 3.59Å; L108-F424 HydrophobicContact CD1-CB 4.29Å; L108-F424 HydrophobicContact CD1-CD1 3.96Å; L108-F424 HydrophobicContact CD2-CD1 4.28Å; L108-F424 HydrophobicContact CG-CD1 4.28Å; L108-V425 PolarHBondContact N-O 3.38Å; L108-F426 HydrophobicContact CB-CD1 4.43Å; L108-F426 HydrophobicContact CD1-CD1 3.95Å; L108-F426 HydrophobicContact CD1-CE1 3.82Å; L108-F426 HydrophobicContact CG-CD1 4.47Å; L108-C427 VanDerWaalsContact O-CB 3.31Å; L108-C427 WeakPolarHBondContact O-CB 3.31Å; L108-C427 PolarHBondContact O-N 2.92Å
109	A	97.8	Very high	93.4	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.199	C	C	.	.			trans	-126.9	23	-171.7	0	0	0	0	0	113.7	K89 P94 W96 C427 V430 V431	K89-A109 HydrophobicContact CB-CB 4.15Å; K89-A109 HydrophobicContact CD-CB 3.99Å; K89-A109 VanDerWaalsContact CE-O 3.31Å; K89-A109 WeakPolarHBondContact CE-O 3.22Å; K89-A109 HydrophobicContact CG-CB 3.99Å; K89-A109 PolarHBondContact NZ-O 3.13Å; P94-A109 PolarHBondContact O-N 3.39Å; W96-A109 HydrophobicContact CH2-CB 3.98Å; W96-A109 HydrophobicContact CZ3-CB 3.58Å; A109-C427 HydrophobicContact CB-CB 4.16Å; A109-V430 HydrophobicContact CB-CG1 3.64Å; A109-V431 VanDerWaalsContact C-CG2 3.43Å
110	S	97.3	Very high	93.6	Very high	17 Å²	17	36.8 Å²	36.8	12%	0.119	20%	0.198	C	C	.	.	S	Bend	trans	-138.7	148.7	171.4	70.6	0	0	0	0	111.9	L113 L114	S110-L113 PolarHBondContact O-N 3.28Å; S110-L113 VanDerWaalsContact OG-CD1 3.32Å; S110-L113 WeakPolarHBondContact OG-CD1 3.23Å; S110-L113 WeakPolarHBondContact OG-CG 3.31Å; S110-L114 VanDerWaalsContact O-CD1 3.26Å; S110-L114 WeakPolarHBondContact O-CD1 3.5Å; S110-L114 PolarHBondContact O-N 2.99Å
111	A	97	Very high	94	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-60.8	-40	-176.4	0	0	0	0	0	114.3	L113 L114 E115 V431 H462 F464	A111-L113 VanDerWaalsContact C-N 3.34Å; A111-L113 PolarHBondContact O-N 2.84Å; A111-L114 PolarHBondContact O-N 3.36Å; A111-E115 PolarHBondContact O-N 3.42Å; A111-V431 HydrophobicContact CB-CG1 4.09Å; A111-H462 HydrophobicContact CB-CB 3.91Å; A111-H462 WeakPolarHBondContact CB-ND1 3.19Å; A111-H462 PolarHBondContact O-CE1 3.27Å; A111-F464 HydrophobicContact CB-CB 4.22Å
112	P	97.3	Very high	94.5	Very high	61 Å²	61	36.3 Å²	36.3	40%	0.396	20%	0.196	S	C	.	.	H	α-helix	trans	-63.2	-36.4	176.9	-24.6	35.5	0	0	0	113.5	E115 Q116	P112-E115 PolarHBondContact O-N 3.44Å; P112-Q116 WeakPolarHBondContact O-CG 3.19Å; P112-Q116 PolarHBondContact O-N 3.03Å
113	L	97.7	Very high	95.1	Very high	6 Å²	6	35.7 Å²	35.7	3%	0.031	18%	0.179	C	C	.	.	H	α-helix	trans	-70.2	-41.5	178.1	-63.9	178	0	0	0	111.7	P94 M95 L108 S110 A111 E115 Q116 V117 V413 D414	P94-L113 HydrophobicContact CB-CD1 3.95Å; P94-L113 HydrophobicContact CG-CD1 4.45Å; P94-L113 WeakPolarHBondContact O-CD1 3.49Å; M95-L113 HydrophobicContact CB-CD1 4.09Å; M95-L113 HydrophobicContact CE-CD1 3.92Å; M95-L113 HydrophobicContact CE-CD2 3.76Å; M95-L113 HydrophobicContact CE-CG 4.42Å; L108-L113 HydrophobicContact CB-CB 4.24Å; L108-L113 HydrophobicContact CD1-CB 4.26Å; L108-L113 HydrophobicContact CD2-CB 4.27Å; L108-L113 HydrophobicContact CD2-CD1 4.33Å; S110-L113 PolarHBondContact O-N 3.28Å; S110-L113 VanDerWaalsContact OG-CD1 3.32Å; S110-L113 WeakPolarHBondContact OG-CD1 3.23Å; S110-L113 WeakPolarHBondContact OG-CG 3.31Å; A111-L113 VanDerWaalsContact C-N 3.34Å; A111-L113 PolarHBondContact O-N 2.84Å; L113-E115 VanDerWaalsContact C-N 3.3Å; L113-E115 PolarHBondContact O-N 2.98Å; L113-Q116 PolarHBondContact O-N 3.47Å; L113-V117 PolarHBondContact O-N 3.22Å; L113-V413 HydrophobicContact CD2-CG1 3.97Å; L113-D414 HydrophobicContact CD2-CB 3.7Å
114	L	97.2	Very high	95.7	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-57.4	-46.5	173.7	-93.3	65.3	0	0	0	110.5	L108 S110 A111 V117 M118 F426 V431	L108-L114 HydrophobicContact CB-CD1 3.61Å; L108-L114 WeakPolarHBondContact O-CD1 3.43Å; S110-L114 VanDerWaalsContact O-CD1 3.26Å; S110-L114 WeakPolarHBondContact O-CD1 3.5Å; S110-L114 PolarHBondContact O-N 2.99Å; A111-L114 PolarHBondContact O-N 3.36Å; L114-V117 PolarHBondContact O-N 3.12Å; L114-M118 VanDerWaalsContact O-CB 3.31Å; L114-M118 WeakPolarHBondContact O-CB 3.39Å; L114-M118 VanDerWaalsContact O-CG 3.26Å; L114-M118 WeakPolarHBondContact O-CG 3.43Å; L114-M118 PolarHBondContact O-N 3.33Å; L114-F426 HydrophobicContact CD1-CB 4.31Å; L114-F426 HydrophobicContact CD1-CD1 4.25Å; L114-F426 HydrophobicContact CD2-CB 4.07Å; L114-F426 HydrophobicContact CG-CB 3.99Å; L114-F426 HydrophobicContact CG-CD1 3.97Å; L114-F426 HydrophobicContact CG-CG 4.03Å; L114-V431 HydrophobicContact CD1-CG2 4.02Å; L114-V431 HydrophobicContact CD2-CG1 4.29Å; L114-V431 HydrophobicContact CD2-CG2 4.11Å
115	E	97	Very high	95.9	Very high	43 Å²	43	33.6 Å²	33.6	20%	0.201	17%	0.167	C	C	.	.	H	α-helix	trans	-60.1	-48.4	177.8	177.9	168.5	-150.2	0	0	112.5	A111 P112 L113 V117 M118 R119 H462 F464	A111-E115 PolarHBondContact O-N 3.42Å; P112-E115 PolarHBondContact O-N 3.44Å; L113-E115 VanDerWaalsContact C-N 3.3Å; L113-E115 PolarHBondContact O-N 2.98Å; E115-V117 VanDerWaalsContact C-N 3.27Å; E115-V117 PolarHBondContact O-N 3.5Å; E115-M118 PolarHBondContact O-N 3.44Å; E115-R119 HydrophobicContact CG-CG 4.05Å; E115-R119 WeakPolarHBondContact O-CB 3.49Å; E115-R119 WeakPolarHBondContact O-CG 3.23Å; E115-R119 PolarHBondContact O-N 2.97Å; E115-R119 IonicContact OE1-CZ 3.55Å; E115-R119 IonicContact OE1-NE 2.63Å; E115-R119 PolarHBondContact OE1-NE 3.45Å; E115-R119 IonicContact OE1-NH2 3.36Å; E115-R119 PolarHBondContact OE1-NH2 2.93Å; E115-H462 IonicContact OE2-CE1 3.45Å; E115-H462 PolarHBondContact OE2-CE1 2.61Å; E115-H462 IonicContact OE2-NE2 2.92Å; E115-H462 PolarHBondContact OE2-NE2 3.44Å; E115-H462 VanDerWaalsContact OE2-NE2 3.13Å; E115-F464 HydrophobicContact CB-CB 4.41Å; E115-F464 HydrophobicContact CB-CD1 4.28Å; E115-F464 HydrophobicContact CB-CD2 3.54Å; E115-F464 HydrophobicContact CB-CE1 4.45Å; E115-F464 HydrophobicContact CB-CE2 3.75Å; E115-F464 HydrophobicContact CB-CG 3.83Å; E115-F464 HydrophobicContact CB-CZ 4.21Å; E115-F464 HydrophobicContact CG-CD2 3.73Å; E115-F464 HydrophobicContact CG-CE2 3.47Å; E115-F464 VanDerWaalsContact CG-CE2 3.47Å; E115-F464 HydrophobicContact CG-CG 4.47Å; E115-F464 HydrophobicContact CG-CZ 4.01Å
116	Q	97.3	Very high	95.8	Very high	72 Å²	72	33.4 Å²	33.4	34%	0.336	17%	0.167	S	C	.	.	H	α-helix	trans	-55.7	-42.5	179.9	-76.3	177.4	34.5	0	0	112	P112 L113 Q120 V413	P112-Q116 WeakPolarHBondContact O-CG 3.19Å; P112-Q116 PolarHBondContact O-N 3.03Å; L113-Q116 PolarHBondContact O-N 3.47Å; Q116-Q120 VanDerWaalsContact O-CG 3.28Å; Q116-Q120 WeakPolarHBondContact O-CG 3.48Å; Q116-Q120 PolarHBondContact O-NE2 2.95Å; Q116-V413 HydrophobicContact CB-CG1 4.23Å
117	V	97.1	Very high	95.6	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-73.3	-48.8	177.7	176.5	0	0	0	0	111.6	L108 L113 L114 E115 R119 Q120 E121 I407 I411 V413 F424 F426	L108-V117 HydrophobicContact CD1-CB 4.25Å; L108-V117 HydrophobicContact CD1-CG2 3.59Å; L113-V117 PolarHBondContact O-N 3.22Å; L114-V117 PolarHBondContact O-N 3.12Å; E115-V117 VanDerWaalsContact C-N 3.27Å; E115-V117 PolarHBondContact O-N 3.5Å; V117-R119 VanDerWaalsContact C-N 3.27Å; V117-R119 PolarHBondContact O-N 2.89Å; V117-Q120 PolarHBondContact O-N 3.32Å; V117-E121 PolarHBondContact O-N 2.71Å; V117-I407 HydrophobicContact CG1-CD1 3.87Å; V117-I407 HydrophobicContact CG1-CG1 3.99Å; V117-I411 HydrophobicContact CG1-CD1 4.42Å; V117-I411 HydrophobicContact CG2-CD1 4.18Å; V117-V413 HydrophobicContact CG2-CG1 4.19Å; V117-V413 HydrophobicContact CG2-CG2 3.64Å; V117-F424 HydrophobicContact CG1-CB 3.99Å; V117-F424 HydrophobicContact CG1-CD2 3.96Å; V117-F424 HydrophobicContact CG1-CG 3.93Å; V117-F424 HydrophobicContact CG2-CB 4.5Å; V117-F424 HydrophobicContact CG2-CD1 3.8Å; V117-F424 HydrophobicContact CG2-CD2 4.42Å; V117-F424 HydrophobicContact CG2-CE1 4.05Å; V117-F424 HydrophobicContact CG2-CG 3.98Å; V117-F424 HydrophobicContact CG2-CZ 4.45Å; V117-F426 HydrophobicContact CB-CE1 4.04Å; V117-F426 HydrophobicContact CB-CZ 4.2Å; V117-F426 HydrophobicContact CG1-CE1 3.84Å; V117-F426 HydrophobicContact CG1-CZ 3.72Å
118	M	95.2	Very high	95.1	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-64	-30.8	-176.2	-73.4	-176.1	179.2	0	0	112.8	L114 E115 Q120 E121 F426 F464 V467 Y471	L114-M118 VanDerWaalsContact O-CB 3.31Å; L114-M118 WeakPolarHBondContact O-CB 3.39Å; L114-M118 VanDerWaalsContact O-CG 3.26Å; L114-M118 WeakPolarHBondContact O-CG 3.43Å; L114-M118 PolarHBondContact O-N 3.33Å; E115-M118 PolarHBondContact O-N 3.44Å; M118-Q120 VanDerWaalsContact C-N 3.29Å; M118-E121 VanDerWaalsContact O-CG 3.27Å; M118-E121 WeakPolarHBondContact O-CG 3.19Å; M118-F426 HydrophobicContact CE-CD2 3.18Å; M118-F426 HydrophobicContact CE-CE2 3.3Å; M118-F426 HydrophobicContact CE-CG 4.03Å; M118-F426 HydrophobicContact CE-CZ 4.19Å; M118-F426 HydrophobicContact CG-CE2 3.81Å; M118-F426 HydrophobicContact CG-CZ 3.94Å; M118-F426 HydrophobicContact SD-CE2 4.39Å; M118-F464 HydrophobicContact CB-CE1 3.92Å; M118-F464 HydrophobicContact CG-CE1 4.34Å; M118-F464 HydrophobicContact SD-CD1 3.66Å; M118-F464 HydrophobicContact SD-CE1 3.5Å; M118-F464 VanDerWaalsContact SD-CE1 3.5Å; M118-V467 HydrophobicContact CE-CG2 4.39Å; M118-Y471 HydrophobicContact CB-CD1 3.79Å; M118-Y471 HydrophobicContact CB-CE1 4.24Å; M118-Y471 HydrophobicContact CB-CG 4.49Å; M118-Y471 HydrophobicContact CG-CD1 4.46Å; M118-Y471 VanDerWaalsContact SD-CB 3.57Å; M118-Y471 HydrophobicContact SD-CD1 4.27Å; M118-Y471 HydrophobicContact SD-CG 4.12Å
119	R	94.8	Very high	94.5	Very high	149 Å²	149	40.2 Å²	40.2	56%	0.562	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-18.3	175	-72.3	-170.4	-179.1	-73.8	-1.9	113.9	E115 V117	E115-R119 HydrophobicContact CG-CG 4.05Å; E115-R119 WeakPolarHBondContact O-CB 3.49Å; E115-R119 WeakPolarHBondContact O-CG 3.23Å; E115-R119 PolarHBondContact O-N 2.97Å; E115-R119 IonicContact OE1-CZ 3.55Å; E115-R119 IonicContact OE1-NE 2.63Å; E115-R119 PolarHBondContact OE1-NE 3.45Å; E115-R119 IonicContact OE1-NH2 3.36Å; E115-R119 PolarHBondContact OE1-NH2 2.93Å; V117-R119 VanDerWaalsContact C-N 3.27Å; V117-R119 PolarHBondContact O-N 2.89Å
120	Q	94.7	Very high	94.2	Very high	56 Å²	56	41.5 Å²	41.5	26%	0.262	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	5.5	178.8	-67	-178.2	81.7	0	0	112.6	Q116 V117 M118 K409 I411 E412	Q116-Q120 VanDerWaalsContact O-CG 3.28Å; Q116-Q120 WeakPolarHBondContact O-CG 3.48Å; Q116-Q120 PolarHBondContact O-NE2 2.95Å; V117-Q120 PolarHBondContact O-N 3.32Å; M118-Q120 VanDerWaalsContact C-N 3.29Å; Q120-K409 WeakPolarHBondContact O-CE 3.47Å; Q120-K409 PolarHBondContact O-NZ 3Å; Q120-I411 HydrophobicContact CB-CG2 3.98Å; Q120-E412 PolarHBondContact NE2-O 3.45Å
121	E	89.9	Confident	93.9	Very high	36 Å²	36	46 Å²	46	17%	0.168	23%	0.225	C	C	.	.			trans	-63	149.2	178.6	77.7	-178.5	-174.4	0	0	112.5	V117 M118 P125 R405 G472	V117-E121 PolarHBondContact O-N 2.71Å; M118-E121 VanDerWaalsContact O-CG 3.27Å; M118-E121 WeakPolarHBondContact O-CG 3.19Å; E121-P125 HydrophobicContact CB-CG 4.42Å; E121-P125 HydrophobicContact CG-CG 4.05Å; E121-R405 IonicContact OE2-CZ 2.93Å; E121-R405 IonicContact OE2-NE 3.76Å; E121-R405 PolarHBondContact OE2-NE 3.32Å; E121-R405 VanDerWaalsContact OE2-NE 3.11Å; E121-R405 IonicContact OE2-NH2 3.94Å; E121-G472 WeakPolarHBondContact OE1-CA 3.3Å
122	G	90.4	Very high	93.6	Very high	45 Å²	45	47.3 Å²	47.3	46%	0.464	23%	0.231	S	C	.	.			trans	-81.1	-177.8	177.3	0	0	0	0	0	113.1	Y124 P125	G122-Y124 PolarHBondContact O-N 3.49Å; G122-P125 WeakPolarHBondContact O-CD 3.26Å
123	K	92.3	Very high	93.5	Very high	125 Å²	125	46 Å²	46	54%	0.543	22%	0.219	S	C	.	.	S	Bend	trans	-61.9	-30.8	178.3	-172.3	-179.4	173.3	-163.8	0	113.2	P125	K123-P125 WeakPolarHBondContact O-CD 3.36Å
124	Y	95.6	Very high	93.5	Very high	56 Å²	56	47.7 Å²	47.7	22%	0.22	23%	0.226	C	C	.	.	S	Bend	trans	-120	75	-178.8	-45.7	-53.4	0	0	0	109.8	G122 V126 Y155	G122-Y124 PolarHBondContact O-N 3.49Å; Y124-V126 PolarHBondContact O-N 3.25Å; Y124-Y155 HydrophobicContact CD1-CD2 4.15Å; Y124-Y155 AromaticContact CD1-CG 3.97Å; Y124-Y155 HydrophobicContact CD1-CG 3.97Å; Y124-Y155 HydrophobicContact CE1-CD1 4.12Å; Y124-Y155 HydrophobicContact CE1-CD2 4.14Å; Y124-Y155 AromaticContact CE1-CG 3.7Å; Y124-Y155 HydrophobicContact CE1-CG 3.7Å
125	P	95.1	Very high	93.4	Very high	5 Å²	5	50.1 Å²	50.1	3%	0.032	24%	0.237	C	C	.	.			trans	-60.3	131	-176.7	-21	32	0	0	0	110.8	E121 G122 K123 V473 R474	E121-P125 HydrophobicContact CB-CG 4.42Å; E121-P125 HydrophobicContact CG-CG 4.05Å; G122-P125 WeakPolarHBondContact O-CD 3.26Å; K123-P125 WeakPolarHBondContact O-CD 3.36Å; P125-V473 VanDerWaalsContact CD-CG2 3.41Å; P125-V473 HydrophobicContact CG-CG2 3.55Å; P125-R474 HydrophobicContact CB-CB 4.18Å; P125-R474 HydrophobicContact CG-CB 4.38Å; P125-R474 WeakPolarHBondContact O-CD 3.34Å; P125-R474 PolarHBondContact O-NH1 3.42Å
126	V	94.7	Very high	93.3	Very high	14 Å²	14	48 Å²	48	9%	0.085	23%	0.227	C	C	.	.	B	Isolated β-bridge	trans	-102.3	132.8	175.1	179.2	0	0	0	0	108.2	Y124 N128 E150 R405 I406	Y124-V126 PolarHBondContact O-N 3.25Å; V126-N128 WeakPolarHBondContact CG1-O 3.04Å; V126-E150 WeakPolarHBondContact CG2-OE2 3.36Å; V126-R405 CarbonylContact O-C 3.49Å; V126-R405 VanDerWaalsContact O-CA 3.26Å; V126-R405 WeakPolarHBondContact O-CA 3.31Å; V126-I406 HydrophobicContact CB-CB 4.19Å; V126-I406 HydrophobicContact CG1-CB 4.2Å; V126-I406 HydrophobicContact CG1-CD1 3.98Å; V126-I406 HydrophobicContact CG1-CG1 4.32Å; V126-I406 PolarHBondContact O-N 2.99Å
127	R	92	Very high	93.2	Very high	58 Å²	58	44.6 Å²	44.6	22%	0.219	21%	0.211	C	C	.	.			trans	-80.5	-60.9	178.7	-71.5	-175.9	179.9	170.3	2.1	110.9	S404 R405 R474	R127-S404 VanDerWaalsContact CA-O 3.32Å; R127-S404 WeakPolarHBondContact CA-O 3.42Å; R127-S404 CarbonylContact O-C 3.58Å; R127-S404 VanDerWaalsContact O-C 3.23Å; R127-S404 VanDerWaalsContact O-CB 3.32Å; R127-S404 WeakPolarHBondContact O-CB 3.26Å; R127-S404 PolarHBondContact O-OG 3.14Å; R127-R405 PolarHBondContact O-N 2.9Å; R127-R474 PolarHBondContact NH2-O 2.71Å
128	N	89.2	Confident	93.2	Very high	46 Å²	46	49.2 Å²	49.2	25%	0.246	24%	0.236	C	C	.	.			trans	-154.3	-174.2	171.4	59.5	28.3	0	0	0	106.4	V126 M130	V126-N128 WeakPolarHBondContact CG1-O 3.04Å; N128-M130 PolarHBondContact O-N 3.02Å; N128-M130 WeakPolarHBondContact OD1-CA 3.4Å; N128-M130 WeakPolarHBondContact OD1-CG 3.22Å; N128-M130 PolarHBondContact OD1-N 3.48Å; N128-M130 PolarHBondContact OD1-SD 3.02Å
129	D	84.2	Confident	93.2	Very high	55 Å²	55	54.1 Å²	54.1	29%	0.294	26%	0.261	S	S	.	.			trans	-68.9	-17.9	180	58.1	28	0	0	0	114.5	E131 K134	D129-E131 HydrophobicContact CB-CG 3.88Å; D129-E131 VanDerWaalsContact CG-CG 3.5Å; D129-E131 PolarHBondContact O-N 3.43Å; D129-E131 VanDerWaalsContact O-N 3.1Å; D129-E131 PolarHBondContact OD1-N 2.96Å; D129-K134 WeakPolarHBondContact O-CD 3.23Å; D129-K134 VanDerWaalsContact O-CE 3.28Å; D129-K134 WeakPolarHBondContact O-CE 3.36Å; D129-K134 PolarHBondContact O-NZ 3.46Å
130	M	91.4	Very high	93.1	Very high	26 Å²	26	51 Å²	51	13%	0.128	25%	0.253	C	S	.	.			trans	46.5	30.1	-170	-62.7	-69.7	-62	0	0	113.2	N128 L132 W133 K134 F147 T148	N128-M130 PolarHBondContact O-N 3.02Å; N128-M130 WeakPolarHBondContact OD1-CA 3.4Å; N128-M130 WeakPolarHBondContact OD1-CG 3.22Å; N128-M130 PolarHBondContact OD1-N 3.48Å; N128-M130 PolarHBondContact OD1-SD 3.02Å; M130-L132 VanDerWaalsContact C-N 3.29Å; M130-L132 PolarHBondContact O-N 2.79Å; M130-W133 HydrophobicContact CE-CB 4.19Å; M130-W133 HydrophobicContact CE-CD2 3.36Å; M130-W133 HydrophobicContact CE-CE3 3.37Å; M130-W133 HydrophobicContact CE-CG 3.75Å; M130-W133 HydrophobicContact CE-CH2 4.38Å; M130-W133 HydrophobicContact CE-CZ2 4.37Å; M130-W133 HydrophobicContact CE-CZ3 3.91Å; M130-W133 PolarHBondContact O-N 3.24Å; M130-K134 PolarHBondContact O-N 2.91Å; M130-F147 HydrophobicContact CE-CB 4.06Å; M130-F147 WeakPolarHBondContact CG-O 3.22Å; M130-T148 HydrophobicContact CB-CG2 4.4Å
131	E	91.1	Very high	93.1	Very high	112 Å²	112	54.1 Å²	54.1	52%	0.523	27%	0.272	S	S	.	.	H	α-helix	trans	-54.5	-45	-172.6	-88.8	-173	-172.2	0	0	112	D129 W133 K134 E135	D129-E131 HydrophobicContact CB-CG 3.88Å; D129-E131 VanDerWaalsContact CG-CG 3.5Å; D129-E131 PolarHBondContact O-N 3.43Å; D129-E131 VanDerWaalsContact O-N 3.1Å; D129-E131 PolarHBondContact OD1-N 2.96Å; E131-W133 PolarHBondContact O-N 2.66Å; E131-K134 PolarHBondContact O-N 2.7Å; E131-E135 WeakPolarHBondContact O-CB 3Å; E131-E135 PolarHBondContact O-N 2.87Å
132	L	92.5	Very high	93.3	Very high	27 Å²	27	54.4 Å²	54.4	14%	0.141	27%	0.274	C	S	.	.	H	α-helix	trans	-59.7	-34.8	-178.2	176.8	59.8	0	0	0	112.6	M130 A254 T255 W268 Y271	M130-L132 VanDerWaalsContact C-N 3.29Å; M130-L132 PolarHBondContact O-N 2.79Å; L132-A254 HydrophobicContact CD1-CB 3.64Å; L132-A254 HydrophobicContact CD2-CB 4.02Å; L132-T255 WeakPolarHBondContact CD2-OG1 3.37Å; L132-W268 HydrophobicContact CD1-CH2 4.19Å; L132-W268 HydrophobicContact CD1-CZ3 3.61Å; L132-Y271 HydrophobicContact CD1-CD1 4.43Å; L132-Y271 HydrophobicContact CD1-CE1 3.73Å; L132-Y271 HydrophobicContact CD1-CE2 4.42Å; L132-Y271 HydrophobicContact CD2-CE2 4.36Å; L132-Y271 HydrophobicContact CG-CE1 4.24Å; L132-Y271 HydrophobicContact CG-CE2 4.26Å; L132-Y271 WeakPolarHBondContact CG-OH 3.03Å; L132-Y271 PolarHBondContact O-OH 3.21Å
133	W	95	Very high	93.5	Very high	35 Å²	35	53.7 Å²	53.7	13%	0.133	26%	0.261	C	S	.	.	H	α-helix	trans	-81.7	-43.1	178.7	-70.7	24.7	0	0	0	110.3	M130 E131 E135 H136 R137 F147 T148 W275 M334	M130-W133 HydrophobicContact CE-CB 4.19Å; M130-W133 HydrophobicContact CE-CD2 3.36Å; M130-W133 HydrophobicContact CE-CE3 3.37Å; M130-W133 HydrophobicContact CE-CG 3.75Å; M130-W133 HydrophobicContact CE-CH2 4.38Å; M130-W133 HydrophobicContact CE-CZ2 4.37Å; M130-W133 HydrophobicContact CE-CZ3 3.91Å; M130-W133 PolarHBondContact O-N 3.24Å; E131-W133 PolarHBondContact O-N 2.66Å; W133-E135 VanDerWaalsContact C-N 3.26Å; W133-E135 PolarHBondContact O-N 2.81Å; W133-H136 PolarHBondContact O-N 2.89Å; W133-H136 VanDerWaalsContact O-N 3.17Å; W133-R137 WeakPolarHBondContact O-CD 3.41Å; W133-R137 PolarHBondContact O-N 2.87Å; W133-R137 PolarHBondContact O-NE 2.99Å; W133-F147 HydrophobicContact CE3-CB 4.23Å; W133-F147 HydrophobicContact CZ3-CB 4.02Å; W133-F147 HydrophobicContact CZ3-CD2 4.4Å; W133-F147 HydrophobicContact CZ3-CG 4.12Å; W133-T148 HydrophobicContact CB-CG2 3.61Å; W133-W275 AromaticContact CD2-CH2 3.92Å; W133-W275 HydrophobicContact CD2-CH2 3.92Å; W133-W275 AromaticContact CD2-CZ2 3.51Å; W133-W275 HydrophobicContact CD2-CZ2 3.51Å; W133-W275 AromaticContact CE2-CZ2 3.56Å; W133-W275 AromaticContact CE3-CH2 3.73Å; W133-W275 HydrophobicContact CE3-CH2 3.73Å; W133-W275 AromaticContact CE3-CZ2 3.85Å; W133-W275 HydrophobicContact CE3-CZ2 3.85Å; W133-W275 AromaticContact CG-CZ2 3.91Å; W133-W275 HydrophobicContact CG-CZ2 3.91Å; W133-W275 HydrophobicContact CH2-CH2 4.02Å; W133-W275 HydrophobicContact CH2-CZ2 4.25Å; W133-W275 HydrophobicContact CZ2-CH2 4.18Å; W133-W275 AromaticContact CZ2-CZ2 3.94Å; W133-W275 HydrophobicContact CZ2-CZ2 3.94Å; W133-W275 AromaticContact CZ3-CH2 3.79Å; W133-W275 HydrophobicContact CZ3-CH2 3.79Å; W133-W275 HydrophobicContact CZ3-CZ2 4.2Å; W133-W275 AromaticContact NE1-CZ2 3.88Å; W133-M334 HydrophobicContact CH2-CE 3.76Å; W133-M334 HydrophobicContact CH2-SD 4.37Å; W133-M334 HydrophobicContact CZ3-CE 3.91Å
134	K	95.9	Very high	93.6	Very high	40 Å²	40	51.4 Å²	51.4	17%	0.174	25%	0.249	C	C	.	.	H	α-helix	trans	-56.3	-40.2	174.9	-71.5	174.2	176.8	165.7	0	112.4	D129 M130 E131 H136 R137 D138 Y144 T148	D129-K134 WeakPolarHBondContact O-CD 3.23Å; D129-K134 VanDerWaalsContact O-CE 3.28Å; D129-K134 WeakPolarHBondContact O-CE 3.36Å; D129-K134 PolarHBondContact O-NZ 3.46Å; M130-K134 PolarHBondContact O-N 2.91Å; E131-K134 PolarHBondContact O-N 2.7Å; K134-H136 VanDerWaalsContact C-N 3.25Å; K134-H136 PolarHBondContact O-N 3.42Å; K134-R137 WeakPolarHBondContact O-CA 3.13Å; K134-R137 WeakPolarHBondContact O-CB 3.32Å; K134-R137 PolarHBondContact O-N 3.23Å; K134-D138 PolarHBondContact O-N 2.9Å; K134-Y144 HydrophobicContact CB-CE1 4.28Å; K134-Y144 HydrophobicContact CD-CE2 3.96Å; K134-Y144 HydrophobicContact CG-CD2 4.41Å; K134-Y144 HydrophobicContact CG-CE1 4.22Å; K134-Y144 HydrophobicContact CG-CE2 3.88Å; K134-T148 WeakPolarHBondContact CE-O 3.3Å; K134-T148 HydrophobicContact CG-CG2 4.07Å
135	E	95.2	Very high	93.6	Very high	51 Å²	51	48.8 Å²	48.8	24%	0.238	24%	0.239	C	C	.	.	H	α-helix	trans	-57.3	-37.2	178.9	-176.1	170	-161.5	0	0	112.5	E131 W133 L139 R262 W268	E131-E135 WeakPolarHBondContact O-CB 3Å; E131-E135 PolarHBondContact O-N 2.87Å; W133-E135 VanDerWaalsContact C-N 3.26Å; W133-E135 PolarHBondContact O-N 2.81Å; E135-L139 HydrophobicContact CG-CD1 4.3Å; E135-L139 WeakPolarHBondContact O-CB 3.48Å; E135-L139 WeakPolarHBondContact O-CD1 3.09Å; E135-L139 WeakPolarHBondContact O-CG 3.48Å; E135-L139 PolarHBondContact O-N 3.43Å; E135-L139 VanDerWaalsContact O-N 3.17Å; E135-R262 IonicContact OE1-CZ 2.68Å; E135-R262 IonicContact OE1-NH1 2.72Å; E135-R262 PolarHBondContact OE1-NH1 3.5Å; E135-R262 IonicContact OE2-CZ 3.15Å; E135-R262 VanDerWaalsContact OE2-CZ 3.26Å; E135-R262 IonicContact OE2-NH1 3.02Å; E135-R262 PolarHBondContact OE2-NH1 3.41Å; E135-R262 IonicContact OE2-NH2 3.13Å; E135-R262 PolarHBondContact OE2-NH2 3.35Å; E135-W268 HydrophobicContact CG-CH2 4.08Å; E135-W268 HydrophobicContact CG-CZ2 4.21Å; E135-W268 WeakPolarHBondContact OE2-CH2 3.41Å
136	H	95.7	Very high	93.6	Very high	0 Å²	0	49 Å²	49	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-65.9	-40.6	172.5	167.1	-96.3	0	0	0	111.8	W133 K134 L139 H140 L272 W275 N276 F279	W133-H136 PolarHBondContact O-N 2.89Å; W133-H136 VanDerWaalsContact O-N 3.17Å; K134-H136 VanDerWaalsContact C-N 3.25Å; K134-H136 PolarHBondContact O-N 3.42Å; H136-L139 PolarHBondContact O-N 3.26Å; H136-H140 AromaticContact CD2-CD2 3.46Å; H136-H140 PolarHBondContact CD2-CD2 3.44Å; H136-H140 VanDerWaalsContact CD2-CD2 3.46Å; H136-H140 AromaticContact CD2-NE2 3.88Å; H136-H140 AromaticContact NE2-CD2 3.38Å; H136-H140 PolarHBondContact NE2-CD2 3.21Å; H136-H140 AromaticContact NE2-NE2 3.86Å; H136-H140 PolarHBondContact O-CD2 3.37Å; H136-H140 PolarHBondContact O-N 3.46Å; H136-L272 HydrophobicContact CB-CD2 4.26Å; H136-W275 HydrophobicContact CB-CG 4.46Å; H136-W275 VanDerWaalsContact CD2-CB 3.47Å; H136-W275 WeakPolarHBondContact CD2-CB 3.44Å; H136-W275 AromaticContact CG-CG 3.93Å; H136-W275 WeakPolarHBondContact NE2-CB 3.22Å; H136-N276 PolarHBondContact NE2-OD1 2.87Å; H136-F279 AromaticContact CE1-CD2 3.76Å
137	R	95.9	Very high	93.5	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-67.4	-44.7	-176.1	-76.3	38	152.2	175.3	-2.9	109.6	W133 K134 L139 H140 D141 L142 Y144 W275 E331	W133-R137 WeakPolarHBondContact O-CD 3.41Å; W133-R137 PolarHBondContact O-N 2.87Å; W133-R137 PolarHBondContact O-NE 2.99Å; K134-R137 WeakPolarHBondContact O-CA 3.13Å; K134-R137 WeakPolarHBondContact O-CB 3.32Å; K134-R137 PolarHBondContact O-N 3.23Å; R137-L139 PolarHBondContact O-N 3.24Å; R137-H140 CarbonylContact O-C 3.48Å; R137-H140 PolarHBondContact O-N 2.85Å; R137-H140 VanDerWaalsContact O-N 3.15Å; R137-D141 PolarHBondContact O-N 3.08Å; R137-L142 HydrophobicContact CB-CB 4.23Å; R137-L142 HydrophobicContact CG-CB 4.31Å; R137-L142 PolarHBondContact O-N 3.11Å; R137-Y144 HydrophobicContact CB-CD1 3.72Å; R137-Y144 HydrophobicContact CB-CE1 3.61Å; R137-Y144 HydrophobicContact CG-CD1 3.94Å; R137-Y144 HydrophobicContact CG-CE1 4.3Å; R137-W275 VanDerWaalsContact NH1-CE3 3.28Å; R137-E331 IonicContact CZ-OE1 2.89Å; R137-E331 IonicContact NE-OE1 3.8Å; R137-E331 PolarHBondContact NE-OE1 2.93Å; R137-E331 IonicContact NH2-OE1 2.82Å; R137-E331 PolarHBondContact NH2-OE1 3.44Å
138	D	96.4	Very high	93.7	Very high	97 Å²	97	47.8 Å²	47.8	52%	0.519	24%	0.236	S	C	.	.	H	α-helix	trans	-62.6	-41.4	178.6	-59.5	-23	0	0	0	111.8	K134 H140 Y144	K134-D138 PolarHBondContact O-N 2.9Å; D138-H140 PolarHBondContact O-N 3.07Å; D138-Y144 VanDerWaalsContact CG-OH 3.32Å; D138-Y144 VanDerWaalsContact OD1-CE1 3.26Å; D138-Y144 WeakPolarHBondContact OD1-CE1 3.49Å; D138-Y144 VanDerWaalsContact OD1-CZ 3.31Å; D138-Y144 PolarHBondContact OD1-OH 2.95Å; D138-Y144 PolarHBondContact OD2-OH 3.36Å
139	L	95.2	Very high	94	Very high	103 Å²	103	46.4 Å²	46.4	54%	0.539	23%	0.229	S	C	.	.	H	α-helix	trans	-64.4	-21.5	177.4	-75.2	171	0	0	0	113.6	E135 H136 R137 W268 L272	E135-L139 HydrophobicContact CG-CD1 4.3Å; E135-L139 WeakPolarHBondContact O-CB 3.48Å; E135-L139 WeakPolarHBondContact O-CD1 3.09Å; E135-L139 WeakPolarHBondContact O-CG 3.48Å; E135-L139 PolarHBondContact O-N 3.43Å; E135-L139 VanDerWaalsContact O-N 3.17Å; H136-L139 PolarHBondContact O-N 3.26Å; R137-L139 PolarHBondContact O-N 3.24Å; L139-W268 HydrophobicContact CD1-CZ2 4.45Å; L139-L272 HydrophobicContact CD1-CD1 4.45Å; L139-L272 HydrophobicContact CD1-CD2 4.23Å
140	H	92.9	Very high	94.5	Very high	83 Å²	83	45.8 Å²	45.8	38%	0.384	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.7	9.8	-174	-70.8	-79	0	0	0	113.4	H136 R137 D138 L142 N276	H136-H140 AromaticContact CD2-CD2 3.46Å; H136-H140 PolarHBondContact CD2-CD2 3.44Å; H136-H140 VanDerWaalsContact CD2-CD2 3.46Å; H136-H140 AromaticContact CD2-NE2 3.88Å; H136-H140 AromaticContact NE2-CD2 3.38Å; H136-H140 PolarHBondContact NE2-CD2 3.21Å; H136-H140 AromaticContact NE2-NE2 3.86Å; H136-H140 PolarHBondContact O-CD2 3.37Å; H136-H140 PolarHBondContact O-N 3.46Å; R137-H140 CarbonylContact O-C 3.48Å; R137-H140 PolarHBondContact O-N 2.85Å; R137-H140 VanDerWaalsContact O-N 3.15Å; D138-H140 PolarHBondContact O-N 3.07Å; H140-L142 HydrophobicContact CB-CD1 3.82Å; H140-L142 HydrophobicContact CB-CG 3.86Å; H140-L142 PolarHBondContact O-N 3.15Å; H140-N276 PolarHBondContact CE1-OD1 3.39Å; H140-N276 VanDerWaalsContact CE1-OD1 3.3Å; H140-N276 PolarHBondContact NE2-OD1 2.84Å; H140-N276 VanDerWaalsContact NE2-OD1 3.07Å
141	D	93.9	Very high	94.6	Very high	123 Å²	123	45.6 Å²	45.6	66%	0.658	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.8	32.5	-175.9	-168.2	37.6	0	0	0	114	R137 R323	R137-D141 PolarHBondContact O-N 3.08Å; D141-R323 VanDerWaalsContact CG-NH2 3.26Å; D141-R323 PolarHBondContact O-NH2 3.43Å; D141-R323 IonicContact OD1-NH2 2.73Å; D141-R323 PolarHBondContact OD1-NH2 3.03Å; D141-R323 IonicContact OD2-NH2 3.15Å; D141-R323 PolarHBondContact OD2-NH2 3.46Å; D141-R323 VanDerWaalsContact OD2-NH2 3.15Å
142	L	94.3	Very high	94.8	Very high	42 Å²	42	44.7 Å²	44.7	22%	0.22	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-86.1	143.1	178.2	-62.2	170.1	0	0	0	110.4	R137 H140 F279	R137-L142 HydrophobicContact CB-CB 4.23Å; R137-L142 HydrophobicContact CG-CB 4.31Å; R137-L142 PolarHBondContact O-N 3.11Å; H140-L142 HydrophobicContact CB-CD1 3.82Å; H140-L142 HydrophobicContact CB-CG 3.86Å; H140-L142 PolarHBondContact O-N 3.15Å; L142-F279 HydrophobicContact CD1-CB 4.31Å; L142-F279 HydrophobicContact CD1-CD1 3.66Å; L142-F279 HydrophobicContact CD1-CD2 4.38Å; L142-F279 HydrophobicContact CD1-CE1 4Å; L142-F279 HydrophobicContact CD1-CG 3.85Å; L142-F279 HydrophobicContact CD2-CD1 4.33Å; L142-F279 HydrophobicContact CG-CD1 4.5Å
143	T	94.2	Very high	94.9	Very high	30 Å²	30	49.9 Å²	49.9	18%	0.184	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-68.4	153.6	171.8	47.7	0	0	0	0	111.1	R323 G327	T143-R323 HydrophobicContact CG2-CB 4.4Å; T143-R323 HydrophobicContact CG2-CG 3.62Å; T143-R323 PolarHBondContact OG1-O 3.39Å; T143-G327 WeakPolarHBondContact O-CA 3.49Å; T143-G327 WeakPolarHBondContact OG1-CA 3.47Å; T143-G327 PolarHBondContact OG1-N 2.84Å; T143-G327 VanDerWaalsContact OG1-N 3.11Å
144	Y	96	Very high	94.9	Very high	77 Å²	77	48.2 Å²	48.2	30%	0.302	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-77.8	144.2	174.8	-65.6	-4.6	0	0	0	110.9	K134 R137 D138 T148 T149	K134-Y144 HydrophobicContact CB-CE1 4.28Å; K134-Y144 HydrophobicContact CD-CE2 3.96Å; K134-Y144 HydrophobicContact CG-CD2 4.41Å; K134-Y144 HydrophobicContact CG-CE1 4.22Å; K134-Y144 HydrophobicContact CG-CE2 3.88Å; R137-Y144 HydrophobicContact CB-CD1 3.72Å; R137-Y144 HydrophobicContact CB-CE1 3.61Å; R137-Y144 HydrophobicContact CG-CD1 3.94Å; R137-Y144 HydrophobicContact CG-CE1 4.3Å; D138-Y144 VanDerWaalsContact CG-OH 3.32Å; D138-Y144 VanDerWaalsContact OD1-CE1 3.26Å; D138-Y144 WeakPolarHBondContact OD1-CE1 3.49Å; D138-Y144 VanDerWaalsContact OD1-CZ 3.31Å; D138-Y144 PolarHBondContact OD1-OH 2.95Å; D138-Y144 PolarHBondContact OD2-OH 3.36Å; Y144-T148 WeakPolarHBondContact CA-OG1 3.46Å; Y144-T148 WeakPolarHBondContact CB-OG1 3.39Å; Y144-T149 VanDerWaalsContact CB-OG1 3.3Å; Y144-T149 WeakPolarHBondContact CB-OG1 3.12Å; Y144-T149 PolarHBondContact O-OG1 3.39Å
145	G	95.4	Very high	94.9	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.245	C	C	.	.			trans	-99.7	-169.3	176.6	0	0	0	0	0	112.8	F147 T148 T149 G327 E331	G145-F147 PolarHBondContact O-N 2.94Å; G145-T148 PolarHBondContact N-OG1 3.06Å; G145-T148 PolarHBondContact O-N 3.33Å; G145-T148 PolarHBondContact O-OG1 3.25Å; G145-T149 VanDerWaalsContact O-CB 3.26Å; G145-T149 WeakPolarHBondContact O-CB 3.34Å; G145-T149 PolarHBondContact O-N 2.82Å; G145-T149 PolarHBondContact O-OG1 2.9Å; G145-G327 VanDerWaalsContact CA-O 3.23Å; G145-G327 WeakPolarHBondContact CA-O 3.26Å; G145-E331 VanDerWaalsContact C-OE2 3.31Å; G145-E331 VanDerWaalsContact CA-OE2 3.31Å; G145-E331 WeakPolarHBondContact CA-OE2 3.43Å
146	P	94.4	Very high	94.8	Very high	9 Å²	9	51.4 Å²	51.4	6%	0.058	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-18.4	-175.3	25.8	-34.4	0	0	0	114.3	W154 L157 L161 E331 L332	P146-W154 PolarHBondContact O-NE1 3.1Å; P146-L157 HydrophobicContact CB-CD2 4.47Å; P146-L161 HydrophobicContact CB-CD1 3.91Å; P146-L161 HydrophobicContact CG-CD1 4.05Å; P146-E331 WeakPolarHBondContact CD-OE2 3.47Å; P146-L332 HydrophobicContact CG-CD2 3.75Å; P146-L332 HydrophobicContact CG-CG 4.16Å
147	F	93.4	Very high	94.8	Very high	47 Å²	47	52.3 Å²	52.3	21%	0.206	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-35.3	174.5	-65.3	-88.7	0	0	0	112.3	M130 W133 G145 E331 A335	M130-F147 HydrophobicContact CE-CB 4.06Å; M130-F147 WeakPolarHBondContact CG-O 3.22Å; W133-F147 HydrophobicContact CE3-CB 4.23Å; W133-F147 HydrophobicContact CZ3-CB 4.02Å; W133-F147 HydrophobicContact CZ3-CD2 4.4Å; W133-F147 HydrophobicContact CZ3-CG 4.12Å; G145-F147 PolarHBondContact O-N 2.94Å; F147-E331 WeakPolarHBondContact CB-OE2 3.38Å; F147-E331 HydrophobicContact CD2-CB 3.94Å; F147-E331 WeakPolarHBondContact CD2-OE2 3.34Å; F147-E331 HydrophobicContact CE2-CB 4.35Å; F147-E331 PolarHBondContact N-OE2 3.3Å; F147-E331 VanDerWaalsContact N-OE2 3.08Å; F147-A335 HydrophobicContact CE2-CB 3.89Å; F147-A335 HydrophobicContact CZ-CB 3.72Å
148	T	95.2	Very high	94.7	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-22	-173.7	40.2	0	0	0	0	113.3	M130 W133 K134 Y144 G145 E331	M130-T148 HydrophobicContact CB-CG2 4.4Å; W133-T148 HydrophobicContact CB-CG2 3.61Å; K134-T148 WeakPolarHBondContact CE-O 3.3Å; K134-T148 HydrophobicContact CG-CG2 4.07Å; Y144-T148 WeakPolarHBondContact CA-OG1 3.46Å; Y144-T148 WeakPolarHBondContact CB-OG1 3.39Å; G145-T148 PolarHBondContact N-OG1 3.06Å; G145-T148 PolarHBondContact O-N 3.33Å; G145-T148 PolarHBondContact O-OG1 3.25Å; T148-E331 WeakPolarHBondContact CG2-OE1 3.39Å; T148-E331 PolarHBondContact OG1-OE1 3.13Å
149	T	95	Very high	94.5	Very high	18 Å²	18	52.6 Å²	52.6	11%	0.11	26%	0.257	C	S	.	.			trans	-78.2	144.1	176.4	-48.9	0	0	0	0	110.9	Y144 G145 H153 W154 R474	Y144-T149 VanDerWaalsContact CB-OG1 3.3Å; Y144-T149 WeakPolarHBondContact CB-OG1 3.12Å; Y144-T149 PolarHBondContact O-OG1 3.39Å; G145-T149 VanDerWaalsContact O-CB 3.26Å; G145-T149 WeakPolarHBondContact O-CB 3.34Å; G145-T149 PolarHBondContact O-N 2.82Å; G145-T149 PolarHBondContact O-OG1 2.9Å; T149-H153 HydrophobicContact CG2-CB 3.81Å; T149-W154 HydrophobicContact CG2-CB 3.93Å; T149-W154 VanDerWaalsContact CG2-N 3.31Å; T149-W154 WeakPolarHBondContact O-CB 3.37Å; T149-W154 VanDerWaalsContact O-CD1 3.31Å; T149-R474 PolarHBondContact O-NH2 3.49Å
150	E	94.4	Very high	94.4	Very high	41 Å²	41	47.9 Å²	47.9	19%	0.192	23%	0.233	C	C	.	.			trans	-129.2	170.6	179.2	-63.1	-58.9	150.7	0	0	112.5	V126 W154 R474	V126-E150 WeakPolarHBondContact CG2-OE2 3.36Å; E150-W154 VanDerWaalsContact C-CB 3.48Å; E150-W154 PolarHBondContact O-N 3.08Å; E150-R474 VanDerWaalsContact CD-NH2 3.31Å; E150-R474 IonicContact OE1-CZ 3.36Å; E150-R474 IonicContact OE1-NH1 3.88Å; E150-R474 IonicContact OE1-NH2 2.63Å; E150-R474 PolarHBondContact OE1-NH2 3.25Å; E150-R474 IonicContact OE2-CZ 2.87Å; E150-R474 IonicContact OE2-NH1 2.99Å; E150-R474 PolarHBondContact OE2-NH1 2.87Å; E150-R474 IonicContact OE2-NH2 2.69Å; E150-R474 PolarHBondContact OE2-NH2 2.99Å
151	G	94.4	Very high	94.3	Very high	22 Å²	22	43.9 Å²	43.9	23%	0.227	22%	0.215	C	C	.	.	H	α-helix	trans	63.4	-142.4	172.6	0	0	0	0	0	115	W154 Y155	G151-W154 PolarHBondContact O-N 2.78Å; G151-Y155 PolarHBondContact O-N 3.28Å
152	H	95.2	Very high	94.2	Very high	93 Å²	93	40.1 Å²	40.1	43%	0.431	20%	0.195	S	C	.	.	H	α-helix	trans	-65.6	-41.7	-177.5	-174.5	-90.5	0	0	0	112.9	W154 Y155 Q156	H152-W154 VanDerWaalsContact C-N 3.3Å; H152-W154 PolarHBondContact O-N 3.29Å; H152-Y155 WeakPolarHBondContact O-CB 3.45Å; H152-Y155 PolarHBondContact O-N 2.89Å; H152-Q156 PolarHBondContact CE1-NE2 3.44Å; H152-Q156 VanDerWaalsContact CE1-NE2 3.35Å; H152-Q156 PolarHBondContact CE1-OE1 2.91Å; H152-Q156 VanDerWaalsContact ND1-CD 3.34Å; H152-Q156 PolarHBondContact ND1-OE1 3.34Å; H152-Q156 PolarHBondContact O-N 2.97Å
153	H	94	Very high	93.7	Very high	136 Å²	136	41.6 Å²	41.6	63%	0.63	20%	0.2	S	C	*	.	H	α-helix	trans	-62.1	-40.2	178.4	-64.2	166.4	0	0	0	111.4	T149 Y155 Q156 L157	T149-H153 HydrophobicContact CG2-CB 3.81Å; H153-Y155 VanDerWaalsContact C-N 3.28Å; H153-Y155 PolarHBondContact O-N 3.01Å; H153-Q156 PolarHBondContact O-N 3.03Å; H153-L157 WeakPolarHBondContact O-CB 3.47Å; H153-L157 PolarHBondContact O-N 3.48Å
154	W	95.8	Very high	93.3	Very high	1 Å²	1	42.6 Å²	42.6	0%	0.004	20%	0.2	C	C	.	.	H	α-helix	trans	-59.2	-42.4	173.1	168.5	80	0	0	0	111.6	P146 T149 E150 G151 H152 L157 R158 V473 R474	P146-W154 PolarHBondContact O-NE1 3.1Å; T149-W154 HydrophobicContact CG2-CB 3.93Å; T149-W154 VanDerWaalsContact CG2-N 3.31Å; T149-W154 WeakPolarHBondContact O-CB 3.37Å; T149-W154 VanDerWaalsContact O-CD1 3.31Å; E150-W154 VanDerWaalsContact C-CB 3.48Å; E150-W154 PolarHBondContact O-N 3.08Å; G151-W154 PolarHBondContact O-N 2.78Å; H152-W154 VanDerWaalsContact C-N 3.3Å; H152-W154 PolarHBondContact O-N 3.29Å; W154-L157 PolarHBondContact O-N 2.75Å; W154-R158 HydrophobicContact CH2-CG 4.3Å; W154-R158 HydrophobicContact CZ2-CB 4.13Å; W154-R158 HydrophobicContact CZ2-CG 3.88Å; W154-R158 WeakPolarHBondContact O-CB 3.49Å; W154-R158 PolarHBondContact O-N 2.98Å; W154-V473 HydrophobicContact CH2-CB 4.36Å; W154-V473 HydrophobicContact CH2-CG2 3.96Å; W154-V473 HydrophobicContact CZ3-CG2 4.32Å; W154-R474 HydrophobicContact CH2-CB 3.87Å; W154-R474 HydrophobicContact CH2-CG 4.11Å; W154-R474 HydrophobicContact CZ2-CB 3.71Å; W154-R474 VanDerWaalsContact CZ2-CD 3.49Å; W154-R474 HydrophobicContact CZ2-CG 3.46Å; W154-R474 VanDerWaalsContact CZ2-CG 3.46Å
155	Y	95.1	Very high	92.9	Very high	62 Å²	62	39.1 Å²	39.1	24%	0.243	19%	0.187	C	C	.	.	H	α-helix	trans	-64.6	-42.7	-179.5	-175.7	-99.5	0	0	0	111.9	Y124 G151 H152 H153 R158 Q159	Y124-Y155 HydrophobicContact CD1-CD2 4.15Å; Y124-Y155 AromaticContact CD1-CG 3.97Å; Y124-Y155 HydrophobicContact CD1-CG 3.97Å; Y124-Y155 HydrophobicContact CE1-CD1 4.12Å; Y124-Y155 HydrophobicContact CE1-CD2 4.14Å; Y124-Y155 AromaticContact CE1-CG 3.7Å; Y124-Y155 HydrophobicContact CE1-CG 3.7Å; G151-Y155 PolarHBondContact O-N 3.28Å; H152-Y155 WeakPolarHBondContact O-CB 3.45Å; H152-Y155 PolarHBondContact O-N 2.89Å; H153-Y155 VanDerWaalsContact C-N 3.28Å; H153-Y155 PolarHBondContact O-N 3.01Å; Y155-R158 PolarHBondContact O-N 3.34Å; Y155-Q159 HydrophobicContact CD1-CG 4.35Å; Y155-Q159 HydrophobicContact CE1-CG 4.01Å; Y155-Q159 VanDerWaalsContact CE1-OE1 3.26Å; Y155-Q159 WeakPolarHBondContact O-CG 3.47Å; Y155-Q159 PolarHBondContact O-N 3.04Å; Y155-Q159 PolarHBondContact OH-NE2 3.22Å
156	Q	94.2	Very high	92.6	Very high	96 Å²	96	41.2 Å²	41.2	45%	0.449	20%	0.198	S	C	.	.	H	α-helix	trans	-62.1	-51	174.8	-69.8	173.4	-61.8	0	0	111.6	H152 H153 R158 Q159 A160	H152-Q156 PolarHBondContact CE1-NE2 3.44Å; H152-Q156 VanDerWaalsContact CE1-NE2 3.35Å; H152-Q156 PolarHBondContact CE1-OE1 2.91Å; H152-Q156 VanDerWaalsContact ND1-CD 3.34Å; H152-Q156 PolarHBondContact ND1-OE1 3.34Å; H152-Q156 PolarHBondContact O-N 2.97Å; H153-Q156 PolarHBondContact O-N 3.03Å; Q156-R158 VanDerWaalsContact C-N 3.26Å; Q156-R158 PolarHBondContact O-N 3.33Å; Q156-Q159 WeakPolarHBondContact O-CB 3.39Å; Q156-Q159 PolarHBondContact O-N 3.08Å; Q156-Q159 VanDerWaalsContact O-N 3.11Å; Q156-A160 PolarHBondContact O-N 2.89Å
157	L	94.4	Very high	92.3	Very high	18 Å²	18	45.3 Å²	45.3	9%	0.094	22%	0.215	C	C	.	.	H	α-helix	trans	-55.9	-44.5	175.4	175.6	58.6	0	0	0	111	P146 H153 W154 Q159 A160 L161 L320	P146-L157 HydrophobicContact CB-CD2 4.47Å; H153-L157 WeakPolarHBondContact O-CB 3.47Å; H153-L157 PolarHBondContact O-N 3.48Å; W154-L157 PolarHBondContact O-N 2.75Å; L157-Q159 VanDerWaalsContact C-N 3.35Å; L157-Q159 PolarHBondContact O-N 3.36Å; L157-A160 PolarHBondContact O-N 3.35Å; L157-L161 HydrophobicContact CD1-CD1 3.83Å; L157-L161 HydrophobicContact CD1-CG 4.01Å; L157-L161 HydrophobicContact CG-CD1 3.9Å; L157-L161 HydrophobicContact CG-CG 4.45Å; L157-L161 VanDerWaalsContact O-CG 3.29Å; L157-L161 WeakPolarHBondContact O-CG 3.22Å; L157-L161 PolarHBondContact O-N 2.95Å; L157-L320 HydrophobicContact CD1-CD2 3.57Å
158	R	94.6	Very high	92	Very high	16 Å²	16	46.7 Å²	46.7	6%	0.06	23%	0.229	C	C	.	.	H	α-helix	trans	-63.1	-40.7	178.8	-177.4	61.6	-174.1	-127.8	-5.7	111.7	W154 Y155 Q156 L161 N162 A475	W154-R158 HydrophobicContact CH2-CG 4.3Å; W154-R158 HydrophobicContact CZ2-CB 4.13Å; W154-R158 HydrophobicContact CZ2-CG 3.88Å; W154-R158 WeakPolarHBondContact O-CB 3.49Å; W154-R158 PolarHBondContact O-N 2.98Å; Y155-R158 PolarHBondContact O-N 3.34Å; Q156-R158 VanDerWaalsContact C-N 3.26Å; Q156-R158 PolarHBondContact O-N 3.33Å; R158-L161 PolarHBondContact O-N 3.02Å; R158-N162 WeakPolarHBondContact CD-OD1 3.4Å; R158-N162 PolarHBondContact NE-OD1 2.8Å; R158-N162 VanDerWaalsContact O-CB 3.25Å; R158-N162 WeakPolarHBondContact O-CB 3.22Å; R158-N162 PolarHBondContact O-N 3.45Å; R158-N162 PolarHBondContact O-ND2 3.32Å; R158-N162 PolarHBondContact O-OD1 2.94Å; R158-A475 PolarHBondContact NH1-O 3.04Å; R158-A475 PolarHBondContact NH2-O 3.06Å
159	Q	92.8	Very high	91.7	Very high	87 Å²	87	50.3 Å²	50.3	41%	0.407	26%	0.259	S	S	.	.	H	α-helix	trans	-63.3	-43	177	-76.6	-177.2	-55.2	0	0	112.1	Y155 Q156 L157	Y155-Q159 HydrophobicContact CD1-CG 4.35Å; Y155-Q159 HydrophobicContact CE1-CG 4.01Å; Y155-Q159 VanDerWaalsContact CE1-OE1 3.26Å; Y155-Q159 WeakPolarHBondContact O-CG 3.47Å; Y155-Q159 PolarHBondContact O-N 3.04Å; Y155-Q159 PolarHBondContact OH-NE2 3.22Å; Q156-Q159 WeakPolarHBondContact O-CB 3.39Å; Q156-Q159 PolarHBondContact O-N 3.08Å; Q156-Q159 VanDerWaalsContact O-N 3.11Å; L157-Q159 VanDerWaalsContact C-N 3.35Å; L157-Q159 PolarHBondContact O-N 3.36Å
160	A	92.3	Very high	91.5	Very high	4 Å²	4	52.5 Å²	52.5	3%	0.033	27%	0.267	C	S	.	.	H	α-helix	trans	-59.3	-53	174.5	0	0	0	0	0	111.1	Q156 L157 N162 Q163 Q319	Q156-A160 PolarHBondContact O-N 2.89Å; L157-A160 PolarHBondContact O-N 3.35Å; A160-N162 VanDerWaalsContact C-N 3.31Å; A160-N162 PolarHBondContact O-N 2.98Å; A160-Q163 PolarHBondContact O-N 3.2Å; A160-Q319 HydrophobicContact CB-CB 4.07Å
161	L	92.3	Very high	91.2	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-66.2	-30	-176.8	-65	173.6	0	0	0	113.7	P146 L157 R158 Q163 Y310 L314 L320 L332 L477	P146-L161 HydrophobicContact CB-CD1 3.91Å; P146-L161 HydrophobicContact CG-CD1 4.05Å; L157-L161 HydrophobicContact CD1-CD1 3.83Å; L157-L161 HydrophobicContact CD1-CG 4.01Å; L157-L161 HydrophobicContact CG-CD1 3.9Å; L157-L161 HydrophobicContact CG-CG 4.45Å; L157-L161 VanDerWaalsContact O-CG 3.29Å; L157-L161 WeakPolarHBondContact O-CG 3.22Å; L157-L161 PolarHBondContact O-N 2.95Å; R158-L161 PolarHBondContact O-N 3.02Å; L161-Q163 VanDerWaalsContact C-N 3.3Å; L161-Q163 PolarHBondContact O-N 3.49Å; L161-Y310 VanDerWaalsContact CA-OH 3.27Å; L161-Y310 WeakPolarHBondContact CA-OH 3.49Å; L161-Y310 VanDerWaalsContact CD2-OH 3.31Å; L161-Y310 WeakPolarHBondContact CD2-OH 3.42Å; L161-Y310 PolarHBondContact O-OH 3.05Å; L161-L314 HydrophobicContact CD2-CD1 4.01Å; L161-L320 HydrophobicContact CD2-CD1 4.06Å; L161-L332 HydrophobicContact CD1-CD1 4.41Å; L161-L332 HydrophobicContact CD2-CD1 4.21Å; L161-L477 HydrophobicContact CB-CD1 4.18Å; L161-L477 HydrophobicContact CB-CD2 3.91Å; L161-L477 HydrophobicContact CD1-CD2 4.07Å
162	N	90.9	Very high	91.1	Very high	44 Å²	44	50.8 Å²	50.8	24%	0.235	26%	0.258	C	S	.	.	H	α-helix	trans	-65	-29.4	-176.8	-80.7	-14.1	0	0	0	113.9	R158 A160 R164 L165 L166 L477	R158-N162 WeakPolarHBondContact CD-OD1 3.4Å; R158-N162 PolarHBondContact NE-OD1 2.8Å; R158-N162 VanDerWaalsContact O-CB 3.25Å; R158-N162 WeakPolarHBondContact O-CB 3.22Å; R158-N162 PolarHBondContact O-N 3.45Å; R158-N162 PolarHBondContact O-ND2 3.32Å; R158-N162 PolarHBondContact O-OD1 2.94Å; A160-N162 VanDerWaalsContact C-N 3.31Å; A160-N162 PolarHBondContact O-N 2.98Å; N162-R164 VanDerWaalsContact C-N 3.34Å; N162-R164 PolarHBondContact O-N 2.81Å; N162-L165 PolarHBondContact O-N 3.28Å; N162-L166 PolarHBondContact O-N 3.22Å; N162-L166 VanDerWaalsContact O-N 3.12Å; N162-L166 WeakPolarHBondContact OD1-CD1 3.21Å; N162-L477 WeakPolarHBondContact OD1-CD1 3.15Å
163	Q	83.5	Confident	91	Very high	72 Å²	72	52.1 Å²	52.1	34%	0.336	27%	0.268	S	S	.	.	H	α-helix	trans	-54.7	-48.7	-164.3	-67.7	-67.1	-18.1	0	0	112	A160 L161 K167 E170 F313	A160-Q163 PolarHBondContact O-N 3.2Å; L161-Q163 VanDerWaalsContact C-N 3.3Å; L161-Q163 PolarHBondContact O-N 3.49Å; Q163-K167 WeakPolarHBondContact O-CD 3.37Å; Q163-K167 WeakPolarHBondContact O-CG 3.44Å; Q163-E170 WeakPolarHBondContact O-CG 3.47Å; Q163-F313 HydrophobicContact CB-CE1 4.3Å
164	R	85.1	Confident	91	Very high	51 Å²	51	46.9 Å²	46.9	19%	0.192	24%	0.243	C	C	.	.	H	α-helix	trans	-99.5	-15.3	-178	-68.1	-171.7	176.9	-156.7	-7.1	115	N162 Y174 G309 Y310 F313	N162-R164 VanDerWaalsContact C-N 3.34Å; N162-R164 PolarHBondContact O-N 2.81Å; R164-Y174 WeakPolarHBondContact O-CE2 3.48Å; R164-G309 PolarHBondContact NH1-O 3.15Å; R164-Y310 HydrophobicContact CB-CD2 3.66Å; R164-Y310 HydrophobicContact CB-CE2 3.86Å; R164-F313 HydrophobicContact CG-CD1 4.17Å; R164-F313 HydrophobicContact CG-CE1 4.29Å; R164-F313 VanDerWaalsContact CZ-CD2 3.46Å
165	L	89.1	Confident	91.1	Very high	5 Å²	5	47 Å²	47	3%	0.026	24%	0.244	C	C	.	.	H	α-helix	trans	-94.6	-31	-177.2	-63.1	178.9	0	0	0	115.1	N162 I220 Y310 L332 L477 I481	N162-L165 PolarHBondContact O-N 3.28Å; L165-I220 HydrophobicContact CD2-CG2 4.17Å; L165-Y310 HydrophobicContact CD1-CE1 4.17Å; L165-Y310 HydrophobicContact CD1-CE2 4.07Å; L165-Y310 WeakPolarHBondContact CD1-OH 3.13Å; L165-Y310 HydrophobicContact CD2-CD2 4.21Å; L165-Y310 HydrophobicContact CD2-CE2 3.95Å; L165-Y310 HydrophobicContact CG-CD2 4.31Å; L165-Y310 HydrophobicContact CG-CE1 4.43Å; L165-Y310 HydrophobicContact CG-CE2 3.56Å; L165-L332 HydrophobicContact CD1-CD1 4.36Å; L165-L477 HydrophobicContact CD1-CD1 4.46Å; L165-L477 HydrophobicContact CD1-CD2 3.74Å; L165-L477 HydrophobicContact CD1-CG 3.84Å; L165-I481 HydrophobicContact CB-CG1 4.45Å; L165-I481 HydrophobicContact CD2-CD1 4.26Å; L165-I481 HydrophobicContact CD2-CG1 3.88Å
166	L	88.3	Confident	91.1	Very high	43 Å²	43	48.7 Å²	48.7	23%	0.225	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.6	-21.2	-171.8	-80.5	-174	0	0	0	115.3	N162 P168 L477 R479 R480	N162-L166 PolarHBondContact O-N 3.22Å; N162-L166 VanDerWaalsContact O-N 3.12Å; N162-L166 WeakPolarHBondContact OD1-CD1 3.21Å; L166-P168 WeakPolarHBondContact O-CD 3.41Å; L166-L477 HydrophobicContact CD1-CD1 4.22Å; L166-L477 WeakPolarHBondContact CD2-O 3.44Å; L166-L477 HydrophobicContact CG-CD1 4.36Å; L166-L477 VanDerWaalsContact CG-O 3.24Å; L166-L477 WeakPolarHBondContact CG-O 3.37Å; L166-R479 HydrophobicContact CD2-CB 4.23Å; L166-R480 HydrophobicContact CD2-CG 4.19Å; L166-R480 WeakPolarHBondContact O-CG 3.37Å
167	K	88.3	Confident	91.2	Very high	96 Å²	96	44.9 Å²	44.9	42%	0.417	24%	0.242	S	C	.	.	S	Bend	trans	-67.9	126	175.3	-70.7	-172.6	-173.4	171.9	0	108.9	Q163 A169 E170 A171	Q163-K167 WeakPolarHBondContact O-CD 3.37Å; Q163-K167 WeakPolarHBondContact O-CG 3.44Å; K167-A169 VanDerWaalsContact C-N 3.3Å; K167-A169 PolarHBondContact O-N 3.46Å; K167-E170 HydrophobicContact CB-CB 4.04Å; K167-E170 HydrophobicContact CB-CG 3.73Å; K167-E170 HydrophobicContact CD-CG 4.07Å; K167-E170 HydrophobicContact CG-CG 4.5Å; K167-E170 PolarHBondContact O-N 2.97Å; K167-A171 WeakPolarHBondContact O-CB 3.37Å; K167-A171 PolarHBondContact O-N 2.89Å
168	P	87.1	Confident	91.4	Very high	76 Å²	76	44 Å²	44	49%	0.494	24%	0.237	S	C	.	.	H	α-helix	trans	-55.8	-42.5	-176.9	-28.2	35.5	0	0	0	113.8	L166 A171 A172	L166-P168 WeakPolarHBondContact O-CD 3.41Å; P168-A171 PolarHBondContact O-N 3.43Å; P168-A172 WeakPolarHBondContact O-CB 3.49Å; P168-A172 PolarHBondContact O-N 2.91Å
169	A	89.2	Confident	91.5	Very high	76 Å²	76	43.6 Å²	43.6	63%	0.628	24%	0.236	S	C	*	.	H	α-helix	trans	-63.4	-42.5	179.2	0	0	0	0	0	112.3	K167 A172	K167-A169 VanDerWaalsContact C-N 3.3Å; K167-A169 PolarHBondContact O-N 3.46Å; A169-A172 PolarHBondContact O-N 3.3Å
170	E	89.9	Confident	91.8	Very high	63 Å²	63	43.7 Å²	43.7	29%	0.294	24%	0.237	S	C	.	.	H	α-helix	trans	-69.8	-44.2	178.7	-59.3	-70.2	156.3	0	0	111.5	Q163 K167 A172 L173	Q163-E170 WeakPolarHBondContact O-CG 3.47Å; K167-E170 HydrophobicContact CB-CB 4.04Å; K167-E170 HydrophobicContact CB-CG 3.73Å; K167-E170 HydrophobicContact CD-CG 4.07Å; K167-E170 HydrophobicContact CG-CG 4.5Å; K167-E170 PolarHBondContact O-N 2.97Å; E170-A172 PolarHBondContact O-N 3.41Å; E170-L173 VanDerWaalsContact O-CB 3.3Å; E170-L173 WeakPolarHBondContact O-CB 3.12Å; E170-L173 PolarHBondContact O-N 3.31Å
171	A	89.4	Confident	92	Very high	3 Å²	3	43.5 Å²	43.5	3%	0.025	24%	0.235	C	C	.	.	H	α-helix	trans	-61.4	-33.3	178.2	0	0	0	0	0	112	K167 P168 L173 Y174 R480 I481 L484	K167-A171 WeakPolarHBondContact O-CB 3.37Å; K167-A171 PolarHBondContact O-N 2.89Å; P168-A171 PolarHBondContact O-N 3.43Å; A171-L173 PolarHBondContact O-N 3.16Å; A171-Y174 PolarHBondContact O-N 3.24Å; A171-R480 HydrophobicContact CB-CB 3.65Å; A171-I481 HydrophobicContact CB-CD1 4.13Å; A171-L484 WeakPolarHBondContact O-CD2 3.26Å
172	A	92.2	Very high	92.3	Very high	24 Å²	24	43.5 Å²	43.5	20%	0.198	24%	0.235	C	C	.	.	H	α-helix	trans	-65.9	-24.1	176	0	0	0	0	0	113.3	P168 A169 E170 Y174 T175 H377	P168-A172 WeakPolarHBondContact O-CB 3.49Å; P168-A172 PolarHBondContact O-N 2.91Å; A169-A172 PolarHBondContact O-N 3.3Å; E170-A172 PolarHBondContact O-N 3.41Å; A172-Y174 PolarHBondContact O-N 3.36Å; A172-T175 WeakPolarHBondContact O-CB 3.24Å; A172-T175 PolarHBondContact O-N 3.12Å; A172-T175 PolarHBondContact O-OG1 3.11Å; A172-H377 HydrophobicContact CB-CB 4.04Å; A172-H377 VanDerWaalsContact CB-CD2 3.45Å; A172-H377 WeakPolarHBondContact CB-CD2 3.48Å
173	L	92.7	Very high	92.7	Very high	122 Å²	122	44.5 Å²	44.5	64%	0.639	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-19.3	177.3	-59.4	175.8	0	0	0	112.5	E170 A171 T175	E170-L173 VanDerWaalsContact O-CB 3.3Å; E170-L173 WeakPolarHBondContact O-CB 3.12Å; E170-L173 PolarHBondContact O-N 3.31Å; A171-L173 PolarHBondContact O-N 3.16Å; L173-T175 VanDerWaalsContact C-N 3.25Å; L173-T175 PolarHBondContact O-N 3.44Å
174	Y	94.9	Very high	93.4	Very high	25 Å²	25	44 Å²	44	10%	0.098	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	1.8	177	-60.8	-58.3	0	0	0	114.1	R164 A171 A172 D176 A177 F178 I220 I481	R164-Y174 WeakPolarHBondContact O-CE2 3.48Å; A171-Y174 PolarHBondContact O-N 3.24Å; A172-Y174 PolarHBondContact O-N 3.36Å; Y174-D176 PolarHBondContact O-N 3.05Å; Y174-A177 PolarHBondContact O-N 3.05Å; Y174-F178 WeakPolarHBondContact O-CD2 3.49Å; Y174-F178 PolarHBondContact O-N 3.2Å; Y174-I220 HydrophobicContact CD1-CD1 3.54Å; Y174-I220 HydrophobicContact CD1-CG2 4.39Å; Y174-I220 HydrophobicContact CD2-CG2 4.44Å; Y174-I220 HydrophobicContact CE1-CD1 4.22Å; Y174-I220 HydrophobicContact CE1-CG2 4.09Å; Y174-I220 HydrophobicContact CE2-CG2 4.16Å; Y174-I220 HydrophobicContact CG-CD1 3.7Å; Y174-I481 HydrophobicContact CD2-CD1 3.47Å; Y174-I481 VanDerWaalsContact CD2-CD1 3.47Å; Y174-I481 HydrophobicContact CE2-CD1 3.79Å
175	T	96.6	Very high	94	Very high	5 Å²	5	41.6 Å²	41.6	3%	0.031	23%	0.231	C	C	.	.	H	α-helix	trans	-58.2	-46.9	-176.4	-57.3	0	0	0	0	112.3	A172 L173 F178 N179 Q376 H377 L488	A172-T175 WeakPolarHBondContact O-CB 3.24Å; A172-T175 PolarHBondContact O-N 3.12Å; A172-T175 PolarHBondContact O-OG1 3.11Å; L173-T175 VanDerWaalsContact C-N 3.25Å; L173-T175 PolarHBondContact O-N 3.44Å; T175-F178 PolarHBondContact O-N 3.2Å; T175-N179 PolarHBondContact O-N 3.05Å; T175-N179 PolarHBondContact O-ND2 3.33Å; T175-Q376 VanDerWaalsContact CG2-OE1 3.25Å; T175-H377 HydrophobicContact CG2-CB 4.49Å; T175-H377 WeakPolarHBondContact OG1-CB 3.47Å; T175-L488 HydrophobicContact CG2-CD1 4.23Å; T175-L488 HydrophobicContact CG2-CD2 4.03Å
176	D	95.8	Very high	94.4	Very high	97 Å²	97	41.8 Å²	41.8	52%	0.519	23%	0.232	S	C	.	.	H	α-helix	trans	-68.2	-43.5	-178.3	-64.8	-30.8	0	0	0	111.1	Y174 F178 N179 E180	Y174-D176 PolarHBondContact O-N 3.05Å; D176-F178 VanDerWaalsContact C-N 3.28Å; D176-F178 PolarHBondContact O-N 3.3Å; D176-N179 PolarHBondContact O-N 2.67Å; D176-E180 PolarHBondContact O-N 3.34Å
177	A	96	Very high	94.9	Very high	15 Å²	15	44.1 Å²	44.1	12%	0.124	24%	0.244	C	C	.	.	H	α-helix	trans	-56.5	-41.5	174.4	0	0	0	0	0	112.5	Y174 V181 Y219 I220	Y174-A177 PolarHBondContact O-N 3.05Å; A177-V181 WeakPolarHBondContact O-CG2 3.24Å; A177-V181 PolarHBondContact O-N 3.1Å; A177-Y219 HydrophobicContact CB-CD1 3.79Å; A177-Y219 HydrophobicContact CB-CE1 3.43Å; A177-Y219 VanDerWaalsContact CB-CE1 3.43Å; A177-I220 HydrophobicContact CB-CD1 4.38Å
178	F	97.7	Very high	95.3	Very high	1 Å²	1	41.1 Å²	41.1	0%	0.004	23%	0.23	C	C	.	.	H	α-helix	trans	-67.6	-41.5	173.5	-76.6	-53	0	0	0	112.7	Y174 T175 D176 E180 V181 I182 A216 I220 I481 L484 E485 L488	Y174-F178 WeakPolarHBondContact O-CD2 3.49Å; Y174-F178 PolarHBondContact O-N 3.2Å; T175-F178 PolarHBondContact O-N 3.2Å; D176-F178 VanDerWaalsContact C-N 3.28Å; D176-F178 PolarHBondContact O-N 3.3Å; F178-E180 VanDerWaalsContact C-N 3.3Å; F178-E180 PolarHBondContact O-N 2.78Å; F178-V181 PolarHBondContact O-N 3.41Å; F178-I182 WeakPolarHBondContact O-CB 3.32Å; F178-I182 WeakPolarHBondContact O-CD1 3.29Å; F178-I182 WeakPolarHBondContact O-CG1 3.21Å; F178-I182 PolarHBondContact O-N 2.77Å; F178-A216 HydrophobicContact CD1-CB 4.03Å; F178-A216 HydrophobicContact CE1-CB 3.86Å; F178-I220 HydrophobicContact CE1-CD1 4.14Å; F178-I220 HydrophobicContact CE1-CG1 3.89Å; F178-I220 HydrophobicContact CE2-CD1 4.31Å; F178-I220 HydrophobicContact CE2-CG1 4.5Å; F178-I220 HydrophobicContact CZ-CD1 3.97Å; F178-I220 HydrophobicContact CZ-CG1 3.74Å; F178-I481 HydrophobicContact CE2-CG2 4.4Å; F178-I481 HydrophobicContact CZ-CG2 3.64Å; F178-L484 HydrophobicContact CD2-CD2 3.9Å; F178-L484 HydrophobicContact CD2-CG 3.99Å; F178-L484 HydrophobicContact CE2-CB 4.4Å; F178-L484 HydrophobicContact CE2-CD2 3.95Å; F178-L484 HydrophobicContact CE2-CG 4.15Å; F178-E485 HydrophobicContact CD1-CB 3.78Å; F178-E485 HydrophobicContact CD2-CB 4.44Å; F178-E485 HydrophobicContact CE1-CB 3.57Å; F178-E485 WeakPolarHBondContact CE1-OE2 3.49Å; F178-E485 HydrophobicContact CE2-CB 4.26Å; F178-E485 HydrophobicContact CG-CB 4.22Å; F178-E485 HydrophobicContact CZ-CB 3.82Å; F178-L488 HydrophobicContact CB-CD1 3.57Å; F178-L488 HydrophobicContact CD2-CD1 4.14Å; F178-L488 HydrophobicContact CG-CD1 4.22Å
179	N	97.9	Very high	95.8	Very high	7 Å²	7	37.5 Å²	37.5	4%	0.037	21%	0.206	C	C	.	.	H	α-helix	trans	-62.5	-37.3	178.9	-82.5	-37.9	0	0	0	112	T175 D176 I182 D183 V374 P375 Q376	T175-N179 PolarHBondContact O-N 3.05Å; T175-N179 PolarHBondContact O-ND2 3.33Å; D176-N179 PolarHBondContact O-N 2.67Å; N179-I182 CarbonylContact O-C 3.57Å; N179-I182 PolarHBondContact O-N 3.42Å; N179-D183 VanDerWaalsContact O-CG 3.3Å; N179-D183 PolarHBondContact O-N 2.92Å; N179-V374 HydrophobicContact CB-CG1 4Å; N179-V374 WeakPolarHBondContact ND2-CG1 3.4Å; N179-V374 WeakPolarHBondContact OD1-CG1 3.44Å; N179-P375 PolarHBondContact ND2-O 3.3Å; N179-Q376 PolarHBondContact ND2-NE2 3.11Å
180	E	97.8	Very high	96.1	Very high	89 Å²	89	36.1 Å²	36.1	42%	0.416	19%	0.188	S	C	.	.	H	α-helix	trans	-59.9	-45.6	171.7	-70	176.9	-154.5	0	0	112.3	D176 F178 I182 D183 D184	D176-E180 PolarHBondContact O-N 3.34Å; F178-E180 VanDerWaalsContact C-N 3.3Å; F178-E180 PolarHBondContact O-N 2.78Å; E180-I182 VanDerWaalsContact C-N 3.3Å; E180-I182 PolarHBondContact O-N 2.78Å; E180-D183 PolarHBondContact O-N 3.25Å; E180-D184 PolarHBondContact O-N 2.97Å
181	V	98.4	Very high	96.4	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-66.2	-35.7	176.9	177.8	0	0	0	0	111.1	A177 F178 D184 F185 F212 E215 A216 Y219 L229	A177-V181 WeakPolarHBondContact O-CG2 3.24Å; A177-V181 PolarHBondContact O-N 3.1Å; F178-V181 PolarHBondContact O-N 3.41Å; V181-D184 PolarHBondContact O-N 3.02Å; V181-F185 WeakPolarHBondContact O-CB 3.41Å; V181-F185 PolarHBondContact O-N 2.71Å; V181-F212 HydrophobicContact CG1-CD2 3.87Å; V181-F212 HydrophobicContact CG1-CE2 3.82Å; V181-E215 HydrophobicContact CG1-CB 3.9Å; V181-E215 HydrophobicContact CG1-CG 3.77Å; V181-E215 HydrophobicContact CG2-CG 4.17Å; V181-A216 HydrophobicContact CG1-CB 4.14Å; V181-Y219 HydrophobicContact CG2-CD1 3.86Å; V181-L229 HydrophobicContact CG1-CD1 3.8Å; V181-L229 WeakPolarHBondContact O-CD1 3.27Å
182	I	98.4	Very high	96.8	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-68.4	-38	175.8	-67.3	163.3	0	0	0	110.7	F178 N179 E180 D184 F185 M186 F212 L488 L489 R492	F178-I182 WeakPolarHBondContact O-CB 3.32Å; F178-I182 WeakPolarHBondContact O-CD1 3.29Å; F178-I182 WeakPolarHBondContact O-CG1 3.21Å; F178-I182 PolarHBondContact O-N 2.77Å; N179-I182 CarbonylContact O-C 3.57Å; N179-I182 PolarHBondContact O-N 3.42Å; E180-I182 VanDerWaalsContact C-N 3.3Å; E180-I182 PolarHBondContact O-N 2.78Å; I182-D184 VanDerWaalsContact C-N 3.34Å; I182-D184 PolarHBondContact O-N 3.22Å; I182-F185 CarbonylContact O-C 3.59Å; I182-F185 WeakPolarHBondContact O-CB 3.32Å; I182-F185 PolarHBondContact O-N 2.85Å; I182-M186 HydrophobicContact CG2-CG 4.06Å; I182-M186 WeakPolarHBondContact O-CB 3.44Å; I182-M186 WeakPolarHBondContact O-CG 3.44Å; I182-M186 PolarHBondContact O-N 3.41Å; I182-F212 HydrophobicContact CG1-CE2 3.55Å; I182-F212 HydrophobicContact CG1-CZ 3.87Å; I182-L488 HydrophobicContact CD1-CB 3.38Å; I182-L489 HydrophobicContact CD1-CB 4.14Å; I182-L489 HydrophobicContact CG1-CB 4.24Å; I182-L489 HydrophobicContact CG1-CD1 4.18Å; I182-L489 HydrophobicContact CG2-CD1 3.9Å; I182-R492 HydrophobicContact CG2-CB 4.02Å; I182-R492 HydrophobicContact CG2-CG 3.94Å
183	D	98	Very high	96.9	Very high	65 Å²	65	38.2 Å²	38.2	35%	0.348	19%	0.194	S	C	.	.	H	α-helix	trans	-59	-47.6	175.3	-74.2	-27.6	0	0	0	110.8	N179 E180 F185 M186 I187 R492	N179-D183 VanDerWaalsContact O-CG 3.3Å; N179-D183 PolarHBondContact O-N 2.92Å; E180-D183 PolarHBondContact O-N 3.25Å; D183-F185 VanDerWaalsContact C-N 3.31Å; D183-F185 PolarHBondContact O-N 3.5Å; D183-M186 PolarHBondContact O-N 3.03Å; D183-M186 VanDerWaalsContact O-N 3.16Å; D183-I187 WeakPolarHBondContact O-CG1 3.39Å; D183-I187 PolarHBondContact O-N 3.5Å; D183-R492 IonicContact OD1-CZ 3.87Å; D183-R492 IonicContact OD1-NH2 3.95Å; D183-R492 PolarHBondContact OD1-NH2 2.89Å
184	D	98.4	Very high	97	Very high	61 Å²	61	36.1 Å²	36.1	33%	0.326	19%	0.193	S	C	.	.	H	α-helix	trans	-63.3	-37.6	175.1	-72.4	-31.6	0	0	0	112.5	E180 V181 I182 I187 R188 R225 L229	E180-D184 PolarHBondContact O-N 2.97Å; V181-D184 PolarHBondContact O-N 3.02Å; I182-D184 VanDerWaalsContact C-N 3.34Å; I182-D184 PolarHBondContact O-N 3.22Å; D184-I187 PolarHBondContact O-N 3.46Å; D184-R188 WeakPolarHBondContact O-CB 3.36Å; D184-R188 PolarHBondContact O-N 2.92Å; D184-R225 IonicContact OD2-CZ 3.55Å; D184-R225 VanDerWaalsContact OD2-CZ 3.3Å; D184-R225 IonicContact OD2-NH1 3.88Å; D184-R225 PolarHBondContact OD2-NH1 3.48Å; D184-R225 VanDerWaalsContact OD2-NH1 3.14Å; D184-R225 IonicContact OD2-NH2 3.79Å; D184-R225 PolarHBondContact OD2-NH2 2.88Å; D184-L229 HydrophobicContact CB-CB 4.35Å; D184-L229 HydrophobicContact CB-CD1 4.13Å
185	F	98.5	Very high	97	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-62.6	-43.9	173.4	173.6	-87.7	0	0	0	111.8	V181 I182 D183 I187 R188 L189 M205 L208 F209 F212 L229 L489 L493	V181-F185 WeakPolarHBondContact O-CB 3.41Å; V181-F185 PolarHBondContact O-N 2.71Å; I182-F185 CarbonylContact O-C 3.59Å; I182-F185 WeakPolarHBondContact O-CB 3.32Å; I182-F185 PolarHBondContact O-N 2.85Å; D183-F185 VanDerWaalsContact C-N 3.31Å; D183-F185 PolarHBondContact O-N 3.5Å; F185-I187 VanDerWaalsContact C-N 3.33Å; F185-R188 PolarHBondContact O-N 3.42Å; F185-L189 HydrophobicContact CE1-CB 4.41Å; F185-L189 HydrophobicContact CE1-CD2 4.14Å; F185-L189 VanDerWaalsContact O-CB 3.26Å; F185-L189 WeakPolarHBondContact O-CB 3.3Å; F185-L189 PolarHBondContact O-N 3.29Å; F185-M205 HydrophobicContact CZ-CE 4.23Å; F185-L208 HydrophobicContact CD2-CG 4.19Å; F185-L208 HydrophobicContact CE2-CD1 4.42Å; F185-L208 HydrophobicContact CE2-CD2 3.85Å; F185-L208 HydrophobicContact CE2-CG 3.6Å; F185-L208 HydrophobicContact CZ-CD2 4.03Å; F185-L208 HydrophobicContact CZ-CG 4.27Å; F185-F209 HydrophobicContact CE1-CE1 4.41Å; F185-F209 AromaticContact CE2-CD1 3.83Å; F185-F209 HydrophobicContact CE2-CD1 3.83Å; F185-F209 HydrophobicContact CE2-CE1 4.04Å; F185-F209 AromaticContact CZ-CD1 3.82Å; F185-F209 HydrophobicContact CZ-CD1 3.82Å; F185-F209 AromaticContact CZ-CE1 3.53Å; F185-F209 HydrophobicContact CZ-CE1 3.53Å; F185-F209 HydrophobicContact CZ-CZ 4.49Å; F185-F212 HydrophobicContact CB-CD2 3.98Å; F185-F212 HydrophobicContact CD2-CB 3.68Å; F185-F212 HydrophobicContact CD2-CD2 4.05Å; F185-F212 HydrophobicContact CD2-CG 4.11Å; F185-F212 HydrophobicContact CE2-CB 4.01Å; F185-F212 HydrophobicContact CG-CD2 4.15Å; F185-L229 HydrophobicContact CB-CD1 4.04Å; F185-L229 HydrophobicContact CD2-CD2 4.22Å; F185-L489 HydrophobicContact CD1-CD1 3.54Å; F185-L489 HydrophobicContact CE1-CD1 3.66Å; F185-L489 HydrophobicContact CG-CD1 4.23Å; F185-L489 HydrophobicContact CZ-CD1 4.37Å; F185-L489 HydrophobicContact CZ-CD2 4.45Å; F185-L493 HydrophobicContact CE1-CD1 4.38Å; F185-L493 HydrophobicContact CE1-CD2 4.11Å
186	M	97.7	Very high	96.8	Very high	10 Å²	10	40.5 Å²	40.5	5%	0.049	22%	0.218	C	C	.	.	H	α-helix	trans	-66	-38.5	179.9	-67.7	-63.6	-76	0	0	110.9	I182 D183 L189 D190 L493 K496 Y497	I182-M186 HydrophobicContact CG2-CG 4.06Å; I182-M186 WeakPolarHBondContact O-CB 3.44Å; I182-M186 WeakPolarHBondContact O-CG 3.44Å; I182-M186 PolarHBondContact O-N 3.41Å; D183-M186 PolarHBondContact O-N 3.03Å; D183-M186 VanDerWaalsContact O-N 3.16Å; M186-L189 PolarHBondContact O-N 2.94Å; M186-L189 HydrophobicContact SD-CD2 4.25Å; M186-D190 VanDerWaalsContact O-CG 3.3Å; M186-D190 PolarHBondContact O-N 2.98Å; M186-L493 HydrophobicContact SD-CD2 3.87Å; M186-L493 HydrophobicContact SD-CG 4.39Å; M186-K496 HydrophobicContact CE-CB 4.15Å; M186-K496 HydrophobicContact CE-CD 3.57Å; M186-K496 HydrophobicContact CE-CG 4.46Å; M186-Y497 HydrophobicContact CE-CD2 4.28Å; M186-Y497 HydrophobicContact CE-CE2 3.68Å
187	I	97.5	Very high	96.6	Very high	92 Å²	92	41.6 Å²	41.6	47%	0.472	24%	0.24	S	C	.	.	H	α-helix	trans	-60.6	-48.8	171.7	-68.2	165.7	0	0	0	110.2	D183 D184 F185 L189 D190 Q191	D183-I187 WeakPolarHBondContact O-CG1 3.39Å; D183-I187 PolarHBondContact O-N 3.5Å; D184-I187 PolarHBondContact O-N 3.46Å; F185-I187 VanDerWaalsContact C-N 3.33Å; I187-L189 VanDerWaalsContact C-N 3.35Å; I187-L189 PolarHBondContact O-N 3.5Å; I187-D190 PolarHBondContact O-N 2.69Å; I187-Q191 WeakPolarHBondContact O-CG 3.36Å; I187-Q191 PolarHBondContact O-N 2.86Å
188	R	97.7	Very high	96.2	Very high	32 Å²	32	43.8 Å²	43.8	12%	0.121	25%	0.254	C	S	.	.	H	α-helix	trans	-64.6	-39.6	-179.7	-174.4	54.6	174.3	145.9	3.5	112.5	D184 F185 D190 Q191 L192 L208 L229	D184-R188 WeakPolarHBondContact O-CB 3.36Å; D184-R188 PolarHBondContact O-N 2.92Å; F185-R188 PolarHBondContact O-N 3.42Å; R188-D190 VanDerWaalsContact C-N 3.34Å; R188-Q191 PolarHBondContact O-N 2.77Å; R188-L192 HydrophobicContact CG-CD1 4.24Å; R188-L192 WeakPolarHBondContact O-CG 3.47Å; R188-L192 PolarHBondContact O-N 2.78Å; R188-L208 HydrophobicContact CG-CD1 3.9Å; R188-L229 VanDerWaalsContact CB-O 3.32Å; R188-L229 WeakPolarHBondContact CB-O 3.27Å; R188-L229 VanDerWaalsContact CD-O 3.27Å; R188-L229 WeakPolarHBondContact CD-O 3.42Å; R188-L229 VanDerWaalsContact CG-O 3.24Å; R188-L229 WeakPolarHBondContact CG-O 3.36Å
189	L	97.7	Very high	96	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-58.3	-47	174.1	175.2	61.9	0	0	0	110.7	F185 M186 I187 Q191 L192 R193 V202 M205 L208 L493 Y497 F526	F185-L189 HydrophobicContact CE1-CB 4.41Å; F185-L189 HydrophobicContact CE1-CD2 4.14Å; F185-L189 VanDerWaalsContact O-CB 3.26Å; F185-L189 WeakPolarHBondContact O-CB 3.3Å; F185-L189 PolarHBondContact O-N 3.29Å; M186-L189 PolarHBondContact O-N 2.94Å; M186-L189 HydrophobicContact SD-CD2 4.25Å; I187-L189 VanDerWaalsContact C-N 3.35Å; I187-L189 PolarHBondContact O-N 3.5Å; L189-Q191 PolarHBondContact O-N 2.76Å; L189-L192 PolarHBondContact O-N 3.16Å; L189-R193 HydrophobicContact CD1-CG 4.31Å; L189-R193 WeakPolarHBondContact O-CB 3.11Å; L189-R193 WeakPolarHBondContact O-CG 3.33Å; L189-R193 PolarHBondContact O-N 3.43Å; L189-V202 HydrophobicContact CD1-CG2 3.57Å; L189-M205 HydrophobicContact CD1-SD 4.28Å; L189-L208 HydrophobicContact CD1-CD2 4.2Å; L189-L493 HydrophobicContact CD2-CD2 3.52Å; L189-Y497 HydrophobicContact CD2-CD2 4.23Å; L189-Y497 HydrophobicContact CD2-CE2 3.82Å; L189-F526 HydrophobicContact CD1-CD2 4Å; L189-F526 HydrophobicContact CD1-CE1 4.47Å; L189-F526 HydrophobicContact CD1-CE2 3.82Å; L189-F526 HydrophobicContact CD1-CG 4.41Å; L189-F526 HydrophobicContact CD1-CZ 4.08Å; L189-F526 HydrophobicContact CD2-CD1 4.27Å; L189-F526 HydrophobicContact CD2-CE1 4.26Å
190	D	95.9	Very high	95.8	Very high	47 Å²	47	47 Å²	47	25%	0.251	28%	0.282	S	S	.	.	H	α-helix	trans	-65.9	-37.9	-179.9	-72.2	-15.1	0	0	0	112.4	M186 I187 R188 R193 A194 K496 Y497	M186-D190 VanDerWaalsContact O-CG 3.3Å; M186-D190 PolarHBondContact O-N 2.98Å; I187-D190 PolarHBondContact O-N 2.69Å; R188-D190 VanDerWaalsContact C-N 3.34Å; D190-R193 PolarHBondContact O-N 3.37Å; D190-R193 IonicContact OD1-CZ 3.02Å; D190-R193 IonicContact OD1-NH1 3.04Å; D190-R193 PolarHBondContact OD1-NH1 2.94Å; D190-A194 WeakPolarHBondContact O-CB 3.26Å; D190-A194 PolarHBondContact O-N 3.3Å; D190-K496 IonicContact OD2-NZ 3.37Å; D190-K496 PolarHBondContact OD2-NZ 3.17Å; D190-Y497 VanDerWaalsContact CG-OH 3.28Å; D190-Y497 PolarHBondContact OD1-OH 3.11Å; D190-Y497 PolarHBondContact OD2-OH 2.94Å
191	Q	96	Very high	95.6	Very high	66 Å²	66	44.3 Å²	44.3	31%	0.308	27%	0.269	S	S	.	.	H	α-helix	trans	-60.9	-50.5	171.9	-69.1	169.9	1.6	0	0	111.9	I187 R188 L189 R193 A194 E195	I187-Q191 WeakPolarHBondContact O-CG 3.36Å; I187-Q191 PolarHBondContact O-N 2.86Å; R188-Q191 PolarHBondContact O-N 2.77Å; L189-Q191 PolarHBondContact O-N 2.76Å; Q191-R193 VanDerWaalsContact C-N 3.3Å; Q191-R193 PolarHBondContact O-N 3.16Å; Q191-A194 PolarHBondContact O-N 2.93Å; Q191-E195 VanDerWaalsContact O-CG 3.3Å; Q191-E195 WeakPolarHBondContact O-CG 3.43Å; Q191-E195 PolarHBondContact O-N 3.3Å
192	L	96.3	Very high	95.6	Very high	41 Å²	41	44.6 Å²	44.6	22%	0.215	27%	0.271	C	S	.	.	H	α-helix	trans	-63.4	-37	-178.9	-72	171.7	0	0	0	112.1	R188 L189 E195 S196 V202 L208	R188-L192 HydrophobicContact CG-CD1 4.24Å; R188-L192 WeakPolarHBondContact O-CG 3.47Å; R188-L192 PolarHBondContact O-N 2.78Å; L189-L192 PolarHBondContact O-N 3.16Å; L192-E195 PolarHBondContact O-N 2.94Å; L192-S196 PolarHBondContact O-N 3.18Å; L192-V202 HydrophobicContact CB-CG2 3.98Å; L192-V202 HydrophobicContact CD1-CG1 4.36Å; L192-L208 HydrophobicContact CD1-CD1 3.87Å; L192-L208 HydrophobicContact CD1-CD2 3.92Å; L192-L208 HydrophobicContact CD1-CG 4.41Å
193	R	95.5	Very high	95.4	Very high	28 Å²	28	48.5 Å²	48.5	11%	0.106	30%	0.298	C	S	.	.	H	α-helix	trans	-62	-48.5	173.1	-72	166.7	66.3	-134.8	1.1	111	L189 D190 Q191 E195 S196 G199 N200 V202 Y497 F526	L189-R193 HydrophobicContact CD1-CG 4.31Å; L189-R193 WeakPolarHBondContact O-CB 3.11Å; L189-R193 WeakPolarHBondContact O-CG 3.33Å; L189-R193 PolarHBondContact O-N 3.43Å; D190-R193 PolarHBondContact O-N 3.37Å; D190-R193 IonicContact OD1-CZ 3.02Å; D190-R193 IonicContact OD1-NH1 3.04Å; D190-R193 PolarHBondContact OD1-NH1 2.94Å; Q191-R193 VanDerWaalsContact C-N 3.3Å; Q191-R193 PolarHBondContact O-N 3.16Å; R193-E195 VanDerWaalsContact C-N 3.29Å; R193-E195 PolarHBondContact O-N 3.36Å; R193-S196 WeakPolarHBondContact O-CB 3.48Å; R193-S196 PolarHBondContact O-N 3.03Å; R193-S196 VanDerWaalsContact O-N 3.13Å; R193-S196 PolarHBondContact O-OG 3.31Å; R193-G199 CarbonylContact O-C 3.42Å; R193-G199 VanDerWaalsContact O-CA 3.24Å; R193-G199 WeakPolarHBondContact O-CA 3.47Å; R193-N200 PolarHBondContact O-N 3.01Å; R193-V202 HydrophobicContact CG-CG2 4.01Å; R193-Y497 VanDerWaalsContact CZ-CE1 3.45Å; R193-Y497 VanDerWaalsContact NH1-CZ 3.26Å; R193-Y497 PolarHBondContact NH1-OH 3.14Å; R193-F526 HydrophobicContact CG-CD2 4.48Å; R193-F526 PolarHBondContact NE-O 3.19Å; R193-F526 PolarHBondContact NH2-O 3.23Å
194	A	94.1	Very high	95.3	Very high	77 Å²	77	47 Å²	47	64%	0.636	29%	0.29	S	S	*	.	H	α-helix	trans	-65	-31.1	179.8	0	0	0	0	0	113.1	D190 Q191 S196	D190-A194 WeakPolarHBondContact O-CB 3.26Å; D190-A194 PolarHBondContact O-N 3.3Å; Q191-A194 PolarHBondContact O-N 2.93Å; A194-S196 VanDerWaalsContact C-N 3.29Å
195	E	94.3	Very high	95.2	Very high	95 Å²	95	44 Å²	44	44%	0.444	27%	0.274	S	S	.	.	H	α-helix	trans	-76.1	-15.2	175.8	-71.5	173	172.6	0	0	113.3	Q191 L192 R193 R231	Q191-E195 VanDerWaalsContact O-CG 3.3Å; Q191-E195 WeakPolarHBondContact O-CG 3.43Å; Q191-E195 PolarHBondContact O-N 3.3Å; L192-E195 PolarHBondContact O-N 2.94Å; R193-E195 VanDerWaalsContact C-N 3.29Å; R193-E195 PolarHBondContact O-N 3.36Å; E195-R231 IonicContact OE1-CZ 2.75Å; E195-R231 IonicContact OE1-NE 3.89Å; E195-R231 IonicContact OE1-NH1 3.49Å; E195-R231 PolarHBondContact OE1-NH1 3.41Å; E195-R231 IonicContact OE1-NH2 3.11Å; E195-R231 PolarHBondContact OE1-NH2 3.35Å
196	S	94.1	Very high	95.1	Very high	28 Å²	28	45.1 Å²	45.1	20%	0.196	28%	0.283	C	S	.	.	S	Bend	trans	-74.3	148.7	177.6	76.8	0	0	0	0	111.9	L192 R193 A194 S198 G199 N200 Q201	L192-S196 PolarHBondContact O-N 3.18Å; R193-S196 WeakPolarHBondContact O-CB 3.48Å; R193-S196 PolarHBondContact O-N 3.03Å; R193-S196 VanDerWaalsContact O-N 3.13Å; R193-S196 PolarHBondContact O-OG 3.31Å; A194-S196 VanDerWaalsContact C-N 3.29Å; S196-S198 PolarHBondContact O-N 3.02Å; S196-S198 VanDerWaalsContact O-N 3.13Å; S196-G199 PolarHBondContact O-N 3.41Å; S196-G199 PolarHBondContact OG-N 3.36Å; S196-G199 VanDerWaalsContact OG-N 3.13Å; S196-N200 PolarHBondContact OG-N 2.96Å; S196-Q201 VanDerWaalsContact CB-O 3.22Å; S196-Q201 WeakPolarHBondContact CB-O 3.45Å; S196-Q201 PolarHBondContact OG-N 3.37Å; S196-Q201 VanDerWaalsContact OG-N 3.11Å; S196-Q201 PolarHBondContact OG-O 2.83Å
197	A	90.1	Very high	95	Very high	119 Å²	119	47.6 Å²	47.6	98%	0.983	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-28.3	179.2	0	0	0	0	0	113.7
198	S	88.9	Confident	95	Very high	61 Å²	61	43.7 Å²	43.7	43%	0.427	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-4.3	176.8	59.8	0	0	0	0	113.8	S196 N200 Q201	S196-S198 PolarHBondContact O-N 3.02Å; S196-S198 VanDerWaalsContact O-N 3.13Å; S198-N200 VanDerWaalsContact CB-OD1 3.29Å; S198-N200 WeakPolarHBondContact CB-OD1 3.37Å; S198-N200 PolarHBondContact O-N 3.29Å; S198-N200 PolarHBondContact OG-OD1 3.12Å; S198-Q201 WeakPolarHBondContact OG-CB 3.4Å
199	G	92.8	Very high	95	Very high	41 Å²	41	42.1 Å²	42.1	42%	0.423	27%	0.268	S	S	.	.	S	Bend	trans	68.3	6.3	-178.5	0	0	0	0	0	115.3	R193 S196	R193-G199 CarbonylContact O-C 3.42Å; R193-G199 VanDerWaalsContact O-CA 3.24Å; R193-G199 WeakPolarHBondContact O-CA 3.47Å; S196-G199 PolarHBondContact O-N 3.41Å; S196-G199 PolarHBondContact OG-N 3.36Å; S196-G199 VanDerWaalsContact OG-N 3.13Å
200	N	93.2	Very high	94.9	Very high	36 Å²	36	42.8 Å²	42.8	19%	0.193	27%	0.271	C	S	.	.	S	Bend	trans	-141.8	4.9	-171.2	66.7	6.8	0	0	0	114.6	R193 S196 S198 Q525 F526 L527	R193-N200 PolarHBondContact O-N 3.01Å; S196-N200 PolarHBondContact OG-N 2.96Å; S198-N200 VanDerWaalsContact CB-OD1 3.29Å; S198-N200 WeakPolarHBondContact CB-OD1 3.37Å; S198-N200 PolarHBondContact O-N 3.29Å; S198-N200 PolarHBondContact OG-OD1 3.12Å; N200-Q525 CarbonylContact O-C 3.48Å; N200-Q525 WeakPolarHBondContact O-CA 3.28Å; N200-F526 PolarHBondContact O-N 2.93Å; N200-L527 HydrophobicContact CB-CD2 4.49Å
201	Q	95.1	Very high	95	Very high	31 Å²	31	42.1 Å²	42.1	15%	0.145	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	145.7	-168	-170.6	175.4	-51.8	0	0	112.8	S196 S198 A502 E504 L524 Q525	S196-Q201 VanDerWaalsContact CB-O 3.22Å; S196-Q201 WeakPolarHBondContact CB-O 3.45Å; S196-Q201 PolarHBondContact OG-N 3.37Å; S196-Q201 VanDerWaalsContact OG-N 3.11Å; S196-Q201 PolarHBondContact OG-O 2.83Å; S198-Q201 WeakPolarHBondContact OG-CB 3.4Å; Q201-A502 HydrophobicContact CG-CB 4.27Å; Q201-E504 PolarHBondContact NE2-OE1 3.21Å; Q201-L524 WeakPolarHBondContact CA-O 3.38Å; Q201-Q525 HydrophobicContact CB-CG 4.05Å; Q201-Q525 HydrophobicContact CG-CG 3.97Å
202	V	97	Very high	95.1	Very high	7 Å²	7	39 Å²	39	4%	0.042	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	124.8	164	-179.6	0	0	0	0	108.7	L189 L192 R193 M205 L208 G523 L524 F526	L189-V202 HydrophobicContact CD1-CG2 3.57Å; L192-V202 HydrophobicContact CB-CG2 3.98Å; L192-V202 HydrophobicContact CD1-CG1 4.36Å; R193-V202 HydrophobicContact CG-CG2 4.01Å; V202-M205 HydrophobicContact CB-CG 4.09Å; V202-M205 HydrophobicContact CB-SD 3.61Å; V202-M205 HydrophobicContact CG1-CG 4.08Å; V202-M205 HydrophobicContact CG1-SD 3.57Å; V202-M205 VanDerWaalsContact CG1-SD 3.57Å; V202-M205 HydrophobicContact CG2-SD 4.07Å; V202-L208 HydrophobicContact CG1-CD2 4.42Å; V202-G523 CarbonylContact O-C 3.28Å; V202-G523 VanDerWaalsContact O-CA 3.23Å; V202-G523 WeakPolarHBondContact O-CA 3.41Å; V202-L524 PolarHBondContact N-O 2.59Å; V202-L524 PolarHBondContact O-N 2.87Å; V202-F526 HydrophobicContact CB-CE2 4.41Å; V202-F526 HydrophobicContact CG2-CD2 4.44Å; V202-F526 HydrophobicContact CG2-CE2 4.26Å
203	S	94.9	Very high	95.2	Very high	82 Å²	82	37 Å²	37	57%	0.573	24%	0.24	S	C	*	.	S	Bend	trans	-78	-23.4	-172.4	57.3	0	0	0	0	114.6
204	D	95.8	Very high	95.3	Very high	32 Å²	32	35.7 Å²	35.7	17%	0.171	24%	0.235	C	C	.	.			trans	-141.9	77.5	-178.3	-160.8	-13.5	0	0	0	111.9	A206 Q207 L208 K521	D204-A206 VanDerWaalsContact C-N 3.29Å; D204-A206 PolarHBondContact O-N 3.33Å; D204-Q207 HydrophobicContact CB-CB 4.23Å; D204-Q207 PolarHBondContact O-N 3.45Å; D204-Q207 PolarHBondContact OD1-N 2.94Å; D204-L208 PolarHBondContact O-N 3.14Å; D204-K521 HydrophobicContact CB-CD 4.22Å; D204-K521 VanDerWaalsContact OD2-CD 3.29Å; D204-K521 WeakPolarHBondContact OD2-CD 3.41Å; D204-K521 WeakPolarHBondContact OD2-CE 3.44Å; D204-K521 WeakPolarHBondContact OD2-CG 3.42Å; D204-K521 IonicContact OD2-NZ 3.58Å
205	M	97.1	Very high	95.5	Very high	0 Å²	0	32 Å²	32	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-66.6	-30	179.4	-78	-62.4	-52	0	0	113.3	F185 L189 V202 Q207 L208 F209 L348 V522 L524 F526	F185-M205 HydrophobicContact CZ-CE 4.23Å; L189-M205 HydrophobicContact CD1-SD 4.28Å; V202-M205 HydrophobicContact CB-CG 4.09Å; V202-M205 HydrophobicContact CB-SD 3.61Å; V202-M205 HydrophobicContact CG1-CG 4.08Å; V202-M205 HydrophobicContact CG1-SD 3.57Å; V202-M205 VanDerWaalsContact CG1-SD 3.57Å; V202-M205 HydrophobicContact CG2-SD 4.07Å; M205-Q207 VanDerWaalsContact C-N 3.31Å; M205-Q207 PolarHBondContact O-N 3.49Å; M205-L208 HydrophobicContact CE-CD2 4.31Å; M205-L208 PolarHBondContact O-N 3.18Å; M205-L208 HydrophobicContact SD-CD2 4.06Å; M205-F209 HydrophobicContact CB-CE2 4.45Å; M205-F209 HydrophobicContact CE-CD1 4.46Å; M205-F209 HydrophobicContact CE-CD2 4.14Å; M205-F209 HydrophobicContact CE-CE1 3.93Å; M205-F209 HydrophobicContact CE-CE2 3.6Å; M205-F209 HydrophobicContact CE-CZ 3.49Å; M205-F209 VanDerWaalsContact CE-CZ 3.49Å; M205-F209 VanDerWaalsContact O-CD2 3.24Å; M205-F209 WeakPolarHBondContact O-CD2 3.39Å; M205-F209 WeakPolarHBondContact O-CG 3.41Å; M205-F209 PolarHBondContact O-N 3.43Å; M205-L348 HydrophobicContact CE-CD1 4.32Å; M205-V522 WeakPolarHBondContact CB-O 3.37Å; M205-V522 PolarHBondContact N-O 3.21Å; M205-L524 HydrophobicContact CB-CD1 4.23Å; M205-L524 HydrophobicContact CB-CG 4.46Å; M205-L524 HydrophobicContact CG-CB 3.91Å; M205-L524 HydrophobicContact CG-CD1 3.88Å; M205-L524 HydrophobicContact CG-CG 3.94Å; M205-F526 HydrophobicContact CE-CE2 4.25Å; M205-F526 HydrophobicContact CE-CZ 3.67Å; M205-F526 HydrophobicContact CG-CE2 4.17Å; M205-F526 HydrophobicContact CG-CZ 4.31Å; M205-F526 HydrophobicContact SD-CE2 3.58Å; M205-F526 VanDerWaalsContact SD-CE2 3.58Å; M205-F526 HydrophobicContact SD-CZ 3.65Å
206	A	95.4	Very high	95.6	Very high	22 Å²	22	27.5 Å²	27.5	18%	0.182	18%	0.184	C	C	.	.	H	α-helix	trans	-61.3	-43.7	176.7	0	0	0	0	0	110.8	D204 Y210 T345	D204-A206 VanDerWaalsContact C-N 3.29Å; D204-A206 PolarHBondContact O-N 3.33Å; A206-Y210 WeakPolarHBondContact O-CB 3.31Å; A206-Y210 PolarHBondContact O-N 3.33Å; A206-T345 WeakPolarHBondContact CA-OG1 3.44Å; A206-T345 HydrophobicContact CB-CG2 4.11Å
207	Q	95.4	Very high	95.8	Very high	63 Å²	63	26.9 Å²	26.9	29%	0.294	18%	0.178	S	C	.	.	H	α-helix	trans	-67.3	-39.3	176.5	-174.2	60.8	65.4	0	0	112.5	D204 M205 Y210 Y211	D204-Q207 HydrophobicContact CB-CB 4.23Å; D204-Q207 PolarHBondContact O-N 3.45Å; D204-Q207 PolarHBondContact OD1-N 2.94Å; M205-Q207 VanDerWaalsContact C-N 3.31Å; M205-Q207 PolarHBondContact O-N 3.49Å; Q207-Y210 VanDerWaalsContact O-CB 3.22Å; Q207-Y210 WeakPolarHBondContact O-CB 3.48Å; Q207-Y210 PolarHBondContact O-N 3.15Å; Q207-Y211 HydrophobicContact CG-CD2 4.27Å; Q207-Y211 HydrophobicContact CG-CE2 3.71Å; Q207-Y211 VanDerWaalsContact NE2-CE2 3.32Å; Q207-Y211 VanDerWaalsContact O-CD2 3.27Å; Q207-Y211 WeakPolarHBondContact O-CD2 3.07Å; Q207-Y211 PolarHBondContact O-N 3.2Å; Q207-Y211 VanDerWaalsContact O-N 3.15Å
208	L	97.4	Very high	96.1	Very high	9 Å²	9	21.2 Å²	21.2	5%	0.047	13%	0.131	C	C	.	.	H	α-helix	trans	-65.6	-42.8	177.4	-174.5	61.9	0	0	0	111.6	F185 R188 L189 L192 V202 D204 M205 Y210 Y211 F212	F185-L208 HydrophobicContact CD2-CG 4.19Å; F185-L208 HydrophobicContact CE2-CD1 4.42Å; F185-L208 HydrophobicContact CE2-CD2 3.85Å; F185-L208 HydrophobicContact CE2-CG 3.6Å; F185-L208 HydrophobicContact CZ-CD2 4.03Å; F185-L208 HydrophobicContact CZ-CG 4.27Å; R188-L208 HydrophobicContact CG-CD1 3.9Å; L189-L208 HydrophobicContact CD1-CD2 4.2Å; L192-L208 HydrophobicContact CD1-CD1 3.87Å; L192-L208 HydrophobicContact CD1-CD2 3.92Å; L192-L208 HydrophobicContact CD1-CG 4.41Å; V202-L208 HydrophobicContact CG1-CD2 4.42Å; D204-L208 PolarHBondContact O-N 3.14Å; M205-L208 HydrophobicContact CE-CD2 4.31Å; M205-L208 PolarHBondContact O-N 3.18Å; M205-L208 HydrophobicContact SD-CD2 4.06Å; L208-Y210 PolarHBondContact O-N 2.87Å; L208-Y211 PolarHBondContact O-N 3.26Å; L208-F212 PolarHBondContact O-N 3Å
209	F	98.1	Very high	96.4	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-65.2	-28.7	173.1	-73.3	-45.5	0	0	0	113.2	F185 M205 F212 A213 S341 L344 T345 L348 L489 L493	F185-F209 HydrophobicContact CE1-CE1 4.41Å; F185-F209 AromaticContact CE2-CD1 3.83Å; F185-F209 HydrophobicContact CE2-CD1 3.83Å; F185-F209 HydrophobicContact CE2-CE1 4.04Å; F185-F209 AromaticContact CZ-CD1 3.82Å; F185-F209 HydrophobicContact CZ-CD1 3.82Å; F185-F209 AromaticContact CZ-CE1 3.53Å; F185-F209 HydrophobicContact CZ-CE1 3.53Å; F185-F209 HydrophobicContact CZ-CZ 4.49Å; M205-F209 HydrophobicContact CB-CE2 4.45Å; M205-F209 HydrophobicContact CE-CD1 4.46Å; M205-F209 HydrophobicContact CE-CD2 4.14Å; M205-F209 HydrophobicContact CE-CE1 3.93Å; M205-F209 HydrophobicContact CE-CE2 3.6Å; M205-F209 HydrophobicContact CE-CZ 3.49Å; M205-F209 VanDerWaalsContact CE-CZ 3.49Å; M205-F209 VanDerWaalsContact O-CD2 3.24Å; M205-F209 WeakPolarHBondContact O-CD2 3.39Å; M205-F209 WeakPolarHBondContact O-CG 3.41Å; M205-F209 PolarHBondContact O-N 3.43Å; F209-F212 PolarHBondContact O-N 3.38Å; F209-A213 WeakPolarHBondContact O-CB 3.32Å; F209-A213 PolarHBondContact O-N 2.9Å; F209-S341 WeakPolarHBondContact O-CB 3.26Å; F209-L344 HydrophobicContact CD1-CB 4.12Å; F209-L344 HydrophobicContact CD1-CD1 3.92Å; F209-L344 HydrophobicContact CD2-CB 3.92Å; F209-L344 HydrophobicContact CE1-CB 4.17Å; F209-L344 HydrophobicContact CE1-CD1 4.28Å; F209-L344 HydrophobicContact CE2-CB 3.93Å; F209-L344 HydrophobicContact CG-CB 4Å; F209-L344 HydrophobicContact CG-CD1 4.32Å; F209-L344 HydrophobicContact CZ-CB 4.05Å; F209-T345 WeakPolarHBondContact CD2-OG1 3.22Å; F209-L348 HydrophobicContact CE2-CD1 3.84Å; F209-L348 HydrophobicContact CE2-CG 4.31Å; F209-L348 HydrophobicContact CZ-CD1 3.49Å; F209-L348 VanDerWaalsContact CZ-CD1 3.49Å; F209-L348 HydrophobicContact CZ-CG 4.09Å; F209-L489 HydrophobicContact CD1-CD2 3.89Å; F209-L489 HydrophobicContact CE1-CD2 3.65Å; F209-L489 HydrophobicContact CE1-CG 4.48Å; F209-L493 HydrophobicContact CE1-CD1 4.13Å; F209-L493 HydrophobicContact CZ-CD1 4.12Å
210	Y	96.4	Very high	96.5	Very high	14 Å²	14	19.3 Å²	19.3	6%	0.055	10%	0.103	C	C	.	.	H	α-helix	trans	-62.4	-47.2	173	-158.9	-73.4	0	0	0	111.1	A206 Q207 L208 A213 L214 V241 I244 V337 D338	A206-Y210 WeakPolarHBondContact O-CB 3.31Å; A206-Y210 PolarHBondContact O-N 3.33Å; Q207-Y210 VanDerWaalsContact O-CB 3.22Å; Q207-Y210 WeakPolarHBondContact O-CB 3.48Å; Q207-Y210 PolarHBondContact O-N 3.15Å; L208-Y210 PolarHBondContact O-N 2.87Å; Y210-A213 PolarHBondContact O-N 3.29Å; Y210-L214 VanDerWaalsContact O-CB 3.31Å; Y210-L214 WeakPolarHBondContact O-CB 3.39Å; Y210-L214 PolarHBondContact O-N 3.45Å; Y210-V241 HydrophobicContact CD1-CB 4.38Å; Y210-V241 HydrophobicContact CD1-CG1 3.87Å; Y210-V241 HydrophobicContact CD1-CG2 3.82Å; Y210-V241 HydrophobicContact CE1-CB 3.9Å; Y210-V241 HydrophobicContact CE1-CG1 3.62Å; Y210-V241 HydrophobicContact CE1-CG2 3.57Å; Y210-I244 VanDerWaalsContact OH-CB 3.31Å; Y210-I244 WeakPolarHBondContact OH-CB 3.19Å; Y210-I244 VanDerWaalsContact OH-CD1 3.22Å; Y210-I244 WeakPolarHBondContact OH-CD1 3.49Å; Y210-I244 WeakPolarHBondContact OH-CG2 3.33Å; Y210-V337 HydrophobicContact CD1-CG1 3.3Å; Y210-V337 HydrophobicContact CD2-CG1 4.2Å; Y210-V337 HydrophobicContact CE1-CB 4.15Å; Y210-V337 HydrophobicContact CE1-CG1 3.15Å; Y210-V337 HydrophobicContact CE2-CG1 4.11Å; Y210-V337 HydrophobicContact CG-CG1 3.83Å; Y210-V337 WeakPolarHBondContact O-CG1 3.2Å; Y210-D338 WeakPolarHBondContact CE2-OD1 3.39Å; Y210-D338 VanDerWaalsContact CZ-OD1 3.31Å; Y210-D338 PolarHBondContact OH-OD1 2.89Å
211	Y	97.6	Very high	96.6	Very high	32 Å²	32	17.7 Å²	17.7	13%	0.125	9%	0.094	C	C	.	.	H	α-helix	trans	-65.6	-39.6	175.8	-67.6	-55.2	0	0	0	112	Q207 L208 L214 E215 C228 I233 T237 V241	Q207-Y211 HydrophobicContact CG-CD2 4.27Å; Q207-Y211 HydrophobicContact CG-CE2 3.71Å; Q207-Y211 VanDerWaalsContact NE2-CE2 3.32Å; Q207-Y211 VanDerWaalsContact O-CD2 3.27Å; Q207-Y211 WeakPolarHBondContact O-CD2 3.07Å; Q207-Y211 PolarHBondContact O-N 3.2Å; Q207-Y211 VanDerWaalsContact O-N 3.15Å; L208-Y211 PolarHBondContact O-N 3.26Å; Y211-L214 PolarHBondContact O-N 2.74Å; Y211-E215 WeakPolarHBondContact O-CB 3.19Å; Y211-E215 PolarHBondContact O-N 3.18Å; Y211-C228 HydrophobicContact CD1-CB 4.04Å; Y211-C228 PolarHBondContact O-SG 3.21Å; Y211-I233 HydrophobicContact CD1-CD1 4.38Å; Y211-I233 HydrophobicContact CD2-CD1 3.94Å; Y211-I233 HydrophobicContact CE1-CD1 3.94Å; Y211-I233 HydrophobicContact CE1-CG2 4.06Å; Y211-I233 HydrophobicContact CE2-CD1 3.44Å; Y211-I233 VanDerWaalsContact CE2-CD1 3.44Å; Y211-I233 HydrophobicContact CG-CD1 4.39Å; Y211-I233 VanDerWaalsContact CZ-CD1 3.44Å; Y211-T237 HydrophobicContact CD1-CG2 4.42Å; Y211-T237 HydrophobicContact CE1-CG2 4.33Å; Y211-V241 HydrophobicContact CD1-CG2 4.32Å; Y211-V241 HydrophobicContact CE1-CG2 3.84Å
212	F	98.2	Very high	96.6	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-55.6	-55.2	172.2	170.2	-101.3	0	0	0	112.2	V181 I182 F185 L208 F209 L214 E215 A216 L229 L344 L489	V181-F212 HydrophobicContact CG1-CD2 3.87Å; V181-F212 HydrophobicContact CG1-CE2 3.82Å; I182-F212 HydrophobicContact CG1-CE2 3.55Å; I182-F212 HydrophobicContact CG1-CZ 3.87Å; F185-F212 HydrophobicContact CB-CD2 3.98Å; F185-F212 HydrophobicContact CD2-CB 3.68Å; F185-F212 HydrophobicContact CD2-CD2 4.05Å; F185-F212 HydrophobicContact CD2-CG 4.11Å; F185-F212 HydrophobicContact CE2-CB 4.01Å; F185-F212 HydrophobicContact CG-CD2 4.15Å; L208-F212 PolarHBondContact O-N 3Å; F209-F212 PolarHBondContact O-N 3.38Å; F212-L214 PolarHBondContact O-N 2.91Å; F212-E215 PolarHBondContact O-N 3.44Å; F212-A216 HydrophobicContact CZ-CB 4.49Å; F212-A216 VanDerWaalsContact O-CB 3.24Å; F212-A216 WeakPolarHBondContact O-CB 3.44Å; F212-A216 PolarHBondContact O-N 3.32Å; F212-L229 HydrophobicContact CB-CD2 4.43Å; F212-L344 HydrophobicContact CD1-CD1 4.15Å; F212-L344 HydrophobicContact CE1-CD1 4.24Å; F212-L489 HydrophobicContact CD1-CD2 3.61Å; F212-L489 HydrophobicContact CD2-CD2 4.23Å; F212-L489 HydrophobicContact CE1-CB 4.38Å; F212-L489 HydrophobicContact CE1-CD2 3.54Å; F212-L489 HydrophobicContact CE2-CD2 4.16Å; F212-L489 HydrophobicContact CG-CD2 3.97Å; F212-L489 HydrophobicContact CZ-CB 4.13Å; F212-L489 HydrophobicContact CZ-CD2 3.82Å; F212-L489 HydrophobicContact CZ-CG 4.46Å
213	A	97.9	Very high	96.4	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-62.7	-35.5	-177.5	0	0	0	0	0	111.5	F209 Y210 I217 V337 T340	F209-A213 WeakPolarHBondContact O-CB 3.32Å; F209-A213 PolarHBondContact O-N 2.9Å; Y210-A213 PolarHBondContact O-N 3.29Å; A213-I217 WeakPolarHBondContact O-CB 3.23Å; A213-I217 WeakPolarHBondContact O-CG2 3.41Å; A213-I217 PolarHBondContact O-N 3.24Å; A213-V337 HydrophobicContact CB-CG1 4.34Å; A213-T340 HydrophobicContact CB-CG2 4.35Å
214	L	97.6	Very high	96.3	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-66.6	-49.8	175.4	178.4	52.9	0	0	0	112.3	Y210 Y211 F212 A216 I217 C218 I226 T237 F240 V241 L333 V337	Y210-L214 VanDerWaalsContact O-CB 3.31Å; Y210-L214 WeakPolarHBondContact O-CB 3.39Å; Y210-L214 PolarHBondContact O-N 3.45Å; Y211-L214 PolarHBondContact O-N 2.74Å; F212-L214 PolarHBondContact O-N 2.91Å; L214-A216 VanDerWaalsContact C-N 3.29Å; L214-A216 PolarHBondContact O-N 3.14Å; L214-I217 WeakPolarHBondContact O-CG2 3.43Å; L214-C218 VanDerWaalsContact O-CB 3.23Å; L214-C218 WeakPolarHBondContact O-CB 3.43Å; L214-C218 PolarHBondContact O-N 2.99Å; L214-C218 PolarHBondContact O-SG 3.35Å; L214-C218 VanDerWaalsContact O-SG 3.34Å; L214-I226 HydrophobicContact CD1-CD1 4.16Å; L214-I226 HydrophobicContact CD2-CD1 4.17Å; L214-I226 HydrophobicContact CG-CD1 3.68Å; L214-T237 HydrophobicContact CD2-CG2 3.55Å; L214-F240 HydrophobicContact CD1-CD1 3.96Å; L214-F240 HydrophobicContact CD1-CE1 3.59Å; L214-F240 HydrophobicContact CD1-CZ 4.48Å; L214-F240 HydrophobicContact CD2-CD1 3.85Å; L214-F240 HydrophobicContact CD2-CE1 4.23Å; L214-V241 HydrophobicContact CD2-CG2 3.86Å; L214-L333 HydrophobicContact CD1-CD1 4.01Å; L214-V337 HydrophobicContact CB-CG1 3.87Å; L214-V337 HydrophobicContact CB-CG2 4.25Å; L214-V337 HydrophobicContact CD1-CG2 3.99Å
215	E	97.9	Very high	96.3	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-57.2	-46.7	175.9	-170	74.4	-165.5	0	0	110.6	V181 Y211 F212 C218 Y219 R225 I226 G227 C228 L229	V181-E215 HydrophobicContact CG1-CB 3.9Å; V181-E215 HydrophobicContact CG1-CG 3.77Å; V181-E215 HydrophobicContact CG2-CG 4.17Å; Y211-E215 WeakPolarHBondContact O-CB 3.19Å; Y211-E215 PolarHBondContact O-N 3.18Å; F212-E215 PolarHBondContact O-N 3.44Å; E215-C218 PolarHBondContact O-N 2.87Å; E215-Y219 WeakPolarHBondContact O-CB 3.35Å; E215-Y219 PolarHBondContact O-N 3.17Å; E215-R225 WeakPolarHBondContact OE1-CA 3.38Å; E215-R225 IonicContact OE1-CZ 3.41Å; E215-R225 IonicContact OE1-NE 3.22Å; E215-R225 PolarHBondContact OE1-NE 3.18Å; E215-R225 IonicContact OE1-NH2 2.77Å; E215-R225 PolarHBondContact OE1-NH2 2.89Å; E215-R225 VanDerWaalsContact OE1-NH2 3.16Å; E215-I226 PolarHBondContact OE1-N 3.25Å; E215-I226 VanDerWaalsContact OE1-N 3.1Å; E215-I226 WeakPolarHBondContact OE2-CG1 3.47Å; E215-G227 PolarHBondContact OE1-N 2.62Å; E215-G227 VanDerWaalsContact OE1-N 3.12Å; E215-G227 PolarHBondContact OE2-N 3.16Å; E215-C228 PolarHBondContact OE2-N 3.16Å; E215-C228 PolarHBondContact OE2-SG 3.15Å; E215-L229 HydrophobicContact CB-CD1 4.12Å; E215-L229 HydrophobicContact CB-CG 4.25Å; E215-L229 HydrophobicContact CG-CD1 4.06Å; E215-L229 HydrophobicContact CG-CG 4.38Å
216	A	97.6	Very high	96.3	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.008	9%	0.094	C	C	.	.	H	α-helix	trans	-62.5	-53.8	-178	0	0	0	0	0	111.2	F178 V181 F212 L214 C218 Y219 I220	F178-A216 HydrophobicContact CD1-CB 4.03Å; F178-A216 HydrophobicContact CE1-CB 3.86Å; V181-A216 HydrophobicContact CG1-CB 4.14Å; F212-A216 HydrophobicContact CZ-CB 4.49Å; F212-A216 VanDerWaalsContact O-CB 3.24Å; F212-A216 WeakPolarHBondContact O-CB 3.44Å; F212-A216 PolarHBondContact O-N 3.32Å; L214-A216 VanDerWaalsContact C-N 3.29Å; L214-A216 PolarHBondContact O-N 3.14Å; A216-C218 VanDerWaalsContact C-N 3.33Å; A216-C218 PolarHBondContact O-N 2.92Å; A216-Y219 PolarHBondContact O-N 3.3Å; A216-Y219 VanDerWaalsContact O-N 3.15Å; A216-I220 WeakPolarHBondContact O-CG1 3.36Å; A216-I220 PolarHBondContact O-N 3.15Å
217	I	96.4	Very high	96.3	Very high	14 Å²	14	20.2 Å²	20.2	7%	0.072	9%	0.09	C	C	.	.	H	α-helix	trans	-67.9	-32.1	-179.2	-164.9	62.3	0	0	0	112.4	A213 L214 Y219 I220 L221 L333 V337 I481	A213-I217 WeakPolarHBondContact O-CB 3.23Å; A213-I217 WeakPolarHBondContact O-CG2 3.41Å; A213-I217 PolarHBondContact O-N 3.24Å; L214-I217 WeakPolarHBondContact O-CG2 3.43Å; I217-Y219 VanDerWaalsContact C-N 3.32Å; I217-I220 PolarHBondContact O-N 3.42Å; I217-L221 HydrophobicContact CD1-CD1 4Å; I217-L221 HydrophobicContact CD1-CD2 4.37Å; I217-L221 HydrophobicContact CD1-CG 3.85Å; I217-L221 HydrophobicContact CG1-CD1 3.69Å; I217-L221 HydrophobicContact CG1-CG 3.94Å; I217-L221 VanDerWaalsContact O-CB 3.32Å; I217-L221 WeakPolarHBondContact O-CB 3.33Å; I217-L221 WeakPolarHBondContact O-CG 3.46Å; I217-L221 PolarHBondContact O-N 3.34Å; I217-L333 HydrophobicContact CG2-CD1 3.64Å; I217-V337 HydrophobicContact CG2-CG2 4.19Å; I217-I481 HydrophobicContact CD1-CG2 4.47Å
218	C	96.8	Very high	96.2	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-61.3	-43.8	171.9	-83.2	0	0	0	0	111.1	L214 E215 A216 F222 E223 K224 I226 L333	L214-C218 VanDerWaalsContact O-CB 3.23Å; L214-C218 WeakPolarHBondContact O-CB 3.43Å; L214-C218 PolarHBondContact O-N 2.99Å; L214-C218 PolarHBondContact O-SG 3.35Å; L214-C218 VanDerWaalsContact O-SG 3.34Å; E215-C218 PolarHBondContact O-N 2.87Å; A216-C218 VanDerWaalsContact C-N 3.33Å; A216-C218 PolarHBondContact O-N 2.92Å; C218-F222 WeakPolarHBondContact O-CA 3.49Å; C218-F222 WeakPolarHBondContact O-CB 3.42Å; C218-F222 PolarHBondContact O-N 2.85Å; C218-E223 PolarHBondContact O-N 2.81Å; C218-K224 CarbonylContact C-O 3.59Å; C218-I226 HydrophobicContact CB-CD1 4.14Å; C218-I226 HydrophobicContact CB-CG1 4.38Å; C218-I226 HydrophobicContact CB-CG2 3.98Å; C218-I226 VanDerWaalsContact SG-CD1 3.56Å; C218-L333 WeakPolarHBondContact SG-CD1 3.25Å
219	Y	96.1	Very high	96.2	Very high	59 Å²	59	17.2 Å²	17.2	23%	0.231	8%	0.076	C	C	.	.	H	α-helix	trans	-65.4	-41.6	179	-168.4	-163.5	0	0	0	111.6	A177 V181 E215 A216 I217 E223 K224 R225	A177-Y219 HydrophobicContact CB-CD1 3.79Å; A177-Y219 HydrophobicContact CB-CE1 3.43Å; A177-Y219 VanDerWaalsContact CB-CE1 3.43Å; V181-Y219 HydrophobicContact CG2-CD1 3.86Å; E215-Y219 WeakPolarHBondContact O-CB 3.35Å; E215-Y219 PolarHBondContact O-N 3.17Å; A216-Y219 PolarHBondContact O-N 3.3Å; A216-Y219 VanDerWaalsContact O-N 3.15Å; I217-Y219 VanDerWaalsContact C-N 3.32Å; Y219-E223 WeakPolarHBondContact O-CA 3.32Å; Y219-E223 PolarHBondContact O-N 3.44Å; Y219-K224 PolarHBondContact N-O 2.61Å; Y219-R225 HydrophobicContact CD2-CG 4.5Å
220	I	94.6	Very high	96	Very high	4 Å²	4	23.1 Å²	23.1	2%	0.021	10%	0.104	C	C	.	.	H	α-helix	trans	-67.2	-47.6	177.6	-58.7	-45.1	0	0	0	112.2	L165 Y174 A177 F178 A216 I217 Y310	L165-I220 HydrophobicContact CD2-CG2 4.17Å; Y174-I220 HydrophobicContact CD1-CD1 3.54Å; Y174-I220 HydrophobicContact CD1-CG2 4.39Å; Y174-I220 HydrophobicContact CD2-CG2 4.44Å; Y174-I220 HydrophobicContact CE1-CD1 4.22Å; Y174-I220 HydrophobicContact CE1-CG2 4.09Å; Y174-I220 HydrophobicContact CE2-CG2 4.16Å; Y174-I220 HydrophobicContact CG-CD1 3.7Å; A177-I220 HydrophobicContact CB-CD1 4.38Å; F178-I220 HydrophobicContact CE1-CD1 4.14Å; F178-I220 HydrophobicContact CE1-CG1 3.89Å; F178-I220 HydrophobicContact CE2-CD1 4.31Å; F178-I220 HydrophobicContact CE2-CG1 4.5Å; F178-I220 HydrophobicContact CZ-CD1 3.97Å; F178-I220 HydrophobicContact CZ-CG1 3.74Å; A216-I220 WeakPolarHBondContact O-CG1 3.36Å; A216-I220 PolarHBondContact O-N 3.15Å; I217-I220 PolarHBondContact O-N 3.42Å; I220-Y310 WeakPolarHBondContact O-CB 3.39Å
221	L	95.3	Very high	95.8	Very high	1 Å²	1	31 Å²	31	1%	0.005	13%	0.133	C	C	.	.	H	α-helix	trans	-80.4	-38.8	-171.4	-67.9	-176.7	0	0	0	113.1	I217 Y310 L311 L329 L332 L333	I217-L221 HydrophobicContact CD1-CD1 4Å; I217-L221 HydrophobicContact CD1-CD2 4.37Å; I217-L221 HydrophobicContact CD1-CG 3.85Å; I217-L221 HydrophobicContact CG1-CD1 3.69Å; I217-L221 HydrophobicContact CG1-CG 3.94Å; I217-L221 VanDerWaalsContact O-CB 3.32Å; I217-L221 WeakPolarHBondContact O-CB 3.33Å; I217-L221 WeakPolarHBondContact O-CG 3.46Å; I217-L221 PolarHBondContact O-N 3.34Å; L221-Y310 HydrophobicContact CD2-CD1 3.76Å; L221-Y310 HydrophobicContact CD2-CE1 3.79Å; L221-L311 WeakPolarHBondContact O-CB 3.12Å; L221-L329 HydrophobicContact CB-CD1 3.96Å; L221-L329 HydrophobicContact CD2-CD1 4.3Å; L221-L332 HydrophobicContact CD1-CB 3.7Å; L221-L332 HydrophobicContact CD2-CB 4.43Å; L221-L332 HydrophobicContact CD2-CD1 4.33Å; L221-L333 HydrophobicContact CD1-CB 4.19Å
222	F	94.9	Very high	95.6	Very high	4 Å²	4	34.1 Å²	34.1	2%	0.018	16%	0.16	C	C	.	.	H	α-helix	trans	-117.9	1	-171.4	-52.7	-83.5	0	0	0	113	C218 K224 L285 I286 L311 L329 L333	C218-F222 WeakPolarHBondContact O-CA 3.49Å; C218-F222 WeakPolarHBondContact O-CB 3.42Å; C218-F222 PolarHBondContact O-N 2.85Å; F222-K224 HydrophobicContact CB-CB 4.43Å; F222-K224 PolarHBondContact O-N 3.43Å; F222-L285 HydrophobicContact CB-CB 4.08Å; F222-L285 HydrophobicContact CB-CD1 4.43Å; F222-L285 HydrophobicContact CD1-CB 3.57Å; F222-L285 HydrophobicContact CD1-CD1 4.36Å; F222-L285 HydrophobicContact CD2-CB 4.27Å; F222-L285 HydrophobicContact CD2-CD1 3.57Å; F222-L285 HydrophobicContact CE1-CB 4.04Å; F222-L285 HydrophobicContact CE2-CD1 3.81Å; F222-L285 HydrophobicContact CG-CB 3.71Å; F222-L285 HydrophobicContact CG-CD1 3.87Å; F222-L285 HydrophobicContact CG-CG 4.42Å; F222-L285 HydrophobicContact CZ-CD1 4.31Å; F222-I286 HydrophobicContact CD1-CG1 4.09Å; F222-I286 HydrophobicContact CE1-CD1 4.19Å; F222-I286 HydrophobicContact CE1-CG1 3.71Å; F222-L311 HydrophobicContact CD1-CD2 3.93Å; F222-L329 HydrophobicContact CE1-CB 3.72Å; F222-L329 HydrophobicContact CE1-CD1 4.07Å; F222-L329 HydrophobicContact CE1-CG 4.2Å; F222-L329 HydrophobicContact CZ-CB 3.8Å; F222-L329 HydrophobicContact CZ-CD1 4.3Å; F222-L333 HydrophobicContact CE2-CB 4.13Å; F222-L333 HydrophobicContact CE2-CD1 3.8Å; F222-L333 HydrophobicContact CE2-CD2 4.18Å; F222-L333 HydrophobicContact CE2-CG 4.25Å; F222-L333 HydrophobicContact CZ-CB 4.4Å
223	E	92.8	Very high	95.4	Very high	42 Å²	42	36.1 Å²	36.1	20%	0.196	17%	0.17	C	C	.	.	S	Bend	trans	61	25.9	179.9	-57.2	156.4	-135.3	0	0	112.4	C218 Y219 K289 S308 G309 Y310 L311 H312	C218-E223 PolarHBondContact O-N 2.81Å; Y219-E223 WeakPolarHBondContact O-CA 3.32Å; Y219-E223 PolarHBondContact O-N 3.44Å; E223-K289 WeakPolarHBondContact OE2-CE 3.41Å; E223-K289 IonicContact OE2-NZ 2.74Å; E223-K289 PolarHBondContact OE2-NZ 3.46Å; E223-S308 VanDerWaalsContact CD-O 3.25Å; E223-G309 VanDerWaalsContact CD-CA 3.41Å; E223-G309 WeakPolarHBondContact OE1-CA 3.15Å; E223-Y310 PolarHBondContact OE1-N 3.03Å; E223-Y310 VanDerWaalsContact OE1-N 3.07Å; E223-L311 PolarHBondContact OE1-N 3.37Å; E223-H312 PolarHBondContact OE1-N 3.47Å; E223-H312 VanDerWaalsContact OE1-N 3.07Å
224	K	93.8	Very high	95.2	Very high	71 Å²	71	38.3 Å²	38.3	31%	0.309	18%	0.184	S	C	.	.			trans	-126.4	126.7	-172.5	-171.7	158.7	-173.8	166.4	0	112.5	C218 Y219 F222 I226 L285 E288	C218-K224 CarbonylContact C-O 3.59Å; Y219-K224 PolarHBondContact N-O 2.61Å; F222-K224 HydrophobicContact CB-CB 4.43Å; F222-K224 PolarHBondContact O-N 3.43Å; K224-I226 HydrophobicContact CG-CG2 4.36Å; K224-L285 HydrophobicContact CD-CD2 3.95Å; K224-E288 WeakPolarHBondContact CD-OE2 3.43Å; K224-E288 WeakPolarHBondContact CE-OE2 3.3Å; K224-E288 IonicContact NZ-OE1 3.16Å; K224-E288 PolarHBondContact NZ-OE1 2.91Å; K224-E288 VanDerWaalsContact NZ-OE1 3.15Å; K224-E288 IonicContact NZ-OE2 3.35Å; K224-E288 PolarHBondContact NZ-OE2 3.4Å
225	R	95.6	Very high	95	Very high	80 Å²	80	46 Å²	46	30%	0.302	22%	0.22	S	C	.	.			trans	-80	117.6	165.9	-60.6	-59.8	-51.9	-83.1	-10.8	108.5	D184 E215 Y219	D184-R225 IonicContact OD2-CZ 3.55Å; D184-R225 VanDerWaalsContact OD2-CZ 3.3Å; D184-R225 IonicContact OD2-NH1 3.88Å; D184-R225 PolarHBondContact OD2-NH1 3.48Å; D184-R225 VanDerWaalsContact OD2-NH1 3.14Å; D184-R225 IonicContact OD2-NH2 3.79Å; D184-R225 PolarHBondContact OD2-NH2 2.88Å; E215-R225 WeakPolarHBondContact OE1-CA 3.38Å; E215-R225 IonicContact OE1-CZ 3.41Å; E215-R225 IonicContact OE1-NE 3.22Å; E215-R225 PolarHBondContact OE1-NE 3.18Å; E215-R225 IonicContact OE1-NH2 2.77Å; E215-R225 PolarHBondContact OE1-NH2 2.89Å; E215-R225 VanDerWaalsContact OE1-NH2 3.16Å; Y219-R225 HydrophobicContact CD2-CG 4.5Å
226	I	95.6	Very high	94.7	Very high	22 Å²	22	48.6 Å²	48.6	11%	0.113	23%	0.234	C	C	.	.			trans	-96.6	-6	-175.7	64.2	173.9	0	0	0	112.3	L214 E215 C218 K224 C228 P234 T237 F281 L285	L214-I226 HydrophobicContact CD1-CD1 4.16Å; L214-I226 HydrophobicContact CD2-CD1 4.17Å; L214-I226 HydrophobicContact CG-CD1 3.68Å; E215-I226 PolarHBondContact OE1-N 3.25Å; E215-I226 VanDerWaalsContact OE1-N 3.1Å; E215-I226 WeakPolarHBondContact OE2-CG1 3.47Å; C218-I226 HydrophobicContact CB-CD1 4.14Å; C218-I226 HydrophobicContact CB-CG1 4.38Å; C218-I226 HydrophobicContact CB-CG2 3.98Å; C218-I226 VanDerWaalsContact SG-CD1 3.56Å; K224-I226 HydrophobicContact CG-CG2 4.36Å; I226-C228 VanDerWaalsContact C-N 3.35Å; I226-C228 HydrophobicContact CD1-CB 4.28Å; I226-C228 HydrophobicContact CG1-CB 4.24Å; I226-C228 PolarHBondContact O-N 3.32Å; I226-P234 WeakPolarHBondContact O-CG 3.22Å; I226-T237 HydrophobicContact CD1-CG2 4.39Å; I226-F281 HydrophobicContact CD1-CZ 4.24Å; I226-L285 HydrophobicContact CG2-CD2 4.19Å
227	G	95.8	Very high	94.5	Very high	9 Å²	9	48.6 Å²	48.6	9%	0.093	23%	0.234	C	C	.	.			trans	73.6	20.9	172.3	0	0	0	0	0	114.4	E215 L229 Q230	E215-G227 PolarHBondContact OE1-N 2.62Å; E215-G227 VanDerWaalsContact OE1-N 3.12Å; E215-G227 PolarHBondContact OE2-N 3.16Å; G227-L229 PolarHBondContact O-N 3.39Å; G227-Q230 VanDerWaalsContact O-CB 3.32Å; G227-Q230 WeakPolarHBondContact O-CB 3.33Å; G227-Q230 WeakPolarHBondContact O-CG 3.45Å; G227-Q230 PolarHBondContact O-N 2.9Å; G227-Q230 VanDerWaalsContact O-N 3.12Å
228	C	94.4	Very high	94.3	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.007	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-1.7	-176.5	71.7	0	0	0	0	114.4	Y211 E215 I226 I233 T237	Y211-C228 HydrophobicContact CD1-CB 4.04Å; Y211-C228 PolarHBondContact O-SG 3.21Å; E215-C228 PolarHBondContact OE2-N 3.16Å; E215-C228 PolarHBondContact OE2-SG 3.15Å; I226-C228 VanDerWaalsContact C-N 3.35Å; I226-C228 HydrophobicContact CD1-CB 4.28Å; I226-C228 HydrophobicContact CG1-CB 4.24Å; I226-C228 PolarHBondContact O-N 3.32Å; C228-I233 HydrophobicContact CB-CG2 4.13Å; C228-T237 HydrophobicContact CB-CG2 3.48Å; C228-T237 VanDerWaalsContact CB-CG2 3.48Å
229	L	96.6	Very high	94.2	Very high	7 Å²	7	53 Å²	53	4%	0.037	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-3.8	168.6	-64.3	175	0	0	0	113.2	V181 D184 F185 R188 F212 E215 G227	V181-L229 HydrophobicContact CG1-CD1 3.8Å; V181-L229 WeakPolarHBondContact O-CD1 3.27Å; D184-L229 HydrophobicContact CB-CB 4.35Å; D184-L229 HydrophobicContact CB-CD1 4.13Å; F185-L229 HydrophobicContact CB-CD1 4.04Å; F185-L229 HydrophobicContact CD2-CD2 4.22Å; R188-L229 VanDerWaalsContact CB-O 3.32Å; R188-L229 WeakPolarHBondContact CB-O 3.27Å; R188-L229 VanDerWaalsContact CD-O 3.27Å; R188-L229 WeakPolarHBondContact CD-O 3.42Å; R188-L229 VanDerWaalsContact CG-O 3.24Å; R188-L229 WeakPolarHBondContact CG-O 3.36Å; F212-L229 HydrophobicContact CB-CD2 4.43Å; E215-L229 HydrophobicContact CB-CD1 4.12Å; E215-L229 HydrophobicContact CB-CG 4.25Å; E215-L229 HydrophobicContact CG-CD1 4.06Å; E215-L229 HydrophobicContact CG-CG 4.38Å; G227-L229 PolarHBondContact O-N 3.39Å
230	Q	94.5	Very high	94.1	Very high	125 Å²	125	50.2 Å²	50.2	58%	0.584	25%	0.25	S	S	*	.	S	Bend	trans	-73.7	169.9	176.7	-61	177.2	8.3	0	0	111.6	G227 S232	G227-Q230 VanDerWaalsContact O-CB 3.32Å; G227-Q230 WeakPolarHBondContact O-CB 3.33Å; G227-Q230 WeakPolarHBondContact O-CG 3.45Å; G227-Q230 PolarHBondContact O-N 2.9Å; G227-Q230 VanDerWaalsContact O-N 3.12Å; Q230-S232 VanDerWaalsContact C-N 3.32Å; Q230-S232 PolarHBondContact O-N 3.38Å
231	R	91.5	Very high	94	Very high	178 Å²	178	50.8 Å²	50.8	67%	0.672	25%	0.254	S	S	*	.	S	Bend	trans	-63	-38.7	178.7	-170.9	175.9	-174.6	129.7	14.3	112.4	E195	E195-R231 IonicContact OE1-CZ 2.75Å; E195-R231 IonicContact OE1-NE 3.89Å; E195-R231 IonicContact OE1-NH1 3.49Å; E195-R231 PolarHBondContact OE1-NH1 3.41Å; E195-R231 IonicContact OE1-NH2 3.11Å; E195-R231 PolarHBondContact OE1-NH2 3.35Å
232	S	93.3	Very high	93.9	Very high	98 Å²	98	58.6 Å²	58.6	69%	0.685	28%	0.283	S	S	*	.	S	Bend	trans	-103.9	118.1	173.4	-172.2	0	0	0	0	108.8	Q230	Q230-S232 VanDerWaalsContact C-N 3.32Å; Q230-S232 PolarHBondContact O-N 3.38Å
233	I	93.3	Very high	93.9	Very high	43 Å²	43	58.8 Å²	58.8	22%	0.221	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-92.3	131.4	-178.2	-55.9	178.9	0	0	0	108.3	Y211 C228 T237 V238	Y211-I233 HydrophobicContact CD1-CD1 4.38Å; Y211-I233 HydrophobicContact CD2-CD1 3.94Å; Y211-I233 HydrophobicContact CE1-CD1 3.94Å; Y211-I233 HydrophobicContact CE1-CG2 4.06Å; Y211-I233 HydrophobicContact CE2-CD1 3.44Å; Y211-I233 VanDerWaalsContact CE2-CD1 3.44Å; Y211-I233 HydrophobicContact CG-CD1 4.39Å; Y211-I233 VanDerWaalsContact CZ-CD1 3.44Å; C228-I233 HydrophobicContact CB-CG2 4.13Å; I233-T237 HydrophobicContact CG2-CG2 4.07Å; I233-V238 HydrophobicContact CB-CG2 4.21Å; I233-V238 HydrophobicContact CG2-CG2 3.81Å
234	P	93.9	Very high	94	Very high	46 Å²	46	56.8 Å²	56.8	30%	0.299	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-54.9	138.6	175.3	-29.3	38.1	0	0	0	113.3	I226 D236 T237 V238	I226-P234 WeakPolarHBondContact O-CG 3.22Å; P234-D236 VanDerWaalsContact C-N 3.3Å; P234-D236 WeakPolarHBondContact CB-OD1 3.31Å; P234-D236 PolarHBondContact O-N 2.81Å; P234-T237 WeakPolarHBondContact O-CB 3.38Å; P234-T237 PolarHBondContact O-N 3.44Å; P234-T237 VanDerWaalsContact O-N 3.14Å; P234-V238 PolarHBondContact O-N 3.19Å; P234-V238 VanDerWaalsContact O-N 3.13Å
235	E	93.4	Very high	93.8	Very high	162 Å²	162	54 Å²	54	76%	0.757	27%	0.267	S	S	*	.	H	α-helix	trans	-64.2	-34.5	-175.3	-176.5	175.8	-173.8	0	0	112.9	T237 V238 T239	E235-T237 VanDerWaalsContact C-N 3.31Å; E235-T237 PolarHBondContact O-N 3.17Å; E235-V238 PolarHBondContact O-N 3.25Å; E235-T239 WeakPolarHBondContact O-CB 3.37Å; E235-T239 PolarHBondContact O-N 3.3Å; E235-T239 PolarHBondContact O-OG1 2.93Å; E235-T239 VanDerWaalsContact O-OG1 3.06Å
236	D	92.4	Very high	93.6	Very high	53 Å²	53	52.7 Å²	52.7	28%	0.283	27%	0.266	S	S	.	.	H	α-helix	trans	-61.6	-39.9	174.9	60.5	-6.7	0	0	0	111.8	P234 T239 F240 F281 K284	P234-D236 VanDerWaalsContact C-N 3.3Å; P234-D236 WeakPolarHBondContact CB-OD1 3.31Å; P234-D236 PolarHBondContact O-N 2.81Å; D236-T239 WeakPolarHBondContact O-CB 3.42Å; D236-T239 PolarHBondContact O-N 3.23Å; D236-F240 WeakPolarHBondContact O-CB 3.37Å; D236-F240 PolarHBondContact O-N 3.15Å; D236-F281 HydrophobicContact CB-CD2 4.42Å; D236-F281 HydrophobicContact CB-CE2 4.39Å; D236-K284 IonicContact OD2-NZ 3.14Å; D236-K284 PolarHBondContact OD2-NZ 3.09Å
237	T	93	Very high	93.5	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.006	26%	0.26	C	S	.	.	H	α-helix	trans	-66.9	-44.5	176.5	-61.9	0	0	0	0	111.2	Y211 L214 I226 C228 I233 P234 E235 T239 F240 V241	Y211-T237 HydrophobicContact CD1-CG2 4.42Å; Y211-T237 HydrophobicContact CE1-CG2 4.33Å; L214-T237 HydrophobicContact CD2-CG2 3.55Å; I226-T237 HydrophobicContact CD1-CG2 4.39Å; C228-T237 HydrophobicContact CB-CG2 3.48Å; C228-T237 VanDerWaalsContact CB-CG2 3.48Å; I233-T237 HydrophobicContact CG2-CG2 4.07Å; P234-T237 WeakPolarHBondContact O-CB 3.38Å; P234-T237 PolarHBondContact O-N 3.44Å; P234-T237 VanDerWaalsContact O-N 3.14Å; E235-T237 VanDerWaalsContact C-N 3.31Å; E235-T237 PolarHBondContact O-N 3.17Å; T237-T239 VanDerWaalsContact C-N 3.27Å; T237-T239 PolarHBondContact O-N 3.46Å; T237-F240 PolarHBondContact O-N 2.63Å; T237-V241 HydrophobicContact CG2-CG2 4.48Å; T237-V241 WeakPolarHBondContact O-CG2 3.4Å; T237-V241 PolarHBondContact O-N 3.42Å
238	V	93.2	Very high	93.3	Very high	63 Å²	63	51.7 Å²	51.7	38%	0.382	26%	0.258	S	S	.	.	H	α-helix	trans	-59.9	-41.7	174.2	176.8	0	0	0	0	110.7	I233 P234 E235 R242	I233-V238 HydrophobicContact CB-CG2 4.21Å; I233-V238 HydrophobicContact CG2-CG2 3.81Å; P234-V238 PolarHBondContact O-N 3.19Å; P234-V238 VanDerWaalsContact O-N 3.13Å; E235-V238 PolarHBondContact O-N 3.25Å; V238-R242 WeakPolarHBondContact O-CB 3.37Å; V238-R242 PolarHBondContact O-N 2.95Å; V238-R242 VanDerWaalsContact O-N 3.11Å
239	T	94.4	Very high	93.1	Very high	43 Å²	43	56 Å²	56	26%	0.264	28%	0.278	S	S	.	.	H	α-helix	trans	-63.7	-45.7	176.5	-66.3	0	0	0	0	111.5	E235 D236 T237 V241 R242 S243	E235-T239 WeakPolarHBondContact O-CB 3.37Å; E235-T239 PolarHBondContact O-N 3.3Å; E235-T239 PolarHBondContact O-OG1 2.93Å; E235-T239 VanDerWaalsContact O-OG1 3.06Å; D236-T239 WeakPolarHBondContact O-CB 3.42Å; D236-T239 PolarHBondContact O-N 3.23Å; T237-T239 VanDerWaalsContact C-N 3.27Å; T237-T239 PolarHBondContact O-N 3.46Å; T239-V241 PolarHBondContact O-N 2.65Å; T239-R242 PolarHBondContact O-N 2.85Å; T239-S243 WeakPolarHBondContact O-CB 3.33Å; T239-S243 PolarHBondContact O-N 3.38Å; T239-S243 PolarHBondContact O-OG 3.36Å
240	F	94.2	Very high	92.9	Very high	2 Å²	2	56.1 Å²	56.1	1%	0.009	28%	0.279	C	S	.	.	H	α-helix	trans	-57.3	-49.5	176.6	176.2	-97.2	0	0	0	112.3	L214 D236 T237 R242 S243 I244 I278 F281 L333 V337	L214-F240 HydrophobicContact CD1-CD1 3.96Å; L214-F240 HydrophobicContact CD1-CE1 3.59Å; L214-F240 HydrophobicContact CD1-CZ 4.48Å; L214-F240 HydrophobicContact CD2-CD1 3.85Å; L214-F240 HydrophobicContact CD2-CE1 4.23Å; D236-F240 WeakPolarHBondContact O-CB 3.37Å; D236-F240 PolarHBondContact O-N 3.15Å; T237-F240 PolarHBondContact O-N 2.63Å; F240-R242 VanDerWaalsContact C-N 3.34Å; F240-R242 PolarHBondContact O-N 2.96Å; F240-S243 WeakPolarHBondContact O-CB 3.05Å; F240-S243 PolarHBondContact O-N 2.97Å; F240-S243 VanDerWaalsContact O-N 3.1Å; F240-I244 HydrophobicContact CD1-CD1 4.11Å; F240-I244 HydrophobicContact CE1-CD1 3.38Å; F240-I244 HydrophobicContact CE1-CG1 4.33Å; F240-I244 HydrophobicContact CE2-CD1 4.33Å; F240-I244 HydrophobicContact CZ-CD1 3.51Å; F240-I244 HydrophobicContact CZ-CG1 4.27Å; F240-I244 PolarHBondContact O-N 2.88Å; F240-I244 VanDerWaalsContact O-N 3.15Å; F240-I278 HydrophobicContact CD2-CG1 4.41Å; F240-I278 HydrophobicContact CE2-CB 4.23Å; F240-I278 HydrophobicContact CE2-CG1 4.08Å; F240-I278 HydrophobicContact CE2-CG2 4.1Å; F240-F281 HydrophobicContact CB-CB 4.43Å; F240-F281 HydrophobicContact CB-CD1 4.47Å; F240-F281 HydrophobicContact CB-CD2 3.93Å; F240-F281 HydrophobicContact CB-CE2 4.29Å; F240-F281 HydrophobicContact CB-CG 4.02Å; F240-F281 HydrophobicContact CD2-CB 3.56Å; F240-F281 AromaticContact CD2-CD1 3.61Å; F240-F281 HydrophobicContact CD2-CD1 3.61Å; F240-F281 HydrophobicContact CD2-CD2 4.35Å; F240-F281 HydrophobicContact CD2-CE1 4.39Å; F240-F281 AromaticContact CD2-CG 3.57Å; F240-F281 HydrophobicContact CD2-CG 3.57Å; F240-F281 HydrophobicContact CE2-CB 4.21Å; F240-F281 AromaticContact CE2-CD1 3.89Å; F240-F281 HydrophobicContact CE2-CD1 3.89Å; F240-F281 HydrophobicContact CE2-CG 4.26Å; F240-F281 HydrophobicContact CG-CB 4.32Å; F240-F281 AromaticContact CG-CD1 3.95Å; F240-F281 HydrophobicContact CG-CD1 3.95Å; F240-F281 HydrophobicContact CG-CD2 4.3Å; F240-F281 HydrophobicContact CG-CE1 4.33Å; F240-F281 AromaticContact CG-CG 3.93Å; F240-F281 HydrophobicContact CG-CG 3.93Å; F240-F281 HydrophobicContact CZ-CD1 4.47Å; F240-L333 HydrophobicContact CE1-CD2 4.27Å; F240-L333 HydrophobicContact CE1-CG 4.41Å; F240-L333 HydrophobicContact CE2-CD2 3.65Å; F240-L333 HydrophobicContact CE2-CG 4.4Å; F240-L333 HydrophobicContact CZ-CD2 3.45Å; F240-L333 VanDerWaalsContact CZ-CD2 3.45Å; F240-L333 HydrophobicContact CZ-CG 3.73Å; F240-V337 HydrophobicContact CE1-CG2 4.3Å
241	V	92.9	Very high	92.8	Very high	15 Å²	15	50.3 Å²	50.3	9%	0.091	25%	0.252	C	S	.	.	H	α-helix	trans	-56.4	-47.8	177.9	170.1	0	0	0	0	111	Y210 Y211 L214 T237 T239 S243 I244	Y210-V241 HydrophobicContact CD1-CB 4.38Å; Y210-V241 HydrophobicContact CD1-CG1 3.87Å; Y210-V241 HydrophobicContact CD1-CG2 3.82Å; Y210-V241 HydrophobicContact CE1-CB 3.9Å; Y210-V241 HydrophobicContact CE1-CG1 3.62Å; Y210-V241 HydrophobicContact CE1-CG2 3.57Å; Y211-V241 HydrophobicContact CD1-CG2 4.32Å; Y211-V241 HydrophobicContact CE1-CG2 3.84Å; L214-V241 HydrophobicContact CD2-CG2 3.86Å; T237-V241 HydrophobicContact CG2-CG2 4.48Å; T237-V241 WeakPolarHBondContact O-CG2 3.4Å; T237-V241 PolarHBondContact O-N 3.42Å; T239-V241 PolarHBondContact O-N 2.65Å; V241-S243 VanDerWaalsContact C-N 3.31Å; V241-S243 PolarHBondContact O-N 3.21Å; V241-I244 PolarHBondContact O-N 3.5Å
242	R	93.3	Very high	92.6	Very high	165 Å²	165	42.2 Å²	42.2	62%	0.623	22%	0.222	S	C	*	.	H	α-helix	trans	-62.2	-39	177.6	179.8	178.4	58.9	-173.4	-7.3	111.9	V238 T239 F240 G245 L246	V238-R242 WeakPolarHBondContact O-CB 3.37Å; V238-R242 PolarHBondContact O-N 2.95Å; V238-R242 VanDerWaalsContact O-N 3.11Å; T239-R242 PolarHBondContact O-N 2.85Å; F240-R242 VanDerWaalsContact C-N 3.34Å; F240-R242 PolarHBondContact O-N 2.96Å; R242-G245 PolarHBondContact O-N 3.4Å; R242-L246 PolarHBondContact O-N 3Å
243	S	95.1	Very high	92.4	Very high	9 Å²	9	41.8 Å²	41.8	6%	0.063	21%	0.206	C	C	.	.	H	α-helix	trans	-68	-34.4	-176.7	-68.5	0	0	0	0	113.6	T239 F240 V241 L246 M247 A277	T239-S243 WeakPolarHBondContact O-CB 3.33Å; T239-S243 PolarHBondContact O-N 3.38Å; T239-S243 PolarHBondContact O-OG 3.36Å; F240-S243 WeakPolarHBondContact O-CB 3.05Å; F240-S243 PolarHBondContact O-N 2.97Å; F240-S243 VanDerWaalsContact O-N 3.1Å; V241-S243 VanDerWaalsContact C-N 3.31Å; V241-S243 PolarHBondContact O-N 3.21Å; S243-L246 PolarHBondContact O-N 3.15Å; S243-M247 VanDerWaalsContact O-CB 3.29Å; S243-M247 WeakPolarHBondContact O-CB 3.3Å; S243-M247 PolarHBondContact O-N 3.04Å; S243-A277 WeakPolarHBondContact OG-CB 3.28Å
244	I	93.2	Very high	92.4	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-62.1	-48	171.8	-66.5	176.3	0	0	0	110.7	Y210 F240 V241 L246 M247 F248 I278 M334 V337 D338	Y210-I244 VanDerWaalsContact OH-CB 3.31Å; Y210-I244 WeakPolarHBondContact OH-CB 3.19Å; Y210-I244 VanDerWaalsContact OH-CD1 3.22Å; Y210-I244 WeakPolarHBondContact OH-CD1 3.49Å; Y210-I244 WeakPolarHBondContact OH-CG2 3.33Å; F240-I244 HydrophobicContact CD1-CD1 4.11Å; F240-I244 HydrophobicContact CE1-CD1 3.38Å; F240-I244 HydrophobicContact CE1-CG1 4.33Å; F240-I244 HydrophobicContact CE2-CD1 4.33Å; F240-I244 HydrophobicContact CZ-CD1 3.51Å; F240-I244 HydrophobicContact CZ-CG1 4.27Å; F240-I244 PolarHBondContact O-N 2.88Å; F240-I244 VanDerWaalsContact O-N 3.15Å; V241-I244 PolarHBondContact O-N 3.5Å; I244-L246 VanDerWaalsContact C-N 3.31Å; I244-L246 PolarHBondContact O-N 3.3Å; I244-M247 PolarHBondContact O-N 2.55Å; I244-F248 HydrophobicContact CG2-CD2 3.66Å; I244-F248 HydrophobicContact CG2-CE2 3.46Å; I244-F248 VanDerWaalsContact CG2-CE2 3.46Å; I244-F248 HydrophobicContact CG2-CZ 4.33Å; I244-F248 PolarHBondContact O-N 2.95Å; I244-I278 HydrophobicContact CG1-CD1 3.86Å; I244-I278 HydrophobicContact CG1-CG1 3.97Å; I244-M334 HydrophobicContact CD1-CB 4.26Å; I244-M334 HydrophobicContact CD1-CG 4.08Å; I244-M334 HydrophobicContact CG1-CG 4.1Å; I244-M334 HydrophobicContact CG2-CG 4.36Å; I244-V337 HydrophobicContact CD1-CG2 4.46Å; I244-D338 WeakPolarHBondContact CG2-OD1 3.46Å
245	G	90.1	Very high	92.2	Very high	11 Å²	11	40.7 Å²	40.7	11%	0.113	20%	0.201	C	C	.	.	H	α-helix	trans	-59.3	-42.8	176.6	0	0	0	0	0	112.4	R242 Q249	R242-G245 PolarHBondContact O-N 3.4Å; G245-Q249 WeakPolarHBondContact O-CB 3.46Å; G245-Q249 VanDerWaalsContact O-CG 3.23Å; G245-Q249 WeakPolarHBondContact O-CG 3.28Å; G245-Q249 PolarHBondContact O-N 2.93Å
246	L	90.9	Very high	92	Very high	53 Å²	53	34.4 Å²	34.4	28%	0.277	17%	0.171	S	C	.	.	H	α-helix	trans	-62.4	-46.5	176.4	-165.3	70.8	0	0	0	111.3	R242 S243 I244 N250 R270	R242-L246 PolarHBondContact O-N 3Å; S243-L246 PolarHBondContact O-N 3.15Å; I244-L246 VanDerWaalsContact C-N 3.31Å; I244-L246 PolarHBondContact O-N 3.3Å; L246-N250 WeakPolarHBondContact O-CB 3.13Å; L246-N250 PolarHBondContact O-N 2.98Å; L246-N250 VanDerWaalsContact O-N 3.08Å; L246-N250 PolarHBondContact O-ND2 3.39Å; L246-R270 HydrophobicContact CD1-CB 4.05Å; L246-R270 HydrophobicContact CD1-CG 4.27Å; L246-R270 HydrophobicContact CD2-CB 4.08Å; L246-R270 VanDerWaalsContact CD2-O 3.25Å; L246-R270 WeakPolarHBondContact CD2-O 3.26Å; L246-R270 HydrophobicContact CG-CB 4.01Å; L246-R270 WeakPolarHBondContact CG-O 3.33Å
247	M	94.4	Very high	91.8	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-60.9	-50.7	178.7	179.7	-80.5	-68	0	0	111.2	S243 I244 N250 S251 Y271 W275 I278 M334	S243-M247 VanDerWaalsContact O-CB 3.29Å; S243-M247 WeakPolarHBondContact O-CB 3.3Å; S243-M247 PolarHBondContact O-N 3.04Å; I244-M247 PolarHBondContact O-N 2.55Å; M247-N250 PolarHBondContact O-N 2.7Å; M247-S251 WeakPolarHBondContact O-CB 3.48Å; M247-S251 PolarHBondContact O-N 2.69Å; M247-S251 PolarHBondContact O-OG 3.42Å; M247-Y271 HydrophobicContact CG-CD2 4.24Å; M247-Y271 HydrophobicContact CG-CE2 4.15Å; M247-Y271 HydrophobicContact SD-CE2 4.45Å; M247-W275 HydrophobicContact CE-CH2 4.01Å; M247-W275 HydrophobicContact CE-CZ2 3.89Å; M247-W275 HydrophobicContact CG-CD2 3.83Å; M247-W275 VanDerWaalsContact CG-CE2 3.48Å; M247-W275 HydrophobicContact CG-CG 3.97Å; M247-W275 HydrophobicContact CG-CZ2 3.99Å; M247-W275 HydrophobicContact SD-CH2 4.34Å; M247-W275 HydrophobicContact SD-CZ2 3.62Å; M247-I278 HydrophobicContact CB-CD1 4.28Å; M247-I278 HydrophobicContact CE-CD1 4.1Å; M247-I278 HydrophobicContact CG-CD1 4.44Å; M247-M334 HydrophobicContact CE-CG 4.24Å; M247-M334 HydrophobicContact CE-SD 3.3Å; M247-M334 WeakPolarHBondContact CE-SD 3.16Å
248	F	91.5	Very high	91.7	Very high	11 Å²	11	36.8 Å²	36.8	5%	0.048	19%	0.188	C	C	.	.	H	α-helix	trans	-66.1	-42.7	-178.4	-76.8	-35.5	0	0	0	113.5	I244 N250 S251 M334 D338 R513 I514	I244-F248 HydrophobicContact CG2-CD2 3.66Å; I244-F248 HydrophobicContact CG2-CE2 3.46Å; I244-F248 VanDerWaalsContact CG2-CE2 3.46Å; I244-F248 HydrophobicContact CG2-CZ 4.33Å; I244-F248 PolarHBondContact O-N 2.95Å; F248-N250 VanDerWaalsContact C-N 3.33Å; F248-N250 PolarHBondContact O-N 2.89Å; F248-S251 WeakPolarHBondContact O-CB 3.14Å; F248-S251 PolarHBondContact O-N 2.77Å; F248-M334 HydrophobicContact CE1-SD 4.42Å; F248-M334 HydrophobicContact CZ-CG 4.49Å; F248-M334 HydrophobicContact CZ-SD 4.22Å; F248-D338 HydrophobicContact CE2-CB 4.36Å; F248-R513 WeakPolarHBondContact CB-O 3.34Å; F248-I514 HydrophobicContact CB-CG1 4.28Å; F248-I514 HydrophobicContact CD1-CB 3.86Å; F248-I514 HydrophobicContact CD1-CG1 3.87Å; F248-I514 HydrophobicContact CD1-CG2 4.16Å; F248-I514 HydrophobicContact CE1-CB 4.35Å; F248-I514 HydrophobicContact CE1-CG2 4.18Å; F248-I514 HydrophobicContact CG-CB 4.31Å; F248-I514 HydrophobicContact CG-CG1 4.38Å
249	Q	89.1	Confident	91.7	Very high	91 Å²	91	39.9 Å²	39.9	43%	0.425	20%	0.196	S	C	.	.	H	α-helix	trans	-63	-41.2	178.2	-72.7	176.1	11.5	0	0	111.7	G245 Y253	G245-Q249 WeakPolarHBondContact O-CB 3.46Å; G245-Q249 VanDerWaalsContact O-CG 3.23Å; G245-Q249 WeakPolarHBondContact O-CG 3.28Å; G245-Q249 PolarHBondContact O-N 2.93Å; Q249-Y253 WeakPolarHBondContact O-CD2 3.03Å
250	N	92.6	Very high	91.6	Very high	10 Å²	10	46.9 Å²	46.9	5%	0.053	22%	0.217	C	C	.	.	H	α-helix	trans	-80.8	-20.2	-178.9	-67.8	-78.6	0	0	0	113.5	L246 M247 F248 L252 Y253 A254 F267	L246-N250 WeakPolarHBondContact O-CB 3.13Å; L246-N250 PolarHBondContact O-N 2.98Å; L246-N250 VanDerWaalsContact O-N 3.08Å; L246-N250 PolarHBondContact O-ND2 3.39Å; M247-N250 PolarHBondContact O-N 2.7Å; F248-N250 VanDerWaalsContact C-N 3.33Å; F248-N250 PolarHBondContact O-N 2.89Å; N250-L252 VanDerWaalsContact C-N 3.26Å; N250-L252 PolarHBondContact O-N 3.45Å; N250-Y253 PolarHBondContact O-N 2.93Å; N250-A254 WeakPolarHBondContact O-CB 3.47Å; N250-A254 PolarHBondContact O-N 3.19Å; N250-F267 HydrophobicContact CB-CB 4.41Å; N250-F267 WeakPolarHBondContact CB-O 3.34Å; N250-F267 VanDerWaalsContact OD1-CA 3.3Å; N250-F267 WeakPolarHBondContact OD1-CA 3.42Å; N250-F267 WeakPolarHBondContact OD1-CB 3.35Å
251	S	92.3	Very high	91.7	Very high	3 Å²	3	47.2 Å²	47.2	2%	0.021	22%	0.22	C	C	.	.	H	α-helix	trans	-57.9	-37.4	174.1	-67.1	0	0	0	0	112.6	M247 F248 A254 T255 Y271	M247-S251 WeakPolarHBondContact O-CB 3.48Å; M247-S251 PolarHBondContact O-N 2.69Å; M247-S251 PolarHBondContact O-OG 3.42Å; F248-S251 WeakPolarHBondContact O-CB 3.14Å; F248-S251 PolarHBondContact O-N 2.77Å; S251-A254 PolarHBondContact O-N 3.25Å; S251-T255 WeakPolarHBondContact O-CB 3.2Å; S251-T255 PolarHBondContact O-N 2.98Å; S251-T255 PolarHBondContact O-OG1 3.12Å; S251-Y271 VanDerWaalsContact OG-CE2 3.3Å; S251-Y271 WeakPolarHBondContact OG-CE2 3.42Å
252	L	88.1	Confident	91.8	Very high	8 Å²	8	47.7 Å²	47.7	4%	0.042	22%	0.22	C	C	.	.	H	α-helix	trans	-62.1	-48	177.7	-70.5	168.8	0	0	0	111.4	A78 L79 L81 N250 T255 F256 I514	A78-L252 WeakPolarHBondContact O-CD1 3.49Å; L79-L252 HydrophobicContact CD2-CD1 3.51Å; L81-L252 HydrophobicContact CD1-CD2 3.73Å; N250-L252 VanDerWaalsContact C-N 3.26Å; N250-L252 PolarHBondContact O-N 3.45Å; L252-T255 PolarHBondContact O-N 2.97Å; L252-F256 HydrophobicContact CD2-CE2 4.15Å; L252-F256 WeakPolarHBondContact O-CD2 3.24Å; L252-F256 PolarHBondContact O-N 3.34Å; L252-F256 VanDerWaalsContact O-N 3.09Å; L252-I514 HydrophobicContact CD2-CD1 3.91Å; L252-I514 HydrophobicContact CG-CD1 4.19Å
253	Y	90.1	Very high	91.8	Very high	88 Å²	88	45.4 Å²	45.4	35%	0.345	23%	0.226	S	C	.	.	H	α-helix	trans	-64.9	-41.4	176.4	-58.8	-68.5	0	0	0	111.4	F73 Q249 N250 T255 F256 L257 F267	F73-Y253 HydrophobicContact CE1-CD1 4.11Å; F73-Y253 HydrophobicContact CE1-CE1 4.29Å; Q249-Y253 WeakPolarHBondContact O-CD2 3.03Å; N250-Y253 PolarHBondContact O-N 2.93Å; Y253-T255 PolarHBondContact O-N 3.41Å; Y253-F256 PolarHBondContact O-N 3.1Å; Y253-L257 HydrophobicContact CD1-CD1 4.29Å; Y253-L257 VanDerWaalsContact O-CB 3.24Å; Y253-L257 WeakPolarHBondContact O-CB 3.25Å; Y253-L257 WeakPolarHBondContact O-CG 3.27Å; Y253-L257 PolarHBondContact O-N 3.43Å; Y253-F267 HydrophobicContact CD2-CB 4.41Å; Y253-F267 HydrophobicContact CG-CB 4.46Å
254	A	92.5	Very high	91.8	Very high	6 Å²	6	50.2 Å²	50.2	5%	0.05	26%	0.255	C	S	.	.	H	α-helix	trans	-66.4	-24.4	178	0	0	0	0	0	114.2	L132 N250 S251 F267 W268	L132-A254 HydrophobicContact CD1-CB 3.64Å; L132-A254 HydrophobicContact CD2-CB 4.02Å; N250-A254 WeakPolarHBondContact O-CB 3.47Å; N250-A254 PolarHBondContact O-N 3.19Å; S251-A254 PolarHBondContact O-N 3.25Å; A254-F267 HydrophobicContact CB-CD2 4.06Å; A254-F267 HydrophobicContact CB-CE2 3.84Å; A254-W268 HydrophobicContact CB-CE3 4.04Å; A254-W268 HydrophobicContact CB-CZ3 4.09Å
255	T	89.9	Confident	91.9	Very high	60 Å²	60	53.8 Å²	53.8	37%	0.368	27%	0.274	S	S	.	.	H	α-helix	trans	-80.2	-43.4	175.4	-57.9	0	0	0	0	111.9	L100 L132 S251 L252 Y253	L100-T255 HydrophobicContact CD2-CG2 4.14Å; L132-T255 WeakPolarHBondContact CD2-OG1 3.37Å; S251-T255 WeakPolarHBondContact O-CB 3.2Å; S251-T255 PolarHBondContact O-N 2.98Å; S251-T255 PolarHBondContact O-OG1 3.12Å; L252-T255 PolarHBondContact O-N 2.97Å; Y253-T255 PolarHBondContact O-N 3.41Å
256	F	88.4	Confident	92.2	Very high	30 Å²	30	56.5 Å²	56.5	13%	0.132	29%	0.29	C	S	.	.	H	α-helix	trans	-100.6	-23.9	-168.8	-65.9	-63.6	0	0	0	114.6	F68 F69 L72 F73 L81 L100 L252 Y253	F68-F256 AromaticContact CE1-CD1 3.98Å; F68-F256 HydrophobicContact CE1-CD1 3.98Å; F68-F256 AromaticContact CE1-CE1 3.6Å; F68-F256 HydrophobicContact CE1-CE1 3.6Å; F68-F256 HydrophobicContact CE1-CZ 4.41Å; F68-F256 HydrophobicContact CZ-CD1 4.5Å; F68-F256 AromaticContact CZ-CE1 3.77Å; F68-F256 HydrophobicContact CZ-CE1 3.77Å; F68-F256 HydrophobicContact CZ-CZ 4.15Å; F69-F256 HydrophobicContact CE1-CB 4.33Å; F69-F256 WeakPolarHBondContact CE1-O 3.47Å; L72-F256 HydrophobicContact CD1-CB 4.37Å; L72-F256 HydrophobicContact CD1-CD1 3.82Å; L72-F256 HydrophobicContact CD1-CD2 4.04Å; L72-F256 HydrophobicContact CD1-CE1 4.11Å; L72-F256 HydrophobicContact CD1-CE2 4.31Å; L72-F256 HydrophobicContact CD1-CG 3.81Å; L72-F256 HydrophobicContact CD1-CZ 4.35Å; F73-F256 HydrophobicContact CE2-CB 4.22Å; F73-F256 HydrophobicContact CZ-CB 3.79Å; L81-F256 HydrophobicContact CD1-CE2 4.26Å; L81-F256 HydrophobicContact CD1-CZ 4.48Å; L100-F256 HydrophobicContact CD1-CD1 3.56Å; L100-F256 HydrophobicContact CD1-CE1 3.76Å; L100-F256 HydrophobicContact CD2-CE1 4.23Å; L252-F256 HydrophobicContact CD2-CE2 4.15Å; L252-F256 WeakPolarHBondContact O-CD2 3.24Å; L252-F256 PolarHBondContact O-N 3.34Å; L252-F256 VanDerWaalsContact O-N 3.09Å; Y253-F256 PolarHBondContact O-N 3.1Å
257	L	89.8	Confident	92.3	Very high	39 Å²	39	54.5 Å²	54.5	20%	0.204	28%	0.278	C	S	.	.	S	Bend	trans	-84.3	143.4	177.8	-63.9	-179.7	0	0	0	111.3	F73 Y253 L265 F267	F73-L257 HydrophobicContact CE1-CD2 4.11Å; F73-L257 HydrophobicContact CE2-CD2 3.97Å; F73-L257 HydrophobicContact CZ-CD2 3.59Å; F73-L257 HydrophobicContact CZ-CG 4.12Å; Y253-L257 HydrophobicContact CD1-CD1 4.29Å; Y253-L257 VanDerWaalsContact O-CB 3.24Å; Y253-L257 WeakPolarHBondContact O-CB 3.25Å; Y253-L257 WeakPolarHBondContact O-CG 3.27Å; Y253-L257 PolarHBondContact O-N 3.43Å; L257-L265 HydrophobicContact CD1-CD1 4.03Å; L257-F267 HydrophobicContact CB-CE1 4.43Å; L257-F267 HydrophobicContact CB-CZ 4.3Å; L257-F267 HydrophobicContact CD1-CD1 4Å; L257-F267 HydrophobicContact CD1-CE1 3.72Å; L257-F267 HydrophobicContact CD1-CZ 4.32Å
258	P	90.4	Very high	92.4	Very high	66 Å²	66	56 Å²	56	43%	0.429	28%	0.284	S	S	.	.			trans	-57.7	145	177	-26.1	35.1	0	0	0	113.2	W260 T261	P258-W260 HydrophobicContact CB-CG 4.24Å; P258-W260 VanDerWaalsContact CB-NE1 3.26Å; P258-W260 PolarHBondContact O-N 2.85Å; P258-W260 VanDerWaalsContact O-N 3.11Å; P258-T261 HydrophobicContact CB-CG2 4.43Å; P258-T261 WeakPolarHBondContact O-CB 3.37Å; P258-T261 PolarHBondContact O-N 2.99Å; P258-T261 PolarHBondContact O-OG1 3.39Å
259	K	92.2	Very high	92.6	Very high	127 Å²	127	62.1 Å²	62.1	55%	0.552	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-57	-30.5	-177.4	-65	-168.7	178.5	-175.9	0	113.8	T261 R262	K259-T261 PolarHBondContact O-N 3.17Å; K259-T261 VanDerWaalsContact O-N 3.17Å; K259-R262 VanDerWaalsContact O-CB 3.27Å; K259-R262 WeakPolarHBondContact O-CB 3.46Å; K259-R262 VanDerWaalsContact O-CG 3.3Å; K259-R262 WeakPolarHBondContact O-CG 3.46Å; K259-R262 PolarHBondContact O-N 3.31Å; K259-R262 VanDerWaalsContact O-N 3.13Å
260	W	93.7	Very high	93	Very high	190 Å²	190	63.7 Å²	63.7	72%	0.72	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-62.8	-20	176.8	69.3	-103.2	0	0	0	113.8	P258 R262 P263	P258-W260 HydrophobicContact CB-CG 4.24Å; P258-W260 VanDerWaalsContact CB-NE1 3.26Å; P258-W260 PolarHBondContact O-N 2.85Å; P258-W260 VanDerWaalsContact O-N 3.11Å; W260-R262 VanDerWaalsContact C-N 3.34Å; W260-P263 WeakPolarHBondContact O-CD 3.47Å
261	T	94.6	Very high	93.1	Very high	9 Å²	9	63.2 Å²	63.2	6%	0.055	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-77.7	-19.6	177.8	66.7	0	0	0	0	113.2	P258 K259 V264 L265 F267	P258-T261 HydrophobicContact CB-CG2 4.43Å; P258-T261 WeakPolarHBondContact O-CB 3.37Å; P258-T261 PolarHBondContact O-N 2.99Å; P258-T261 PolarHBondContact O-OG1 3.39Å; K259-T261 PolarHBondContact O-N 3.17Å; K259-T261 VanDerWaalsContact O-N 3.17Å; T261-V264 PolarHBondContact O-N 2.98Å; T261-V264 VanDerWaalsContact O-N 3.11Å; T261-L265 PolarHBondContact O-N 3.13Å; T261-F267 WeakPolarHBondContact OG1-CE1 3.39Å
262	R	94.9	Very high	93.3	Very high	26 Å²	26	64.4 Å²	64.4	10%	0.098	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-43	-175.7	-67	175.5	175.5	-173.2	-9.7	114.8	E135 K259 W260 V264 F267 W268	E135-R262 IonicContact OE1-CZ 2.68Å; E135-R262 IonicContact OE1-NH1 2.72Å; E135-R262 PolarHBondContact OE1-NH1 3.5Å; E135-R262 IonicContact OE2-CZ 3.15Å; E135-R262 VanDerWaalsContact OE2-CZ 3.26Å; E135-R262 IonicContact OE2-NH1 3.02Å; E135-R262 PolarHBondContact OE2-NH1 3.41Å; E135-R262 IonicContact OE2-NH2 3.13Å; E135-R262 PolarHBondContact OE2-NH2 3.35Å; K259-R262 VanDerWaalsContact O-CB 3.27Å; K259-R262 WeakPolarHBondContact O-CB 3.46Å; K259-R262 VanDerWaalsContact O-CG 3.3Å; K259-R262 WeakPolarHBondContact O-CG 3.46Å; K259-R262 PolarHBondContact O-N 3.31Å; K259-R262 VanDerWaalsContact O-N 3.13Å; W260-R262 VanDerWaalsContact C-N 3.34Å; R262-V264 VanDerWaalsContact C-N 3.29Å; R262-V264 PolarHBondContact O-N 3.11Å; R262-F267 HydrophobicContact CG-CE2 4.16Å; R262-F267 HydrophobicContact CG-CZ 3.83Å; R262-W268 HydrophobicContact CB-CB 3.78Å; R262-W268 HydrophobicContact CB-CD2 4.25Å; R262-W268 HydrophobicContact CB-CG 3.68Å; R262-W268 HydrophobicContact CG-CB 4.01Å; R262-W268 HydrophobicContact CG-CD2 3.98Å; R262-W268 HydrophobicContact CG-CE3 4.22Å; R262-W268 HydrophobicContact CG-CG 3.87Å
263	P	94.6	Very high	93.7	Very high	117 Å²	117	67.5 Å²	67.5	76%	0.76	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-18.8	176	26.8	-35.5	0	0	0	113.8	W260	W260-P263 WeakPolarHBondContact O-CD 3.47Å
264	V	95.3	Very high	94	Very high	109 Å²	109	63.3 Å²	63.3	66%	0.661	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	-38.7	-174.2	-177.6	0	0	0	0	111.9	T261 R262	T261-V264 PolarHBondContact O-N 2.98Å; T261-V264 VanDerWaalsContact O-N 3.11Å; R262-V264 VanDerWaalsContact C-N 3.29Å; R262-V264 PolarHBondContact O-N 3.11Å
265	L	95.1	Very high	94.2	Very high	75 Å²	75	63 Å²	63	39%	0.393	31%	0.314	S	S	.	.	S	Bend	trans	-100.1	145.3	-174.8	-61.3	-177.8	0	0	0	111.6	L257 T261 F267	L257-L265 HydrophobicContact CD1-CD1 4.03Å; T261-L265 PolarHBondContact O-N 3.13Å; L265-F267 HydrophobicContact CB-CD1 3.52Å; L265-F267 HydrophobicContact CB-CE1 3.7Å; L265-F267 HydrophobicContact CD1-CD1 4.14Å; L265-F267 HydrophobicContact CD1-CE1 3.98Å; L265-F267 HydrophobicContact CG-CD1 4.48Å; L265-F267 HydrophobicContact CG-CE1 4.41Å; L265-F267 PolarHBondContact O-N 2.97Å; L265-F267 VanDerWaalsContact O-N 3.14Å
266	P	95.1	Very high	94.6	Very high	69 Å²	69	62.3 Å²	62.3	45%	0.448	31%	0.308	S	S	.	.	H	α-helix	trans	-72	-11.6	-173.2	29.6	-36.8	0	0	0	114.2	W268 R270	P266-W268 VanDerWaalsContact C-N 3.3Å; P266-W268 PolarHBondContact O-N 3.14Å; P266-R270 WeakPolarHBondContact O-CB 3.35Å; P266-R270 VanDerWaalsContact O-CG 3.27Å; P266-R270 WeakPolarHBondContact O-CG 3.41Å; P266-R270 PolarHBondContact O-N 3.36Å; P266-R270 VanDerWaalsContact O-N 3.07Å
267	F	94.4	Very high	95	Very high	10 Å²	10	62 Å²	62	4%	0.044	31%	0.311	C	S	.	.	H	α-helix	trans	-62.5	-36.7	-173.5	76.4	-95.4	0	0	0	112.2	N250 Y253 A254 L257 T261 R262 L265 R270 Y271	N250-F267 HydrophobicContact CB-CB 4.41Å; N250-F267 WeakPolarHBondContact CB-O 3.34Å; N250-F267 VanDerWaalsContact OD1-CA 3.3Å; N250-F267 WeakPolarHBondContact OD1-CA 3.42Å; N250-F267 WeakPolarHBondContact OD1-CB 3.35Å; Y253-F267 HydrophobicContact CD2-CB 4.41Å; Y253-F267 HydrophobicContact CG-CB 4.46Å; A254-F267 HydrophobicContact CB-CD2 4.06Å; A254-F267 HydrophobicContact CB-CE2 3.84Å; L257-F267 HydrophobicContact CB-CE1 4.43Å; L257-F267 HydrophobicContact CB-CZ 4.3Å; L257-F267 HydrophobicContact CD1-CD1 4Å; L257-F267 HydrophobicContact CD1-CE1 3.72Å; L257-F267 HydrophobicContact CD1-CZ 4.32Å; T261-F267 WeakPolarHBondContact OG1-CE1 3.39Å; R262-F267 HydrophobicContact CG-CE2 4.16Å; R262-F267 HydrophobicContact CG-CZ 3.83Å; L265-F267 HydrophobicContact CB-CD1 3.52Å; L265-F267 HydrophobicContact CB-CE1 3.7Å; L265-F267 HydrophobicContact CD1-CD1 4.14Å; L265-F267 HydrophobicContact CD1-CE1 3.98Å; L265-F267 HydrophobicContact CG-CD1 4.48Å; L265-F267 HydrophobicContact CG-CE1 4.41Å; L265-F267 PolarHBondContact O-N 2.97Å; L265-F267 VanDerWaalsContact O-N 3.14Å; F267-R270 PolarHBondContact O-N 3.26Å; F267-Y271 VanDerWaalsContact O-CB 3.3Å; F267-Y271 WeakPolarHBondContact O-CB 3.34Å; F267-Y271 PolarHBondContact O-N 3.4Å
268	W	96.1	Very high	95.3	Very high	32 Å²	32	60.2 Å²	60.2	12%	0.121	30%	0.302	C	S	.	.	H	α-helix	trans	-69.7	-47	-176.3	-178.2	-116.4	0	0	0	111.4	L132 E135 L139 A254 R262 P266 R270 Y271 L272	L132-W268 HydrophobicContact CD1-CH2 4.19Å; L132-W268 HydrophobicContact CD1-CZ3 3.61Å; E135-W268 HydrophobicContact CG-CH2 4.08Å; E135-W268 HydrophobicContact CG-CZ2 4.21Å; E135-W268 WeakPolarHBondContact OE2-CH2 3.41Å; L139-W268 HydrophobicContact CD1-CZ2 4.45Å; A254-W268 HydrophobicContact CB-CE3 4.04Å; A254-W268 HydrophobicContact CB-CZ3 4.09Å; R262-W268 HydrophobicContact CB-CB 3.78Å; R262-W268 HydrophobicContact CB-CD2 4.25Å; R262-W268 HydrophobicContact CB-CG 3.68Å; R262-W268 HydrophobicContact CG-CB 4.01Å; R262-W268 HydrophobicContact CG-CD2 3.98Å; R262-W268 HydrophobicContact CG-CE3 4.22Å; R262-W268 HydrophobicContact CG-CG 3.87Å; P266-W268 VanDerWaalsContact C-N 3.3Å; P266-W268 PolarHBondContact O-N 3.14Å; W268-R270 VanDerWaalsContact C-N 3.34Å; W268-R270 PolarHBondContact O-N 2.91Å; W268-Y271 AromaticContact CE3-CD1 3.79Å; W268-Y271 HydrophobicContact CE3-CD1 3.79Å; W268-Y271 HydrophobicContact CE3-CE1 4.43Å; W268-Y271 HydrophobicContact CH2-CD1 4.08Å; W268-Y271 AromaticContact CH2-CE1 4Å; W268-Y271 HydrophobicContact CH2-CE1 4Å; W268-Y271 AromaticContact CZ3-CD1 3.49Å; W268-Y271 HydrophobicContact CZ3-CD1 3.49Å; W268-Y271 VanDerWaalsContact CZ3-CD1 3.49Å; W268-Y271 AromaticContact CZ3-CE1 3.67Å; W268-Y271 HydrophobicContact CZ3-CE1 3.67Å; W268-Y271 HydrophobicContact CZ3-CG 4.49Å; W268-Y271 WeakPolarHBondContact O-CB 3.17Å; W268-Y271 PolarHBondContact O-N 3.26Å; W268-L272 HydrophobicContact CD2-CG 4.47Å; W268-L272 HydrophobicContact CH2-CD2 4.36Å; W268-L272 HydrophobicContact CZ2-CD1 4.22Å; W268-L272 HydrophobicContact CZ2-CD2 4.01Å; W268-L272 HydrophobicContact CZ2-CG 4.27Å; W268-L272 WeakPolarHBondContact O-CG 3.23Å; W268-L272 PolarHBondContact O-N 3.26Å
269	K	95.8	Very high	95.6	Very high	140 Å²	140	57.5 Å²	57.5	61%	0.609	28%	0.283	S	S	*	.	H	α-helix	trans	-57.9	-47.5	173.5	-177.3	176.4	177.3	178.4	0	111.1	Y271 L272 D273	K269-Y271 VanDerWaalsContact C-N 3.3Å; K269-Y271 PolarHBondContact O-N 2.93Å; K269-L272 PolarHBondContact O-N 2.87Å; K269-D273 WeakPolarHBondContact O-CB 3.5Å; K269-D273 PolarHBondContact O-N 3.46Å
270	R	96.3	Very high	95.9	Very high	124 Å²	124	55.2 Å²	55.2	47%	0.468	28%	0.283	S	S	.	.	H	α-helix	trans	-60.9	-37.1	177.4	-71.6	171.5	-179.1	171.6	1.1	113.1	L246 P266 F267 W268 G274	L246-R270 HydrophobicContact CD1-CB 4.05Å; L246-R270 HydrophobicContact CD1-CG 4.27Å; L246-R270 HydrophobicContact CD2-CB 4.08Å; L246-R270 VanDerWaalsContact CD2-O 3.25Å; L246-R270 WeakPolarHBondContact CD2-O 3.26Å; L246-R270 HydrophobicContact CG-CB 4.01Å; L246-R270 WeakPolarHBondContact CG-O 3.33Å; P266-R270 WeakPolarHBondContact O-CB 3.35Å; P266-R270 VanDerWaalsContact O-CG 3.27Å; P266-R270 WeakPolarHBondContact O-CG 3.41Å; P266-R270 PolarHBondContact O-N 3.36Å; P266-R270 VanDerWaalsContact O-N 3.07Å; F267-R270 PolarHBondContact O-N 3.26Å; W268-R270 VanDerWaalsContact C-N 3.34Å; W268-R270 PolarHBondContact O-N 2.91Å; R270-G274 PolarHBondContact O-N 3.06Å
271	Y	96.1	Very high	96	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-63.3	-48.7	174.5	169.3	-101.7	0	0	0	111.4	L132 M247 S251 F267 W268 K269 G274 W275	L132-Y271 HydrophobicContact CD1-CD1 4.43Å; L132-Y271 HydrophobicContact CD1-CE1 3.73Å; L132-Y271 HydrophobicContact CD1-CE2 4.42Å; L132-Y271 HydrophobicContact CD2-CE2 4.36Å; L132-Y271 HydrophobicContact CG-CE1 4.24Å; L132-Y271 HydrophobicContact CG-CE2 4.26Å; L132-Y271 WeakPolarHBondContact CG-OH 3.03Å; L132-Y271 PolarHBondContact O-OH 3.21Å; M247-Y271 HydrophobicContact CG-CD2 4.24Å; M247-Y271 HydrophobicContact CG-CE2 4.15Å; M247-Y271 HydrophobicContact SD-CE2 4.45Å; S251-Y271 VanDerWaalsContact OG-CE2 3.3Å; S251-Y271 WeakPolarHBondContact OG-CE2 3.42Å; F267-Y271 VanDerWaalsContact O-CB 3.3Å; F267-Y271 WeakPolarHBondContact O-CB 3.34Å; F267-Y271 PolarHBondContact O-N 3.4Å; W268-Y271 AromaticContact CE3-CD1 3.79Å; W268-Y271 HydrophobicContact CE3-CD1 3.79Å; W268-Y271 HydrophobicContact CE3-CE1 4.43Å; W268-Y271 HydrophobicContact CH2-CD1 4.08Å; W268-Y271 AromaticContact CH2-CE1 4Å; W268-Y271 HydrophobicContact CH2-CE1 4Å; W268-Y271 AromaticContact CZ3-CD1 3.49Å; W268-Y271 HydrophobicContact CZ3-CD1 3.49Å; W268-Y271 VanDerWaalsContact CZ3-CD1 3.49Å; W268-Y271 AromaticContact CZ3-CE1 3.67Å; W268-Y271 HydrophobicContact CZ3-CE1 3.67Å; W268-Y271 HydrophobicContact CZ3-CG 4.49Å; W268-Y271 WeakPolarHBondContact O-CB 3.17Å; W268-Y271 PolarHBondContact O-N 3.26Å; K269-Y271 VanDerWaalsContact C-N 3.3Å; K269-Y271 PolarHBondContact O-N 2.93Å; Y271-G274 PolarHBondContact O-N 3.33Å; Y271-W275 AromaticContact CE1-CD1 3.75Å; Y271-W275 AromaticContact CE1-NE1 3.94Å; Y271-W275 AromaticContact CE2-CD1 3.52Å; Y271-W275 AromaticContact CE2-NE1 3.11Å; Y271-W275 AromaticContact CZ-CD1 3.34Å; Y271-W275 AromaticContact CZ-NE1 3.05Å; Y271-W275 PolarHBondContact O-N 3.06Å; Y271-W275 PolarHBondContact OH-NE1 2.92Å
272	L	96.4	Very high	96.1	Very high	27 Å²	27	46.4 Å²	46.4	14%	0.141	25%	0.249	C	C	.	.	H	α-helix	trans	-64.8	-44.9	177.3	-66.6	178.6	0	0	0	112.1	H136 L139 W268 K269 G274 W275 N276	H136-L272 HydrophobicContact CB-CD2 4.26Å; L139-L272 HydrophobicContact CD1-CD1 4.45Å; L139-L272 HydrophobicContact CD1-CD2 4.23Å; W268-L272 HydrophobicContact CD2-CG 4.47Å; W268-L272 HydrophobicContact CH2-CD2 4.36Å; W268-L272 HydrophobicContact CZ2-CD1 4.22Å; W268-L272 HydrophobicContact CZ2-CD2 4.01Å; W268-L272 HydrophobicContact CZ2-CG 4.27Å; W268-L272 WeakPolarHBondContact O-CG 3.23Å; W268-L272 PolarHBondContact O-N 3.26Å; K269-L272 PolarHBondContact O-N 2.87Å; L272-G274 VanDerWaalsContact C-N 3.26Å; L272-G274 PolarHBondContact O-N 2.99Å; L272-W275 PolarHBondContact O-N 3.5Å; L272-W275 VanDerWaalsContact O-N 3.14Å; L272-N276 WeakPolarHBondContact O-CB 3.31Å; L272-N276 PolarHBondContact O-N 3.18Å; L272-N276 PolarHBondContact O-ND2 2.85Å
273	D	96.4	Very high	96.2	Very high	73 Å²	73	49.9 Å²	49.9	39%	0.39	27%	0.265	S	S	.	.	H	α-helix	trans	-57.9	-40.4	177.2	-68.4	-17.3	0	0	0	111.2	K269 N276 A277	K269-D273 WeakPolarHBondContact O-CB 3.5Å; K269-D273 PolarHBondContact O-N 3.46Å; D273-N276 PolarHBondContact O-N 3.47Å; D273-A277 PolarHBondContact O-N 3.17Å; D273-A277 VanDerWaalsContact O-N 3.07Å
274	G	96.7	Very high	96.3	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-61.1	-47	175	0	0	0	0	0	112.5	R270 Y271 L272 I278	R270-G274 PolarHBondContact O-N 3.06Å; Y271-G274 PolarHBondContact O-N 3.33Å; L272-G274 VanDerWaalsContact C-N 3.26Å; L272-G274 PolarHBondContact O-N 2.99Å; G274-I278 WeakPolarHBondContact O-CD1 2.98Å; G274-I278 VanDerWaalsContact O-CG1 3.29Å; G274-I278 WeakPolarHBondContact O-CG1 3.31Å; G274-I278 PolarHBondContact O-N 3.28Å; G274-I278 VanDerWaalsContact O-N 3.17Å
275	W	96.9	Very high	96.3	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-66	-40.6	175.9	-83	121	0	0	0	113.6	W133 H136 R137 M247 Y271 L272 A277 I278 F279 M334	W133-W275 AromaticContact CD2-CH2 3.92Å; W133-W275 HydrophobicContact CD2-CH2 3.92Å; W133-W275 AromaticContact CD2-CZ2 3.51Å; W133-W275 HydrophobicContact CD2-CZ2 3.51Å; W133-W275 AromaticContact CE2-CZ2 3.56Å; W133-W275 AromaticContact CE3-CH2 3.73Å; W133-W275 HydrophobicContact CE3-CH2 3.73Å; W133-W275 AromaticContact CE3-CZ2 3.85Å; W133-W275 HydrophobicContact CE3-CZ2 3.85Å; W133-W275 AromaticContact CG-CZ2 3.91Å; W133-W275 HydrophobicContact CG-CZ2 3.91Å; W133-W275 HydrophobicContact CH2-CH2 4.02Å; W133-W275 HydrophobicContact CH2-CZ2 4.25Å; W133-W275 HydrophobicContact CZ2-CH2 4.18Å; W133-W275 AromaticContact CZ2-CZ2 3.94Å; W133-W275 HydrophobicContact CZ2-CZ2 3.94Å; W133-W275 AromaticContact CZ3-CH2 3.79Å; W133-W275 HydrophobicContact CZ3-CH2 3.79Å; W133-W275 HydrophobicContact CZ3-CZ2 4.2Å; W133-W275 AromaticContact NE1-CZ2 3.88Å; H136-W275 HydrophobicContact CB-CG 4.46Å; H136-W275 VanDerWaalsContact CD2-CB 3.47Å; H136-W275 WeakPolarHBondContact CD2-CB 3.44Å; H136-W275 AromaticContact CG-CG 3.93Å; H136-W275 WeakPolarHBondContact NE2-CB 3.22Å; R137-W275 VanDerWaalsContact NH1-CE3 3.28Å; M247-W275 HydrophobicContact CE-CH2 4.01Å; M247-W275 HydrophobicContact CE-CZ2 3.89Å; M247-W275 HydrophobicContact CG-CD2 3.83Å; M247-W275 VanDerWaalsContact CG-CE2 3.48Å; M247-W275 HydrophobicContact CG-CG 3.97Å; M247-W275 HydrophobicContact CG-CZ2 3.99Å; M247-W275 HydrophobicContact SD-CH2 4.34Å; M247-W275 HydrophobicContact SD-CZ2 3.62Å; Y271-W275 AromaticContact CE1-CD1 3.75Å; Y271-W275 AromaticContact CE1-NE1 3.94Å; Y271-W275 AromaticContact CE2-CD1 3.52Å; Y271-W275 AromaticContact CE2-NE1 3.11Å; Y271-W275 AromaticContact CZ-CD1 3.34Å; Y271-W275 AromaticContact CZ-NE1 3.05Å; Y271-W275 PolarHBondContact O-N 3.06Å; Y271-W275 PolarHBondContact OH-NE1 2.92Å; L272-W275 PolarHBondContact O-N 3.5Å; L272-W275 VanDerWaalsContact O-N 3.14Å; W275-A277 VanDerWaalsContact C-N 3.32Å; W275-A277 PolarHBondContact O-N 2.9Å; W275-I278 HydrophobicContact CE3-CB 4.37Å; W275-I278 HydrophobicContact CE3-CD1 4Å; W275-I278 HydrophobicContact CE3-CG2 4.29Å; W275-I278 HydrophobicContact CZ3-CD1 4.28Å; W275-I278 HydrophobicContact CZ3-CG2 4.32Å; W275-I278 PolarHBondContact O-N 3.26Å; W275-I278 VanDerWaalsContact O-N 3.15Å; W275-F279 AromaticContact CE3-CD2 3.98Å; W275-F279 HydrophobicContact CE3-CD2 3.98Å; W275-F279 AromaticContact CE3-CE2 3.66Å; W275-F279 HydrophobicContact CE3-CE2 3.66Å; W275-F279 AromaticContact CZ3-CE2 3.95Å; W275-F279 HydrophobicContact CZ3-CE2 3.95Å; W275-F279 WeakPolarHBondContact O-CD2 3.07Å; W275-F279 PolarHBondContact O-N 3.25Å; W275-M334 HydrophobicContact CH2-CE 4.01Å; W275-M334 HydrophobicContact CH2-SD 3.52Å; W275-M334 VanDerWaalsContact CH2-SD 3.52Å; W275-M334 HydrophobicContact CZ2-SD 4.46Å; W275-M334 HydrophobicContact CZ3-CE 4.4Å; W275-M334 HydrophobicContact CZ3-SD 3.79Å
276	N	96.9	Very high	96.4	Very high	46 Å²	46	40.1 Å²	40.1	25%	0.246	20%	0.199	C	C	.	.	H	α-helix	trans	-58.4	-47.3	178.1	-71.3	-17.6	0	0	0	110.7	H136 H140 L272 D273 I278 F279 S280	H136-N276 PolarHBondContact NE2-OD1 2.87Å; H140-N276 PolarHBondContact CE1-OD1 3.39Å; H140-N276 VanDerWaalsContact CE1-OD1 3.3Å; H140-N276 PolarHBondContact NE2-OD1 2.84Å; H140-N276 VanDerWaalsContact NE2-OD1 3.07Å; L272-N276 WeakPolarHBondContact O-CB 3.31Å; L272-N276 PolarHBondContact O-N 3.18Å; L272-N276 PolarHBondContact O-ND2 2.85Å; D273-N276 PolarHBondContact O-N 3.47Å; N276-I278 VanDerWaalsContact C-N 3.35Å; N276-I278 PolarHBondContact O-N 3.38Å; N276-F279 PolarHBondContact O-N 3.09Å; N276-S280 VanDerWaalsContact O-CB 3.32Å; N276-S280 WeakPolarHBondContact O-CB 3.5Å; N276-S280 PolarHBondContact O-N 3.47Å; N276-S280 PolarHBondContact O-OG 2.69Å
277	A	96.9	Very high	96.5	Very high	24 Å²	24	39.3 Å²	39.3	20%	0.198	19%	0.191	C	C	.	.	H	α-helix	trans	-62.7	-38.4	176.2	0	0	0	0	0	113.2	S243 D273 W275 F281	S243-A277 WeakPolarHBondContact OG-CB 3.28Å; D273-A277 PolarHBondContact O-N 3.17Å; D273-A277 VanDerWaalsContact O-N 3.07Å; W275-A277 VanDerWaalsContact C-N 3.32Å; W275-A277 PolarHBondContact O-N 2.9Å; A277-F281 WeakPolarHBondContact O-CB 3.44Å; A277-F281 PolarHBondContact O-N 3.26Å
278	I	96.8	Very high	96.5	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-61.8	-49.2	176.3	-70.4	163.7	0	0	0	110.8	F240 I244 M247 G274 W275 N276 F281 G282 P330 M334	F240-I278 HydrophobicContact CD2-CG1 4.41Å; F240-I278 HydrophobicContact CE2-CB 4.23Å; F240-I278 HydrophobicContact CE2-CG1 4.08Å; F240-I278 HydrophobicContact CE2-CG2 4.1Å; I244-I278 HydrophobicContact CG1-CD1 3.86Å; I244-I278 HydrophobicContact CG1-CG1 3.97Å; M247-I278 HydrophobicContact CB-CD1 4.28Å; M247-I278 HydrophobicContact CE-CD1 4.1Å; M247-I278 HydrophobicContact CG-CD1 4.44Å; G274-I278 WeakPolarHBondContact O-CD1 2.98Å; G274-I278 VanDerWaalsContact O-CG1 3.29Å; G274-I278 WeakPolarHBondContact O-CG1 3.31Å; G274-I278 PolarHBondContact O-N 3.28Å; G274-I278 VanDerWaalsContact O-N 3.17Å; W275-I278 HydrophobicContact CE3-CB 4.37Å; W275-I278 HydrophobicContact CE3-CD1 4Å; W275-I278 HydrophobicContact CE3-CG2 4.29Å; W275-I278 HydrophobicContact CZ3-CD1 4.28Å; W275-I278 HydrophobicContact CZ3-CG2 4.32Å; W275-I278 PolarHBondContact O-N 3.26Å; W275-I278 VanDerWaalsContact O-N 3.15Å; N276-I278 VanDerWaalsContact C-N 3.35Å; N276-I278 PolarHBondContact O-N 3.38Å; I278-F281 PolarHBondContact O-N 3.02Å; I278-G282 PolarHBondContact O-N 3.36Å; I278-G282 VanDerWaalsContact O-N 3.11Å; I278-P330 HydrophobicContact CG2-CB 4.36Å; I278-M334 HydrophobicContact CD1-CG 4.36Å; I278-M334 HydrophobicContact CD1-SD 4.48Å; I278-M334 HydrophobicContact CG2-CB 4.24Å
279	F	97	Very high	96.5	Very high	9 Å²	9	40.2 Å²	40.2	4%	0.039	20%	0.196	C	C	.	.	H	α-helix	trans	-70.6	-37.4	-179.5	-86.8	-95.5	0	0	0	112.4	H136 L142 W275 N276 F281 G282 K283 M326 P330 E331	H136-F279 AromaticContact CE1-CD2 3.76Å; L142-F279 HydrophobicContact CD1-CB 4.31Å; L142-F279 HydrophobicContact CD1-CD1 3.66Å; L142-F279 HydrophobicContact CD1-CD2 4.38Å; L142-F279 HydrophobicContact CD1-CE1 4Å; L142-F279 HydrophobicContact CD1-CG 3.85Å; L142-F279 HydrophobicContact CD2-CD1 4.33Å; L142-F279 HydrophobicContact CG-CD1 4.5Å; W275-F279 AromaticContact CE3-CD2 3.98Å; W275-F279 HydrophobicContact CE3-CD2 3.98Å; W275-F279 AromaticContact CE3-CE2 3.66Å; W275-F279 HydrophobicContact CE3-CE2 3.66Å; W275-F279 AromaticContact CZ3-CE2 3.95Å; W275-F279 HydrophobicContact CZ3-CE2 3.95Å; W275-F279 WeakPolarHBondContact O-CD2 3.07Å; W275-F279 PolarHBondContact O-N 3.25Å; N276-F279 PolarHBondContact O-N 3.09Å; F279-F281 VanDerWaalsContact C-N 3.34Å; F279-F281 PolarHBondContact O-N 2.89Å; F279-G282 PolarHBondContact O-N 3.32Å; F279-K283 VanDerWaalsContact O-CB 3.31Å; F279-K283 WeakPolarHBondContact O-CB 3.38Å; F279-K283 PolarHBondContact O-N 3.38Å; F279-M326 WeakPolarHBondContact CE1-O 3.48Å; F279-P330 HydrophobicContact CD1-CB 4.02Å; F279-P330 HydrophobicContact CD1-CG 3.9Å; F279-P330 HydrophobicContact CE1-CB 4.17Å; F279-P330 HydrophobicContact CE1-CG 4.16Å; F279-P330 HydrophobicContact CG-CB 4.22Å; F279-P330 HydrophobicContact CG-CG 4.46Å; F279-P330 HydrophobicContact CZ-CB 4.48Å; F279-E331 HydrophobicContact CZ-CG 4.27Å
280	S	96.9	Very high	96.4	Very high	79 Å²	79	36.1 Å²	36.1	55%	0.552	18%	0.181	S	C	*	.	H	α-helix	trans	-62.5	-40.2	174	-66.4	0	0	0	0	112.2	N276 K283 K284	N276-S280 VanDerWaalsContact O-CB 3.32Å; N276-S280 WeakPolarHBondContact O-CB 3.5Å; N276-S280 PolarHBondContact O-N 3.47Å; N276-S280 PolarHBondContact O-OG 2.69Å; S280-K283 PolarHBondContact O-N 3.27Å; S280-K284 PolarHBondContact O-N 3.01Å
281	F	97.1	Very high	96.3	Very high	14 Å²	14	36.6 Å²	36.6	6%	0.061	19%	0.188	C	C	.	.	H	α-helix	trans	-64.4	-47.8	176.2	-173.7	-93.2	0	0	0	111.5	I226 D236 F240 A277 I278 F279 K283 K284 L285 L333	I226-F281 HydrophobicContact CD1-CZ 4.24Å; D236-F281 HydrophobicContact CB-CD2 4.42Å; D236-F281 HydrophobicContact CB-CE2 4.39Å; F240-F281 HydrophobicContact CB-CB 4.43Å; F240-F281 HydrophobicContact CB-CD1 4.47Å; F240-F281 HydrophobicContact CB-CD2 3.93Å; F240-F281 HydrophobicContact CB-CE2 4.29Å; F240-F281 HydrophobicContact CB-CG 4.02Å; F240-F281 HydrophobicContact CD2-CB 3.56Å; F240-F281 AromaticContact CD2-CD1 3.61Å; F240-F281 HydrophobicContact CD2-CD1 3.61Å; F240-F281 HydrophobicContact CD2-CD2 4.35Å; F240-F281 HydrophobicContact CD2-CE1 4.39Å; F240-F281 AromaticContact CD2-CG 3.57Å; F240-F281 HydrophobicContact CD2-CG 3.57Å; F240-F281 HydrophobicContact CE2-CB 4.21Å; F240-F281 AromaticContact CE2-CD1 3.89Å; F240-F281 HydrophobicContact CE2-CD1 3.89Å; F240-F281 HydrophobicContact CE2-CG 4.26Å; F240-F281 HydrophobicContact CG-CB 4.32Å; F240-F281 AromaticContact CG-CD1 3.95Å; F240-F281 HydrophobicContact CG-CD1 3.95Å; F240-F281 HydrophobicContact CG-CD2 4.3Å; F240-F281 HydrophobicContact CG-CE1 4.33Å; F240-F281 AromaticContact CG-CG 3.93Å; F240-F281 HydrophobicContact CG-CG 3.93Å; F240-F281 HydrophobicContact CZ-CD1 4.47Å; A277-F281 WeakPolarHBondContact O-CB 3.44Å; A277-F281 PolarHBondContact O-N 3.26Å; I278-F281 PolarHBondContact O-N 3.02Å; F279-F281 VanDerWaalsContact C-N 3.34Å; F279-F281 PolarHBondContact O-N 2.89Å; F281-K283 VanDerWaalsContact C-N 3.31Å; F281-K283 PolarHBondContact O-N 3.47Å; F281-K284 PolarHBondContact O-N 2.87Å; F281-L285 HydrophobicContact CD1-CD1 4.09Å; F281-L285 HydrophobicContact CE1-CD1 3.65Å; F281-L285 HydrophobicContact CE1-CG 4.42Å; F281-L285 HydrophobicContact CZ-CD1 4.33Å; F281-L285 PolarHBondContact O-N 3.06Å; F281-L333 HydrophobicContact CD1-CD2 3.61Å; F281-L333 HydrophobicContact CE1-CD2 3.89Å
282	G	96.7	Very high	96.1	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-64.3	-35	175.6	0	0	0	0	0	113.1	I278 F279 L285 I286	I278-G282 PolarHBondContact O-N 3.36Å; I278-G282 VanDerWaalsContact O-N 3.11Å; F279-G282 PolarHBondContact O-N 3.32Å; G282-L285 PolarHBondContact O-N 3.28Å; G282-I286 WeakPolarHBondContact O-CD1 3.5Å; G282-I286 VanDerWaalsContact O-CG1 3.32Å; G282-I286 WeakPolarHBondContact O-CG1 3.17Å; G282-I286 PolarHBondContact O-N 3.33Å
283	K	96.2	Very high	95.8	Very high	99 Å²	99	41.6 Å²	41.6	43%	0.43	21%	0.214	S	C	.	.	H	α-helix	trans	-58.6	-50.1	174.8	-170.5	-176.3	-177	-61.7	0	111.2	F279 S280 F281 L285 I286 D287 M326	F279-K283 VanDerWaalsContact O-CB 3.31Å; F279-K283 WeakPolarHBondContact O-CB 3.38Å; F279-K283 PolarHBondContact O-N 3.38Å; S280-K283 PolarHBondContact O-N 3.27Å; F281-K283 VanDerWaalsContact C-N 3.31Å; F281-K283 PolarHBondContact O-N 3.47Å; K283-L285 VanDerWaalsContact C-N 3.29Å; K283-L285 PolarHBondContact O-N 3.31Å; K283-I286 PolarHBondContact O-N 3.43Å; K283-I286 VanDerWaalsContact O-N 3.1Å; K283-D287 WeakPolarHBondContact CG-OD2 3.08Å; K283-D287 VanDerWaalsContact NZ-CG 3.31Å; K283-D287 IonicContact NZ-OD1 3.15Å; K283-D287 PolarHBondContact NZ-OD1 3.08Å; K283-D287 IonicContact NZ-OD2 2.68Å; K283-D287 PolarHBondContact NZ-OD2 3.43Å; K283-D287 VanDerWaalsContact O-CG 3.25Å; K283-D287 PolarHBondContact O-N 3.38Å; K283-M326 VanDerWaalsContact CA-CE 3.42Å; K283-M326 HydrophobicContact CB-CE 3.37Å; K283-M326 HydrophobicContact CB-SD 3.97Å; K283-M326 HydrophobicContact CG-CE 3.7Å; K283-M326 HydrophobicContact CG-SD 3.83Å
284	K	96.7	Very high	95.6	Very high	88 Å²	88	42.8 Å²	42.8	38%	0.383	22%	0.217	S	C	.	.	H	α-helix	trans	-52.5	-49.1	177.9	175.7	-176	167.2	-178.6	0	111.2	D236 S280 F281 I286 D287 E288	D236-K284 IonicContact OD2-NZ 3.14Å; D236-K284 PolarHBondContact OD2-NZ 3.09Å; S280-K284 PolarHBondContact O-N 3.01Å; F281-K284 PolarHBondContact O-N 2.87Å; K284-I286 VanDerWaalsContact C-N 3.32Å; K284-I286 PolarHBondContact O-N 3.5Å; K284-D287 PolarHBondContact O-N 3.24Å; K284-E288 WeakPolarHBondContact CE-OE1 3.49Å; K284-E288 HydrophobicContact CG-CG 4.5Å; K284-E288 WeakPolarHBondContact O-CB 3.44Å; K284-E288 WeakPolarHBondContact O-CG 3.37Å; K284-E288 PolarHBondContact O-N 3.08Å
285	L	96.8	Very high	95.3	Very high	7 Å²	7	45.3 Å²	45.3	4%	0.037	24%	0.239	C	C	.	.	H	α-helix	trans	-66.3	-33	-179	-61	177.8	0	0	0	113	F222 K224 I226 F281 G282 K283 K289	F222-L285 HydrophobicContact CB-CB 4.08Å; F222-L285 HydrophobicContact CB-CD1 4.43Å; F222-L285 HydrophobicContact CD1-CB 3.57Å; F222-L285 HydrophobicContact CD1-CD1 4.36Å; F222-L285 HydrophobicContact CD2-CB 4.27Å; F222-L285 HydrophobicContact CD2-CD1 3.57Å; F222-L285 HydrophobicContact CE1-CB 4.04Å; F222-L285 HydrophobicContact CE2-CD1 3.81Å; F222-L285 HydrophobicContact CG-CB 3.71Å; F222-L285 HydrophobicContact CG-CD1 3.87Å; F222-L285 HydrophobicContact CG-CG 4.42Å; F222-L285 HydrophobicContact CZ-CD1 4.31Å; K224-L285 HydrophobicContact CD-CD2 3.95Å; I226-L285 HydrophobicContact CG2-CD2 4.19Å; F281-L285 HydrophobicContact CD1-CD1 4.09Å; F281-L285 HydrophobicContact CE1-CD1 3.65Å; F281-L285 HydrophobicContact CE1-CG 4.42Å; F281-L285 HydrophobicContact CZ-CD1 4.33Å; F281-L285 PolarHBondContact O-N 3.06Å; G282-L285 PolarHBondContact O-N 3.28Å; K283-L285 VanDerWaalsContact C-N 3.29Å; K283-L285 PolarHBondContact O-N 3.31Å; L285-K289 WeakPolarHBondContact O-CB 3.4Å; L285-K289 PolarHBondContact O-N 3.31Å
286	I	96.7	Very high	94.8	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.005	25%	0.249	C	C	.	.	H	α-helix	trans	-72.3	-45.8	176.3	-68.8	162.8	0	0	0	110.8	F222 G282 K283 K284 K289 L290 L311 M326 L329	F222-I286 HydrophobicContact CD1-CG1 4.09Å; F222-I286 HydrophobicContact CE1-CD1 4.19Å; F222-I286 HydrophobicContact CE1-CG1 3.71Å; G282-I286 WeakPolarHBondContact O-CD1 3.5Å; G282-I286 VanDerWaalsContact O-CG1 3.32Å; G282-I286 WeakPolarHBondContact O-CG1 3.17Å; G282-I286 PolarHBondContact O-N 3.33Å; K283-I286 PolarHBondContact O-N 3.43Å; K283-I286 VanDerWaalsContact O-N 3.1Å; K284-I286 VanDerWaalsContact C-N 3.32Å; K284-I286 PolarHBondContact O-N 3.5Å; I286-K289 PolarHBondContact O-N 3.29Å; I286-L290 HydrophobicContact CG2-CD1 3.96Å; I286-L290 HydrophobicContact CG2-CG 4.41Å; I286-L290 WeakPolarHBondContact O-CG 3.31Å; I286-L290 PolarHBondContact O-N 2.86Å; I286-L311 HydrophobicContact CG1-CD2 4.02Å; I286-M326 HydrophobicContact CB-SD 3.99Å; I286-M326 HydrophobicContact CD1-CE 4.27Å; I286-M326 HydrophobicContact CD1-CG 4.36Å; I286-M326 HydrophobicContact CD1-SD 3.35Å; I286-M326 WeakPolarHBondContact CD1-SD 3.4Å; I286-M326 HydrophobicContact CG1-SD 4.25Å; I286-M326 HydrophobicContact CG2-SD 4.07Å; I286-L329 HydrophobicContact CD1-CB 4.04Å
287	D	96.6	Very high	94.4	Very high	52 Å²	52	48.7 Å²	48.7	28%	0.278	26%	0.255	S	S	.	.	H	α-helix	trans	-59.4	-48.2	178.4	-65.9	-24.1	0	0	0	110.3	K283 K284 K289 L290 E291	K283-D287 WeakPolarHBondContact CG-OD2 3.08Å; K283-D287 VanDerWaalsContact NZ-CG 3.31Å; K283-D287 IonicContact NZ-OD1 3.15Å; K283-D287 PolarHBondContact NZ-OD1 3.08Å; K283-D287 IonicContact NZ-OD2 2.68Å; K283-D287 PolarHBondContact NZ-OD2 3.43Å; K283-D287 VanDerWaalsContact O-CG 3.25Å; K283-D287 PolarHBondContact O-N 3.38Å; K284-D287 PolarHBondContact O-N 3.24Å; D287-K289 VanDerWaalsContact C-N 3.27Å; D287-K289 PolarHBondContact O-N 2.75Å; D287-L290 WeakPolarHBondContact O-CB 3.48Å; D287-L290 PolarHBondContact O-N 2.88Å; D287-L290 VanDerWaalsContact O-N 3.11Å; D287-E291 WeakPolarHBondContact O-CG 3.29Å; D287-E291 PolarHBondContact O-N 2.76Å
288	E	95.3	Very high	94	Very high	40 Å²	40	54.4 Å²	54.4	19%	0.187	28%	0.278	C	S	.	.	H	α-helix	trans	-57.1	-41.6	176.2	-71.2	167.5	156.3	0	0	111.4	K224 K284 E291 D292	K224-E288 WeakPolarHBondContact CD-OE2 3.43Å; K224-E288 WeakPolarHBondContact CE-OE2 3.3Å; K224-E288 IonicContact NZ-OE1 3.16Å; K224-E288 PolarHBondContact NZ-OE1 2.91Å; K224-E288 VanDerWaalsContact NZ-OE1 3.15Å; K224-E288 IonicContact NZ-OE2 3.35Å; K224-E288 PolarHBondContact NZ-OE2 3.4Å; K284-E288 WeakPolarHBondContact CE-OE1 3.49Å; K284-E288 HydrophobicContact CG-CG 4.5Å; K284-E288 WeakPolarHBondContact O-CB 3.44Å; K284-E288 WeakPolarHBondContact O-CG 3.37Å; K284-E288 PolarHBondContact O-N 3.08Å; E288-E291 PolarHBondContact O-N 3.09Å; E288-D292 VanDerWaalsContact O-CG 3.29Å; E288-D292 PolarHBondContact O-N 3.33Å
289	K	94.6	Very high	93.6	Very high	21 Å²	21	58.5 Å²	58.5	9%	0.091	31%	0.311	C	S	.	.	H	α-helix	trans	-68	-37	177.6	-175.3	55.7	173.6	-179.7	0	112.8	E223 L285 I286 D287 D292 M293 L311	E223-K289 WeakPolarHBondContact OE2-CE 3.41Å; E223-K289 IonicContact OE2-NZ 2.74Å; E223-K289 PolarHBondContact OE2-NZ 3.46Å; L285-K289 WeakPolarHBondContact O-CB 3.4Å; L285-K289 PolarHBondContact O-N 3.31Å; I286-K289 PolarHBondContact O-N 3.29Å; D287-K289 VanDerWaalsContact C-N 3.27Å; D287-K289 PolarHBondContact O-N 2.75Å; K289-D292 PolarHBondContact O-N 2.85Å; K289-M293 HydrophobicContact CD-CG 4.47Å; K289-M293 HydrophobicContact CG-SD 4.21Å; K289-M293 WeakPolarHBondContact O-CB 3.24Å; K289-M293 VanDerWaalsContact O-CG 3.22Å; K289-M293 WeakPolarHBondContact O-CG 3.29Å; K289-M293 PolarHBondContact O-N 3.31Å; K289-L311 HydrophobicContact CB-CD2 3.86Å; K289-L311 HydrophobicContact CG-CD2 3.84Å; K289-L311 HydrophobicContact CG-CG 4.14Å
290	L	94.4	Very high	93.1	Very high	55 Å²	55	63.3 Å²	63.3	29%	0.288	33%	0.334	S	S	.	.	H	α-helix	trans	-65.6	-40.8	175.5	-72.4	168	0	0	0	111.1	I286 D287 M293 E294 L315 P322	I286-L290 HydrophobicContact CG2-CD1 3.96Å; I286-L290 HydrophobicContact CG2-CG 4.41Å; I286-L290 WeakPolarHBondContact O-CG 3.31Å; I286-L290 PolarHBondContact O-N 2.86Å; D287-L290 WeakPolarHBondContact O-CB 3.48Å; D287-L290 PolarHBondContact O-N 2.88Å; D287-L290 VanDerWaalsContact O-N 3.11Å; L290-M293 PolarHBondContact O-N 3.15Å; L290-E294 WeakPolarHBondContact O-CB 3.36Å; L290-E294 PolarHBondContact O-N 2.95Å; L290-L315 HydrophobicContact CD2-CD1 3.71Å; L290-L315 HydrophobicContact CG-CD1 4.43Å; L290-P322 HydrophobicContact CD1-CB 4.21Å; L290-P322 HydrophobicContact CD2-CG 4.35Å
291	E	94.5	Very high	92.3	Very high	134 Å²	134	60.7 Å²	60.7	63%	0.626	32%	0.319	S	S	*	.	H	α-helix	trans	-61.2	-45.4	173.8	-71	173.2	-175.2	0	0	111.4	D287 E288 M293 E294 A295	D287-E291 WeakPolarHBondContact O-CG 3.29Å; D287-E291 PolarHBondContact O-N 2.76Å; E288-E291 PolarHBondContact O-N 3.09Å; E291-M293 PolarHBondContact O-N 3.41Å; E291-E294 PolarHBondContact O-N 3.4Å; E291-A295 WeakPolarHBondContact O-CB 3.28Å; E291-A295 PolarHBondContact O-N 2.89Å
292	D	91.8	Very high	91.3	Very high	98 Å²	98	65.2 Å²	65.2	52%	0.524	35%	0.35	S	S	.	.	H	α-helix	trans	-60.9	-42.6	176.3	-71.4	-20	0	0	0	112.1	E288 K289 A295 Q296	E288-D292 VanDerWaalsContact O-CG 3.29Å; E288-D292 PolarHBondContact O-N 3.33Å; K289-D292 PolarHBondContact O-N 2.85Å; D292-A295 PolarHBondContact O-N 3.41Å; D292-Q296 PolarHBondContact O-N 3.02Å
293	M	90.6	Very high	90.2	Very high	33 Å²	33	73.4 Å²	73.4	16%	0.163	39%	0.394	C	S	.	.	H	α-helix	trans	-64.9	-42.2	178.3	-74.2	171.6	56.8	0	0	112.2	K289 L290 E291 Q296 L297 H312 L315	K289-M293 HydrophobicContact CD-CG 4.47Å; K289-M293 HydrophobicContact CG-SD 4.21Å; K289-M293 WeakPolarHBondContact O-CB 3.24Å; K289-M293 VanDerWaalsContact O-CG 3.22Å; K289-M293 WeakPolarHBondContact O-CG 3.29Å; K289-M293 PolarHBondContact O-N 3.31Å; L290-M293 PolarHBondContact O-N 3.15Å; E291-M293 PolarHBondContact O-N 3.41Å; M293-Q296 PolarHBondContact O-N 3.13Å; M293-L297 WeakPolarHBondContact O-CB 3.41Å; M293-L297 PolarHBondContact O-N 3.2Å; M293-H312 VanDerWaalsContact CE-CD2 3.48Å; M293-H312 WeakPolarHBondContact CE-CD2 3.38Å; M293-H312 HydrophobicContact SD-CB 4.33Å; M293-L315 HydrophobicContact CE-CB 4.01Å; M293-L315 HydrophobicContact CE-CD1 4.41Å; M293-L315 HydrophobicContact SD-CD1 3.98Å
294	E	91.1	Very high	88.9	Confident	98 Å²	98	70.3 Å²	70.3	46%	0.458	39%	0.39	S	S	.	.	H	α-helix	trans	-65.2	-43.4	176.6	-178	61.9	-151.6	0	0	111	L290 E291 Q296 L297 Q298	L290-E294 WeakPolarHBondContact O-CB 3.36Å; L290-E294 PolarHBondContact O-N 2.95Å; E291-E294 PolarHBondContact O-N 3.4Å; E294-Q296 VanDerWaalsContact C-N 3.34Å; E294-Q296 PolarHBondContact O-N 3.04Å; E294-L297 PolarHBondContact O-N 3.18Å; E294-Q298 VanDerWaalsContact O-CG 3.31Å; E294-Q298 WeakPolarHBondContact O-CG 3.18Å; E294-Q298 PolarHBondContact O-N 3.48Å; E294-Q298 PolarHBondContact OE1-NE2 3.3Å
295	A	90.7	Very high	87.9	Confident	54 Å²	54	68 Å²	68	45%	0.446	38%	0.383	S	S	.	.	H	α-helix	trans	-61.5	-41.4	176.6	0	0	0	0	0	112.1	E291 D292 Q298 A299	E291-A295 WeakPolarHBondContact O-CB 3.28Å; E291-A295 PolarHBondContact O-N 2.89Å; D292-A295 PolarHBondContact O-N 3.41Å; A295-Q298 PolarHBondContact O-N 2.89Å; A295-A299 WeakPolarHBondContact O-CB 3.32Å; A295-A299 PolarHBondContact O-N 3.38Å
296	Q	87.3	Confident	86.8	Confident	45 Å²	45	74.8 Å²	74.8	21%	0.21	42%	0.415	C	S	.	.	H	α-helix	trans	-63.9	-45	175.7	-173.9	175.8	4.8	0	0	111.7	D292 M293 E294 Q298 A299 E300	D292-Q296 PolarHBondContact O-N 3.02Å; M293-Q296 PolarHBondContact O-N 3.13Å; E294-Q296 VanDerWaalsContact C-N 3.34Å; E294-Q296 PolarHBondContact O-N 3.04Å; Q296-Q298 VanDerWaalsContact C-N 3.29Å; Q296-Q298 PolarHBondContact O-N 3.07Å; Q296-A299 PolarHBondContact O-N 3.11Å; Q296-E300 HydrophobicContact CG-CG 4.46Å; Q296-E300 VanDerWaalsContact CG-OE2 3.29Å; Q296-E300 WeakPolarHBondContact CG-OE2 3.35Å; Q296-E300 PolarHBondContact NE2-OE2 3.42Å; Q296-E300 PolarHBondContact O-N 3.28Å
297	L	87.9	Confident	85.9	Confident	72 Å²	72	77.7 Å²	77.7	38%	0.377	43%	0.432	S	S	.	.	H	α-helix	trans	-60.5	-40.1	177.6	-178.4	65.5	0	0	0	111.9	M293 E294 G301 P302 V305	M293-L297 WeakPolarHBondContact O-CB 3.41Å; M293-L297 PolarHBondContact O-N 3.2Å; E294-L297 PolarHBondContact O-N 3.18Å; L297-G301 VanDerWaalsContact O-CA 3.3Å; L297-G301 WeakPolarHBondContact O-CA 3.47Å; L297-G301 PolarHBondContact O-N 2.86Å; L297-P302 HydrophobicContact CD1-CB 4.45Å; L297-P302 HydrophobicContact CD1-CG 4.45Å; L297-V305 HydrophobicContact CB-CG2 4.3Å; L297-V305 HydrophobicContact CD1-CG2 3.8Å
298	Q	89.3	Confident	84.8	Confident	144 Å²	144	77.8 Å²	77.8	67%	0.673	44%	0.437	S	S	*	.	H	α-helix	trans	-68.7	-34.8	177.2	-71.6	178.2	8.8	0	0	112.9	E294 A295 Q296	E294-Q298 VanDerWaalsContact O-CG 3.31Å; E294-Q298 WeakPolarHBondContact O-CG 3.18Å; E294-Q298 PolarHBondContact O-N 3.48Å; E294-Q298 PolarHBondContact OE1-NE2 3.3Å; A295-Q298 PolarHBondContact O-N 2.89Å; Q296-Q298 VanDerWaalsContact C-N 3.29Å; Q296-Q298 PolarHBondContact O-N 3.07Å
299	A	88.8	Confident	84.3	Confident	85 Å²	85	77.1 Å²	77.1	70%	0.702	44%	0.441	S	S	*	.	H	α-helix	trans	-80.9	-41.7	-178.1	0	0	0	0	0	113.4	A295 Q296	A295-A299 WeakPolarHBondContact O-CB 3.32Å; A295-A299 PolarHBondContact O-N 3.38Å; Q296-A299 PolarHBondContact O-N 3.11Å
300	E	85.9	Confident	84.1	Confident	111 Å²	111	76.1 Å²	76.1	52%	0.519	44%	0.436	S	S	.	.	H	α-helix	trans	-106.4	-11.7	-169.2	-60.7	179.4	165.8	0	0	113.2	Q296	Q296-E300 HydrophobicContact CG-CG 4.46Å; Q296-E300 VanDerWaalsContact CG-OE2 3.29Å; Q296-E300 WeakPolarHBondContact CG-OE2 3.35Å; Q296-E300 PolarHBondContact NE2-OE2 3.42Å; Q296-E300 PolarHBondContact O-N 3.28Å
301	G	80.1	Confident	84	Confident	24 Å²	24	73.5 Å²	73.5	25%	0.247	42%	0.423	C	S	.	.			trans	71.9	173.4	-173.1	0	0	0	0	0	113.2	L297 D303 G304	L297-G301 VanDerWaalsContact O-CA 3.3Å; L297-G301 WeakPolarHBondContact O-CA 3.47Å; L297-G301 PolarHBondContact O-N 2.86Å; G301-D303 VanDerWaalsContact C-N 3.29Å; G301-D303 PolarHBondContact O-N 3.18Å; G301-G304 PolarHBondContact O-N 3.09Å
302	P	75.9	Confident	83.9	Confident	109 Å²	109	67.3 Å²	67.3	71%	0.708	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-34.5	-172.1	-23	33	0	0	0	114.5	L297	L297-P302 HydrophobicContact CD1-CB 4.45Å; L297-P302 HydrophobicContact CD1-CG 4.45Å
303	D	73.7	Confident	83.8	Confident	171 Å²	171	64.8 Å²	64.8	91%	0.914	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-10.7	-176	-62	-38.7	0	0	0	113.2	G301	G301-D303 VanDerWaalsContact C-N 3.29Å; G301-D303 PolarHBondContact O-N 3.18Å
304	G	68.3	Low	83.9	Confident	34 Å²	34	63.2 Å²	63.2	35%	0.351	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-16.2	179.8	0	0	0	0	0	114.6	G301 Q306	G301-G304 PolarHBondContact O-N 3.09Å; G304-Q306 PolarHBondContact O-N 2.93Å; G304-Q306 VanDerWaalsContact O-N 3.13Å
305	V	75.8	Confident	84	Confident	40 Å²	40	59.6 Å²	59.6	24%	0.242	35%	0.354	C	S	.	.			trans	-67	112.3	-173.2	-178.2	0	0	0	0	111.7	L297 V307	L297-V305 HydrophobicContact CB-CG2 4.3Å; L297-V305 HydrophobicContact CD1-CG2 3.8Å; V305-V307 PolarHBondContact O-N 3.4Å
306	Q	73.9	Confident	83.9	Confident	150 Å²	150	59.7 Å²	59.7	70%	0.701	36%	0.355	S	S	*	.			trans	-85.5	108.8	173.1	-168.1	178.3	4.5	0	0	110.7	G304 S308 H312	G304-Q306 PolarHBondContact O-N 2.93Å; G304-Q306 VanDerWaalsContact O-N 3.13Å; Q306-S308 PolarHBondContact O-N 2.63Å; Q306-H312 PolarHBondContact O-CE1 3.25Å
307	V	76.9	Confident	84	Confident	62 Å²	62	60 Å²	60	38%	0.376	36%	0.362	S	S	.	.			trans	-70.8	94.4	175.3	-176.9	0	0	0	0	110.5	V305 F313 A316	V305-V307 PolarHBondContact O-N 3.4Å; V307-F313 HydrophobicContact CG1-CB 4.01Å; V307-F313 HydrophobicContact CG1-CD2 4.49Å; V307-A316 HydrophobicContact CG1-CB 4.4Å; V307-A316 HydrophobicContact CG2-CB 4.01Å
308	S	74.6	Confident	84	Confident	54 Å²	54	59.6 Å²	59.6	38%	0.378	38%	0.375	S	S	.	.			trans	-101.4	145.2	177.7	56.6	0	0	0	0	111.5	E223 Q306 H312	E223-S308 VanDerWaalsContact CD-O 3.25Å; Q306-S308 PolarHBondContact O-N 2.63Å; S308-H312 WeakPolarHBondContact O-CB 3.14Å
309	G	84.6	Confident	84	Confident	25 Å²	25	57.1 Å²	57.1	26%	0.258	36%	0.364	S	S	.	.	S	Bend	trans	69.6	-175.3	168.9	0	0	0	0	0	117.8	R164 E223 F313	R164-G309 PolarHBondContact NH1-O 3.15Å; E223-G309 VanDerWaalsContact CD-CA 3.41Å; E223-G309 WeakPolarHBondContact OE1-CA 3.15Å; G309-F313 VanDerWaalsContact O-CB 3.29Å; G309-F313 WeakPolarHBondContact O-CB 3.03Å
310	Y	90.9	Very high	84.3	Confident	1 Å²	1	53.3 Å²	53.3	0%	0.004	33%	0.332	C	S	.	.	H	α-helix	trans	-80.7	-54.1	-164.9	-173	-112.8	0	0	0	113.7	L161 R164 L165 I220 L221 E223 F313 L314 L329	L161-Y310 VanDerWaalsContact CA-OH 3.27Å; L161-Y310 WeakPolarHBondContact CA-OH 3.49Å; L161-Y310 VanDerWaalsContact CD2-OH 3.31Å; L161-Y310 WeakPolarHBondContact CD2-OH 3.42Å; L161-Y310 PolarHBondContact O-OH 3.05Å; R164-Y310 HydrophobicContact CB-CD2 3.66Å; R164-Y310 HydrophobicContact CB-CE2 3.86Å; L165-Y310 HydrophobicContact CD1-CE1 4.17Å; L165-Y310 HydrophobicContact CD1-CE2 4.07Å; L165-Y310 WeakPolarHBondContact CD1-OH 3.13Å; L165-Y310 HydrophobicContact CD2-CD2 4.21Å; L165-Y310 HydrophobicContact CD2-CE2 3.95Å; L165-Y310 HydrophobicContact CG-CD2 4.31Å; L165-Y310 HydrophobicContact CG-CE1 4.43Å; L165-Y310 HydrophobicContact CG-CE2 3.56Å; I220-Y310 WeakPolarHBondContact O-CB 3.39Å; L221-Y310 HydrophobicContact CD2-CD1 3.76Å; L221-Y310 HydrophobicContact CD2-CE1 3.79Å; E223-Y310 PolarHBondContact OE1-N 3.03Å; E223-Y310 VanDerWaalsContact OE1-N 3.07Å; Y310-F313 PolarHBondContact O-N 2.93Å; Y310-L314 HydrophobicContact CD1-CD1 3.89Å; Y310-L314 HydrophobicContact CE1-CD1 3.41Å; Y310-L314 VanDerWaalsContact CE1-CD1 3.41Å; Y310-L314 HydrophobicContact CE2-CD1 4.12Å; Y310-L314 HydrophobicContact CG-CD1 4.44Å; Y310-L314 WeakPolarHBondContact O-CG 3.44Å; Y310-L314 PolarHBondContact O-N 2.94Å; Y310-L314 VanDerWaalsContact O-N 3.11Å; Y310-L329 HydrophobicContact CD1-CD1 4.37Å; Y310-L329 HydrophobicContact CE1-CD1 4.42Å
311	L	92.5	Very high	84.7	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-69.6	-42.9	-175.2	175.9	58.4	0	0	0	111.1	L221 F222 E223 I286 K289 F313 L314 L315 A325 L329	L221-L311 WeakPolarHBondContact O-CB 3.12Å; F222-L311 HydrophobicContact CD1-CD2 3.93Å; E223-L311 PolarHBondContact OE1-N 3.37Å; I286-L311 HydrophobicContact CG1-CD2 4.02Å; K289-L311 HydrophobicContact CB-CD2 3.86Å; K289-L311 HydrophobicContact CG-CD2 3.84Å; K289-L311 HydrophobicContact CG-CG 4.14Å; L311-F313 VanDerWaalsContact C-N 3.26Å; L311-F313 PolarHBondContact O-N 2.97Å; L311-L314 PolarHBondContact O-N 3.49Å; L311-L315 HydrophobicContact CD1-CD1 3.7Å; L311-L315 HydrophobicContact CD1-CD2 4.46Å; L311-L315 HydrophobicContact CD1-CG 3.87Å; L311-L315 HydrophobicContact CG-CD1 3.83Å; L311-L315 HydrophobicContact CG-CG 4.4Å; L311-L315 WeakPolarHBondContact O-CG 3.5Å; L311-L315 PolarHBondContact O-N 2.94Å; L311-A325 HydrophobicContact CD1-CB 4.12Å; L311-L329 HydrophobicContact CD1-CD1 4.43Å; L311-L329 HydrophobicContact CD1-CG 4.28Å
312	H	90.7	Very high	85.3	Confident	3 Å²	3	52.2 Å²	52.2	1%	0.014	33%	0.331	C	S	.	.	H	α-helix	trans	-56.6	-45.6	176	-166	172.1	0	0	0	110.3	E223 M293 Q306 S308 L314 L315 A316	E223-H312 PolarHBondContact OE1-N 3.47Å; E223-H312 VanDerWaalsContact OE1-N 3.07Å; M293-H312 VanDerWaalsContact CE-CD2 3.48Å; M293-H312 WeakPolarHBondContact CE-CD2 3.38Å; M293-H312 HydrophobicContact SD-CB 4.33Å; Q306-H312 PolarHBondContact O-CE1 3.25Å; S308-H312 WeakPolarHBondContact O-CB 3.14Å; H312-L314 PolarHBondContact O-N 2.83Å; H312-L315 PolarHBondContact O-N 3.3Å; H312-A316 WeakPolarHBondContact O-CB 3.5Å; H312-A316 PolarHBondContact O-N 3.31Å
313	F	91.3	Very high	86.2	Confident	45 Å²	45	53.6 Å²	53.6	20%	0.197	32%	0.322	C	S	.	.	H	α-helix	trans	-59.2	-47.7	177.6	168	-101	0	0	0	112.6	Q163 R164 V307 G309 Y310 L311 L315 S317	Q163-F313 HydrophobicContact CB-CE1 4.3Å; R164-F313 HydrophobicContact CG-CD1 4.17Å; R164-F313 HydrophobicContact CG-CE1 4.29Å; R164-F313 VanDerWaalsContact CZ-CD2 3.46Å; V307-F313 HydrophobicContact CG1-CB 4.01Å; V307-F313 HydrophobicContact CG1-CD2 4.49Å; G309-F313 VanDerWaalsContact O-CB 3.29Å; G309-F313 WeakPolarHBondContact O-CB 3.03Å; Y310-F313 PolarHBondContact O-N 2.93Å; L311-F313 VanDerWaalsContact C-N 3.26Å; L311-F313 PolarHBondContact O-N 2.97Å; F313-L315 VanDerWaalsContact C-N 3.3Å; F313-L315 PolarHBondContact O-N 3.15Å; F313-S317 VanDerWaalsContact O-CB 3.26Å; F313-S317 WeakPolarHBondContact O-CB 3.25Å; F313-S317 PolarHBondContact O-N 2.85Å; F313-S317 PolarHBondContact O-OG 3.1Å
314	L	92.9	Very high	87.1	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-62.2	-39.1	-178.3	-70.9	173.6	0	0	0	112.3	L161 Y310 L311 H312 Q319 L320	L161-L314 HydrophobicContact CD2-CD1 4.01Å; Y310-L314 HydrophobicContact CD1-CD1 3.89Å; Y310-L314 HydrophobicContact CE1-CD1 3.41Å; Y310-L314 VanDerWaalsContact CE1-CD1 3.41Å; Y310-L314 HydrophobicContact CE2-CD1 4.12Å; Y310-L314 HydrophobicContact CG-CD1 4.44Å; Y310-L314 WeakPolarHBondContact O-CG 3.44Å; Y310-L314 PolarHBondContact O-N 2.94Å; Y310-L314 VanDerWaalsContact O-N 3.11Å; L311-L314 PolarHBondContact O-N 3.49Å; H312-L314 PolarHBondContact O-N 2.83Å; L314-Q319 HydrophobicContact CD2-CB 4.08Å; L314-Q319 PolarHBondContact O-N 2.72Å; L314-L320 HydrophobicContact CB-CB 4.39Å; L314-L320 HydrophobicContact CB-CD1 4.25Å; L314-L320 HydrophobicContact CB-CG 4.32Å; L314-L320 HydrophobicContact CD1-CD1 3.83Å; L314-L320 HydrophobicContact CG-CD1 4.48Å; L314-L320 PolarHBondContact O-N 3.42Å
315	L	92.6	Very high	88.4	Confident	22 Å²	22	48.1 Å²	48.1	12%	0.115	28%	0.282	C	S	.	.	H	α-helix	trans	-75.6	-51.4	179.8	-65.1	173.2	0	0	0	111.9	L290 M293 L311 H312 F313 S317 G318 P322 A325	L290-L315 HydrophobicContact CD2-CD1 3.71Å; L290-L315 HydrophobicContact CG-CD1 4.43Å; M293-L315 HydrophobicContact CE-CB 4.01Å; M293-L315 HydrophobicContact CE-CD1 4.41Å; M293-L315 HydrophobicContact SD-CD1 3.98Å; L311-L315 HydrophobicContact CD1-CD1 3.7Å; L311-L315 HydrophobicContact CD1-CD2 4.46Å; L311-L315 HydrophobicContact CD1-CG 3.87Å; L311-L315 HydrophobicContact CG-CD1 3.83Å; L311-L315 HydrophobicContact CG-CG 4.4Å; L311-L315 WeakPolarHBondContact O-CG 3.5Å; L311-L315 PolarHBondContact O-N 2.94Å; H312-L315 PolarHBondContact O-N 3.3Å; F313-L315 VanDerWaalsContact C-N 3.3Å; F313-L315 PolarHBondContact O-N 3.15Å; L315-S317 VanDerWaalsContact C-N 3.32Å; L315-S317 PolarHBondContact O-N 2.68Å; L315-G318 PolarHBondContact O-N 3.13Å; L315-P322 HydrophobicContact CD2-CG 4.29Å; L315-A325 HydrophobicContact CD2-CB 4.19Å
316	A	89.1	Confident	89.3	Confident	56 Å²	56	47.5 Å²	47.5	46%	0.463	28%	0.277	S	S	.	.	H	α-helix	trans	-66.3	-32.6	-176.6	0	0	0	0	0	113	V307 H312 G318	V307-A316 HydrophobicContact CG1-CB 4.4Å; V307-A316 HydrophobicContact CG2-CB 4.01Å; H312-A316 WeakPolarHBondContact O-CB 3.5Å; H312-A316 PolarHBondContact O-N 3.31Å; A316-G318 PolarHBondContact O-N 3.02Å
317	S	88.2	Confident	90.3	Very high	53 Å²	53	40.4 Å²	40.4	37%	0.371	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	1.8	175.4	65.6	0	0	0	0	114	F313 L315 Q319	F313-S317 VanDerWaalsContact O-CB 3.26Å; F313-S317 WeakPolarHBondContact O-CB 3.25Å; F313-S317 PolarHBondContact O-N 2.85Å; F313-S317 PolarHBondContact O-OG 3.1Å; L315-S317 VanDerWaalsContact C-N 3.32Å; L315-S317 PolarHBondContact O-N 2.68Å; S317-Q319 PolarHBondContact O-N 2.73Å; S317-Q319 WeakPolarHBondContact OG-CG 3.23Å
318	G	88.1	Confident	91.2	Very high	63 Å²	63	37.5 Å²	37.5	65%	0.649	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.6	17	-178.1	0	0	0	0	0	114.1	L315 A316 L320	L315-G318 PolarHBondContact O-N 3.13Å; A316-G318 PolarHBondContact O-N 3.02Å; G318-L320 VanDerWaalsContact C-N 3.3Å
319	Q	90.3	Very high	92.2	Very high	91 Å²	91	34.9 Å²	34.9	43%	0.425	21%	0.208	S	C	.	.	S	Bend	trans	-72.6	-27.6	178.1	-68.9	-69.2	-54.5	0	0	111.9	A160 L314 S317	A160-Q319 HydrophobicContact CB-CB 4.07Å; L314-Q319 HydrophobicContact CD2-CB 4.08Å; L314-Q319 PolarHBondContact O-N 2.72Å; S317-Q319 PolarHBondContact O-N 2.73Å; S317-Q319 WeakPolarHBondContact OG-CG 3.23Å
320	L	93.5	Very high	92.7	Very high	6 Å²	6	33.7 Å²	33.7	3%	0.031	20%	0.195	C	C	.	.	S	Bend	trans	-135.3	140	168.8	-66.7	-176.1	0	0	0	110.1	L157 L161 L314 G318 E324 A325 L329	L157-L320 HydrophobicContact CD1-CD2 3.57Å; L161-L320 HydrophobicContact CD2-CD1 4.06Å; L314-L320 HydrophobicContact CB-CB 4.39Å; L314-L320 HydrophobicContact CB-CD1 4.25Å; L314-L320 HydrophobicContact CB-CG 4.32Å; L314-L320 HydrophobicContact CD1-CD1 3.83Å; L314-L320 HydrophobicContact CG-CD1 4.48Å; L314-L320 PolarHBondContact O-N 3.42Å; G318-L320 VanDerWaalsContact C-N 3.3Å; L320-E324 HydrophobicContact CB-CB 4.4Å; L320-E324 HydrophobicContact CD2-CB 3.94Å; L320-A325 HydrophobicContact CD1-CB 4.5Å; L320-L329 HydrophobicContact CD1-CD2 4.24Å
321	S	94.2	Very high	92.9	Very high	46 Å²	46	33.7 Å²	33.7	32%	0.322	20%	0.195	S	C	.	.			trans	-73	158.6	160.1	63.3	0	0	0	0	111.1	R323 E324 A325	S321-R323 PolarHBondContact O-N 3.36Å; S321-R323 VanDerWaalsContact O-N 3.17Å; S321-E324 WeakPolarHBondContact CB-OE2 3.45Å; S321-E324 PolarHBondContact N-OE2 3.29Å; S321-E324 PolarHBondContact O-N 3.45Å; S321-E324 VanDerWaalsContact OG-CG 3.28Å; S321-E324 WeakPolarHBondContact OG-CG 3.47Å; S321-E324 PolarHBondContact OG-N 3.26Å; S321-E324 VanDerWaalsContact OG-N 3.17Å; S321-E324 PolarHBondContact OG-OE2 2.85Å; S321-A325 PolarHBondContact O-N 3.18Å
322	P	94.1	Very high	93.1	Very high	66 Å²	66	34.4 Å²	34.4	43%	0.429	20%	0.199	S	C	.	.	H	α-helix	trans	-52.6	-37.2	171.6	-28.7	35.9	0	0	0	112.8	L290 L315 A325 M326	L290-P322 HydrophobicContact CD1-CB 4.21Å; L290-P322 HydrophobicContact CD2-CG 4.35Å; L315-P322 HydrophobicContact CD2-CG 4.29Å; P322-A325 PolarHBondContact O-N 2.78Å; P322-M326 WeakPolarHBondContact O-CG 3.37Å; P322-M326 PolarHBondContact O-N 3.39Å
323	R	93.3	Very high	93.3	Very high	137 Å²	137	34.3 Å²	34.3	52%	0.517	20%	0.199	S	C	.	.	H	α-helix	trans	-66.2	-40	177	-158.8	-169.2	176.2	168.9	0.9	111.9	D141 T143 S321 M326 G327	D141-R323 VanDerWaalsContact CG-NH2 3.26Å; D141-R323 PolarHBondContact O-NH2 3.43Å; D141-R323 IonicContact OD1-NH2 2.73Å; D141-R323 PolarHBondContact OD1-NH2 3.03Å; D141-R323 IonicContact OD2-NH2 3.15Å; D141-R323 PolarHBondContact OD2-NH2 3.46Å; D141-R323 VanDerWaalsContact OD2-NH2 3.15Å; T143-R323 HydrophobicContact CG2-CB 4.4Å; T143-R323 HydrophobicContact CG2-CG 3.62Å; T143-R323 PolarHBondContact OG1-O 3.39Å; S321-R323 PolarHBondContact O-N 3.36Å; S321-R323 VanDerWaalsContact O-N 3.17Å; R323-M326 WeakPolarHBondContact O-CB 3.37Å; R323-M326 PolarHBondContact O-N 3.27Å; R323-G327 PolarHBondContact O-N 2.9Å
324	E	94.4	Very high	93.5	Very high	90 Å²	90	32.3 Å²	32.3	42%	0.421	19%	0.19	S	C	.	.	H	α-helix	trans	-73.8	-31.9	176.5	-68.4	162	130.2	0	0	112.5	L320 S321 M326 G327 S328	L320-E324 HydrophobicContact CB-CB 4.4Å; L320-E324 HydrophobicContact CD2-CB 3.94Å; S321-E324 WeakPolarHBondContact CB-OE2 3.45Å; S321-E324 PolarHBondContact N-OE2 3.29Å; S321-E324 PolarHBondContact O-N 3.45Å; S321-E324 VanDerWaalsContact OG-CG 3.28Å; S321-E324 WeakPolarHBondContact OG-CG 3.47Å; S321-E324 PolarHBondContact OG-N 3.26Å; S321-E324 VanDerWaalsContact OG-N 3.17Å; S321-E324 PolarHBondContact OG-OE2 2.85Å; E324-M326 VanDerWaalsContact C-N 3.28Å; E324-M326 PolarHBondContact O-N 2.8Å; E324-G327 PolarHBondContact O-N 2.75Å; E324-S328 WeakPolarHBondContact O-CB 3.38Å; E324-S328 PolarHBondContact O-N 3.2Å; E324-S328 PolarHBondContact O-OG 3.47Å
325	A	95.5	Very high	93.5	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-59.8	-42.1	171.2	0	0	0	0	0	110.8	L311 L315 L320 S321 P322 G327 S328 L329	L311-A325 HydrophobicContact CD1-CB 4.12Å; L315-A325 HydrophobicContact CD2-CB 4.19Å; L320-A325 HydrophobicContact CD1-CB 4.5Å; S321-A325 PolarHBondContact O-N 3.18Å; P322-A325 PolarHBondContact O-N 2.78Å; A325-G327 VanDerWaalsContact C-N 3.29Å; A325-G327 PolarHBondContact O-N 3.12Å; A325-S328 PolarHBondContact O-N 3.38Å; A325-S328 VanDerWaalsContact O-N 3.14Å; A325-L329 HydrophobicContact CB-CD2 4.31Å; A325-L329 WeakPolarHBondContact O-CB 3.23Å; A325-L329 PolarHBondContact O-N 3.27Å
326	M	94.6	Very high	93.6	Very high	28 Å²	28	33 Å²	33	14%	0.138	20%	0.2	C	C	.	.	H	α-helix	trans	-60.1	-32.6	175.2	-76.9	-51.9	-44.1	0	0	114.4	F279 K283 I286 P322 R323 E324 P330	F279-M326 WeakPolarHBondContact CE1-O 3.48Å; K283-M326 VanDerWaalsContact CA-CE 3.42Å; K283-M326 HydrophobicContact CB-CE 3.37Å; K283-M326 HydrophobicContact CB-SD 3.97Å; K283-M326 HydrophobicContact CG-CE 3.7Å; K283-M326 HydrophobicContact CG-SD 3.83Å; I286-M326 HydrophobicContact CB-SD 3.99Å; I286-M326 HydrophobicContact CD1-CE 4.27Å; I286-M326 HydrophobicContact CD1-CG 4.36Å; I286-M326 HydrophobicContact CD1-SD 3.35Å; I286-M326 WeakPolarHBondContact CD1-SD 3.4Å; I286-M326 HydrophobicContact CG1-SD 4.25Å; I286-M326 HydrophobicContact CG2-SD 4.07Å; P322-M326 WeakPolarHBondContact O-CG 3.37Å; P322-M326 PolarHBondContact O-N 3.39Å; R323-M326 WeakPolarHBondContact O-CB 3.37Å; R323-M326 PolarHBondContact O-N 3.27Å; E324-M326 VanDerWaalsContact C-N 3.28Å; E324-M326 PolarHBondContact O-N 2.8Å; M326-P330 HydrophobicContact CE-CG 4.48Å; M326-P330 VanDerWaalsContact O-CD 3.25Å; M326-P330 WeakPolarHBondContact O-CD 3.47Å; M326-P330 VanDerWaalsContact O-CG 3.32Å; M326-P330 WeakPolarHBondContact O-CG 3.29Å
327	G	93.8	Very high	93.8	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-78.4	-31.5	174.9	0	0	0	0	0	113.3	T143 G145 R323 E324 A325	T143-G327 WeakPolarHBondContact O-CA 3.49Å; T143-G327 WeakPolarHBondContact OG1-CA 3.47Å; T143-G327 PolarHBondContact OG1-N 2.84Å; T143-G327 VanDerWaalsContact OG1-N 3.11Å; G145-G327 VanDerWaalsContact CA-O 3.23Å; G145-G327 WeakPolarHBondContact CA-O 3.26Å; R323-G327 PolarHBondContact O-N 2.9Å; E324-G327 PolarHBondContact O-N 2.75Å; A325-G327 VanDerWaalsContact C-N 3.29Å; A325-G327 PolarHBondContact O-N 3.12Å
328	S	95.5	Very high	94	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.007	16%	0.161	C	C	.	.	H	α-helix	trans	-95.2	-48.9	-167.8	-60.2	0	0	0	0	113.8	E324 A325 E331 L332	E324-S328 WeakPolarHBondContact O-CB 3.38Å; E324-S328 PolarHBondContact O-N 3.2Å; E324-S328 PolarHBondContact O-OG 3.47Å; A325-S328 PolarHBondContact O-N 3.38Å; A325-S328 VanDerWaalsContact O-N 3.14Å; S328-E331 PolarHBondContact O-N 2.67Å; S328-L332 WeakPolarHBondContact O-CG 3.48Å; S328-L332 PolarHBondContact O-N 3.16Å; S328-L332 VanDerWaalsContact O-N 3.08Å
329	L	95.9	Very high	94.3	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-69.2	-40.5	-168.8	-78.3	-85.6	0	0	0	112.4	L221 F222 I286 Y310 L311 L320 A325 E331 L332 L333	L221-L329 HydrophobicContact CB-CD1 3.96Å; L221-L329 HydrophobicContact CD2-CD1 4.3Å; F222-L329 HydrophobicContact CE1-CB 3.72Å; F222-L329 HydrophobicContact CE1-CD1 4.07Å; F222-L329 HydrophobicContact CE1-CG 4.2Å; F222-L329 HydrophobicContact CZ-CB 3.8Å; F222-L329 HydrophobicContact CZ-CD1 4.3Å; I286-L329 HydrophobicContact CD1-CB 4.04Å; Y310-L329 HydrophobicContact CD1-CD1 4.37Å; Y310-L329 HydrophobicContact CE1-CD1 4.42Å; L311-L329 HydrophobicContact CD1-CD1 4.43Å; L311-L329 HydrophobicContact CD1-CG 4.28Å; L320-L329 HydrophobicContact CD1-CD2 4.24Å; A325-L329 HydrophobicContact CB-CD2 4.31Å; A325-L329 WeakPolarHBondContact O-CB 3.23Å; A325-L329 PolarHBondContact O-N 3.27Å; L329-E331 VanDerWaalsContact C-N 3.31Å; L329-E331 PolarHBondContact O-N 2.98Å; L329-L332 PolarHBondContact O-N 3.19Å; L329-L333 WeakPolarHBondContact O-CB 3.05Å; L329-L333 PolarHBondContact O-N 3.07Å
330	P	96.1	Very high	94.7	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-62.4	-35.5	173.4	-22.8	33.9	0	0	0	113.4	I278 F279 M326 M334	I278-P330 HydrophobicContact CG2-CB 4.36Å; F279-P330 HydrophobicContact CD1-CB 4.02Å; F279-P330 HydrophobicContact CD1-CG 3.9Å; F279-P330 HydrophobicContact CE1-CB 4.17Å; F279-P330 HydrophobicContact CE1-CG 4.16Å; F279-P330 HydrophobicContact CG-CB 4.22Å; F279-P330 HydrophobicContact CG-CG 4.46Å; F279-P330 HydrophobicContact CZ-CB 4.48Å; M326-P330 HydrophobicContact CE-CG 4.48Å; M326-P330 VanDerWaalsContact O-CD 3.25Å; M326-P330 WeakPolarHBondContact O-CD 3.47Å; M326-P330 VanDerWaalsContact O-CG 3.32Å; M326-P330 WeakPolarHBondContact O-CG 3.29Å; P330-M334 WeakPolarHBondContact O-CB 3.37Å; P330-M334 PolarHBondContact O-N 3.07Å; P330-M334 VanDerWaalsContact O-N 3.1Å
331	E	94.6	Very high	94.8	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-66.5	-40.9	174.8	-69	-166	163.3	0	0	111.6	R137 G145 P146 F147 T148 F279 S328 L329 M334 A335	R137-E331 IonicContact CZ-OE1 2.89Å; R137-E331 IonicContact NE-OE1 3.8Å; R137-E331 PolarHBondContact NE-OE1 2.93Å; R137-E331 IonicContact NH2-OE1 2.82Å; R137-E331 PolarHBondContact NH2-OE1 3.44Å; G145-E331 VanDerWaalsContact C-OE2 3.31Å; G145-E331 VanDerWaalsContact CA-OE2 3.31Å; G145-E331 WeakPolarHBondContact CA-OE2 3.43Å; P146-E331 WeakPolarHBondContact CD-OE2 3.47Å; F147-E331 WeakPolarHBondContact CB-OE2 3.38Å; F147-E331 HydrophobicContact CD2-CB 3.94Å; F147-E331 WeakPolarHBondContact CD2-OE2 3.34Å; F147-E331 HydrophobicContact CE2-CB 4.35Å; F147-E331 PolarHBondContact N-OE2 3.3Å; F147-E331 VanDerWaalsContact N-OE2 3.08Å; T148-E331 WeakPolarHBondContact CG2-OE1 3.39Å; T148-E331 PolarHBondContact OG1-OE1 3.13Å; F279-E331 HydrophobicContact CZ-CG 4.27Å; S328-E331 PolarHBondContact O-N 2.67Å; L329-E331 VanDerWaalsContact C-N 3.31Å; L329-E331 PolarHBondContact O-N 2.98Å; E331-M334 WeakPolarHBondContact O-CE 3.48Å; E331-A335 VanDerWaalsContact O-CB 3.3Å; E331-A335 WeakPolarHBondContact O-CB 3.11Å; E331-A335 PolarHBondContact O-N 3.38Å; E331-A335 VanDerWaalsContact O-N 3.08Å
332	L	95.9	Very high	95	Very high	16 Å²	16	20.7 Å²	20.7	8%	0.084	11%	0.109	C	C	.	.	H	α-helix	trans	-67.6	-42.2	176.3	-67.3	-176.2	0	0	0	112.5	P146 L161 L165 L221 S328 L329 A335 G336 L477	P146-L332 HydrophobicContact CG-CD2 3.75Å; P146-L332 HydrophobicContact CG-CG 4.16Å; L161-L332 HydrophobicContact CD1-CD1 4.41Å; L161-L332 HydrophobicContact CD2-CD1 4.21Å; L165-L332 HydrophobicContact CD1-CD1 4.36Å; L221-L332 HydrophobicContact CD1-CB 3.7Å; L221-L332 HydrophobicContact CD2-CB 4.43Å; L221-L332 HydrophobicContact CD2-CD1 4.33Å; S328-L332 WeakPolarHBondContact O-CG 3.48Å; S328-L332 PolarHBondContact O-N 3.16Å; S328-L332 VanDerWaalsContact O-N 3.08Å; L329-L332 PolarHBondContact O-N 3.19Å; L332-A335 PolarHBondContact O-N 2.87Å; L332-G336 PolarHBondContact O-N 2.61Å; L332-L477 HydrophobicContact CD1-CD2 3.89Å; L332-L477 HydrophobicContact CD2-CD2 3.51Å; L332-L477 HydrophobicContact CG-CD2 4.35Å
333	L	95.9	Very high	95.2	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-54.9	-59.1	175.9	178.4	71.3	0	0	0	110	L214 I217 C218 L221 F222 F240 F281 L329 A335 G336 V337	L214-L333 HydrophobicContact CD1-CD1 4.01Å; I217-L333 HydrophobicContact CG2-CD1 3.64Å; C218-L333 WeakPolarHBondContact SG-CD1 3.25Å; L221-L333 HydrophobicContact CD1-CB 4.19Å; F222-L333 HydrophobicContact CE2-CB 4.13Å; F222-L333 HydrophobicContact CE2-CD1 3.8Å; F222-L333 HydrophobicContact CE2-CD2 4.18Å; F222-L333 HydrophobicContact CE2-CG 4.25Å; F222-L333 HydrophobicContact CZ-CB 4.4Å; F240-L333 HydrophobicContact CE1-CD2 4.27Å; F240-L333 HydrophobicContact CE1-CG 4.41Å; F240-L333 HydrophobicContact CE2-CD2 3.65Å; F240-L333 HydrophobicContact CE2-CG 4.4Å; F240-L333 HydrophobicContact CZ-CD2 3.45Å; F240-L333 VanDerWaalsContact CZ-CD2 3.45Å; F240-L333 HydrophobicContact CZ-CG 3.73Å; F281-L333 HydrophobicContact CD1-CD2 3.61Å; F281-L333 HydrophobicContact CE1-CD2 3.89Å; L329-L333 WeakPolarHBondContact O-CB 3.05Å; L329-L333 PolarHBondContact O-N 3.07Å; L333-A335 VanDerWaalsContact C-N 3.28Å; L333-A335 PolarHBondContact O-N 2.63Å; L333-G336 PolarHBondContact O-N 3.08Å; L333-G336 VanDerWaalsContact O-N 3.11Å; L333-V337 VanDerWaalsContact O-CG2 3.25Å; L333-V337 WeakPolarHBondContact O-CG2 3.48Å
334	M	94.2	Very high	95.4	Very high	3 Å²	3	11.2 Å²	11.2	2%	0.015	7%	0.065	C	C	.	.	H	α-helix	trans	-56.3	-41.6	178.4	170.3	-142	52.6	0	0	112	W133 I244 M247 F248 W275 I278 P330 E331 G336 V337	W133-M334 HydrophobicContact CH2-CE 3.76Å; W133-M334 HydrophobicContact CH2-SD 4.37Å; W133-M334 HydrophobicContact CZ3-CE 3.91Å; I244-M334 HydrophobicContact CD1-CB 4.26Å; I244-M334 HydrophobicContact CD1-CG 4.08Å; I244-M334 HydrophobicContact CG1-CG 4.1Å; I244-M334 HydrophobicContact CG2-CG 4.36Å; M247-M334 HydrophobicContact CE-CG 4.24Å; M247-M334 HydrophobicContact CE-SD 3.3Å; M247-M334 WeakPolarHBondContact CE-SD 3.16Å; F248-M334 HydrophobicContact CE1-SD 4.42Å; F248-M334 HydrophobicContact CZ-CG 4.49Å; F248-M334 HydrophobicContact CZ-SD 4.22Å; W275-M334 HydrophobicContact CH2-CE 4.01Å; W275-M334 HydrophobicContact CH2-SD 3.52Å; W275-M334 VanDerWaalsContact CH2-SD 3.52Å; W275-M334 HydrophobicContact CZ2-SD 4.46Å; W275-M334 HydrophobicContact CZ3-CE 4.4Å; W275-M334 HydrophobicContact CZ3-SD 3.79Å; I278-M334 HydrophobicContact CD1-CG 4.36Å; I278-M334 HydrophobicContact CD1-SD 4.48Å; I278-M334 HydrophobicContact CG2-CB 4.24Å; P330-M334 WeakPolarHBondContact O-CB 3.37Å; P330-M334 PolarHBondContact O-N 3.07Å; P330-M334 VanDerWaalsContact O-N 3.1Å; E331-M334 WeakPolarHBondContact O-CE 3.48Å; M334-G336 VanDerWaalsContact C-N 3.29Å; M334-G336 PolarHBondContact O-N 3.27Å; M334-V337 PolarHBondContact O-N 3.1Å
335	A	93.9	Very high	95.6	Very high	25 Å²	25	7 Å²	7	21%	0.207	5%	0.045	C	C	.	.	H	α-helix	trans	-65.4	-29.6	-179.7	0	0	0	0	0	113.5	F147 E331 L332 L333 T339	F147-A335 HydrophobicContact CE2-CB 3.89Å; F147-A335 HydrophobicContact CZ-CB 3.72Å; E331-A335 VanDerWaalsContact O-CB 3.3Å; E331-A335 WeakPolarHBondContact O-CB 3.11Å; E331-A335 PolarHBondContact O-N 3.38Å; E331-A335 VanDerWaalsContact O-N 3.08Å; L332-A335 PolarHBondContact O-N 2.87Å; L333-A335 VanDerWaalsContact C-N 3.28Å; L333-A335 PolarHBondContact O-N 2.63Å; A335-T339 WeakPolarHBondContact O-CB 3.34Å; A335-T339 WeakPolarHBondContact O-CG2 3.41Å; A335-T339 PolarHBondContact O-OG1 3.08Å
336	G	94.6	Very high	95.7	Very high	12 Å²	12	7.1 Å²	7.1	12%	0.124	5%	0.046	C	C	.	.	H	α-helix	trans	-75.1	-22.9	179.7	0	0	0	0	0	114.6	L332 L333 M334	L332-G336 PolarHBondContact O-N 2.61Å; L333-G336 PolarHBondContact O-N 3.08Å; L333-G336 VanDerWaalsContact O-N 3.11Å; M334-G336 VanDerWaalsContact C-N 3.29Å; M334-G336 PolarHBondContact O-N 3.27Å
337	V	93.9	Very high	95.9	Very high	0 Å²	0	5.8 Å²	5.8	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-83.1	-64.5	-168.2	-162.3	0	0	0	0	113.7	Y210 A213 L214 I217 F240 I244 L333 M334 T339 S341	Y210-V337 HydrophobicContact CD1-CG1 3.3Å; Y210-V337 HydrophobicContact CD2-CG1 4.2Å; Y210-V337 HydrophobicContact CE1-CB 4.15Å; Y210-V337 HydrophobicContact CE1-CG1 3.15Å; Y210-V337 HydrophobicContact CE2-CG1 4.11Å; Y210-V337 HydrophobicContact CG-CG1 3.83Å; Y210-V337 WeakPolarHBondContact O-CG1 3.2Å; A213-V337 HydrophobicContact CB-CG1 4.34Å; L214-V337 HydrophobicContact CB-CG1 3.87Å; L214-V337 HydrophobicContact CB-CG2 4.25Å; L214-V337 HydrophobicContact CD1-CG2 3.99Å; I217-V337 HydrophobicContact CG2-CG2 4.19Å; F240-V337 HydrophobicContact CE1-CG2 4.3Å; I244-V337 HydrophobicContact CD1-CG2 4.46Å; L333-V337 VanDerWaalsContact O-CG2 3.25Å; L333-V337 WeakPolarHBondContact O-CG2 3.48Å; M334-V337 PolarHBondContact O-N 3.1Å; V337-T339 PolarHBondContact O-N 3.23Å; V337-S341 WeakPolarHBondContact O-CB 3.48Å; V337-S341 PolarHBondContact O-N 3.44Å; V337-S341 PolarHBondContact O-OG 3.09Å
338	D	91.4	Very high	96.2	Very high	2 Å²	2	5.8 Å²	5.8	1%	0.011	4%	0.039	C	C	.	.	H	α-helix	trans	-61.7	-32.1	-179	-86	58.6	0	0	0	111.2	Y210 I244 F248 S341 N342 R513 V515	Y210-D338 WeakPolarHBondContact CE2-OD1 3.39Å; Y210-D338 VanDerWaalsContact CZ-OD1 3.31Å; Y210-D338 PolarHBondContact OH-OD1 2.89Å; I244-D338 WeakPolarHBondContact CG2-OD1 3.46Å; F248-D338 HydrophobicContact CE2-CB 4.36Å; D338-S341 WeakPolarHBondContact CA-OG 3.48Å; D338-S341 PolarHBondContact O-OG 2.84Å; D338-N342 WeakPolarHBondContact O-CB 3.19Å; D338-N342 PolarHBondContact O-N 3.34Å; D338-N342 PolarHBondContact O-ND2 2.93Å; D338-R513 IonicContact OD2-CZ 2.98Å; D338-R513 IonicContact OD2-NE 2.85Å; D338-R513 IonicContact OD2-NH2 3.94Å; D338-R513 PolarHBondContact OD2-NH2 3.25Å; D338-V515 HydrophobicContact CB-CG2 4.11Å
339	T	95.5	Very high	96.3	Very high	44 Å²	44	6 Å²	6	27%	0.27	4%	0.04	S	C	.	.	H	α-helix	trans	-71.2	-52.4	-168.9	60.3	0	0	0	0	112.4	A335 V337 T343 V399	A335-T339 WeakPolarHBondContact O-CB 3.34Å; A335-T339 WeakPolarHBondContact O-CG2 3.41Å; A335-T339 PolarHBondContact O-OG1 3.08Å; V337-T339 PolarHBondContact O-N 3.23Å; T339-T343 PolarHBondContact O-N 3.49Å; T339-T343 PolarHBondContact O-OG1 3.28Å; T339-V399 HydrophobicContact CG2-CG1 3.76Å
340	T	97.4	Very high	96.4	Very high	1 Å²	1	7 Å²	7	1%	0.006	5%	0.045	C	C	.	.	H	α-helix	trans	-67.4	-46.1	177.8	-65	0	0	0	0	111.3	A213 N342 T343 L344 E485 M486	A213-T340 HydrophobicContact CB-CG2 4.35Å; T340-N342 PolarHBondContact O-N 3.4Å; T340-T343 PolarHBondContact O-N 2.93Å; T340-T343 VanDerWaalsContact O-N 3.12Å; T340-L344 HydrophobicContact CG2-CD1 3.8Å; T340-L344 HydrophobicContact CG2-CG 4.42Å; T340-L344 PolarHBondContact O-N 3.16Å; T340-E485 WeakPolarHBondContact CB-OE1 3.32Å; T340-E485 HydrophobicContact CG2-CG 3.75Å; T340-E485 WeakPolarHBondContact CG2-OE1 3.37Å; T340-E485 PolarHBondContact OG1-OE1 2.99Å; T340-M486 HydrophobicContact CG2-CG 3.74Å; T340-M486 HydrophobicContact CG2-SD 4.5Å
341	S	97.2	Very high	96.5	Very high	2 Å²	2	7 Å²	7	1%	0.014	5%	0.045	C	C	.	.	H	α-helix	trans	-59.5	-43.8	-177.2	57.7	0	0	0	0	113.2	F209 V337 D338 T345	F209-S341 WeakPolarHBondContact O-CB 3.26Å; V337-S341 WeakPolarHBondContact O-CB 3.48Å; V337-S341 PolarHBondContact O-N 3.44Å; V337-S341 PolarHBondContact O-OG 3.09Å; D338-S341 WeakPolarHBondContact CA-OG 3.48Å; D338-S341 PolarHBondContact O-OG 2.84Å; S341-T345 WeakPolarHBondContact O-CB 3.24Å; S341-T345 PolarHBondContact O-N 3.46Å; S341-T345 PolarHBondContact O-OG1 3.44Å
342	N	96.6	Very high	96.7	Very high	8 Å²	8	7.7 Å²	7.7	4%	0.043	5%	0.049	C	C	.	.	H	α-helix	trans	-67.4	-37.7	176.4	-76.2	-69.3	0	0	0	112.1	D338 T340 T345 W346 V517 P518	D338-N342 WeakPolarHBondContact O-CB 3.19Å; D338-N342 PolarHBondContact O-N 3.34Å; D338-N342 PolarHBondContact O-ND2 2.93Å; T340-N342 PolarHBondContact O-N 3.4Å; N342-T345 PolarHBondContact O-N 3.5Å; N342-W346 PolarHBondContact O-N 2.69Å; N342-V517 WeakPolarHBondContact ND2-CG1 3.45Å; N342-V517 WeakPolarHBondContact OD1-CA 3.43Å; N342-V517 WeakPolarHBondContact OD1-CB 3.49Å; N342-V517 WeakPolarHBondContact OD1-CG1 3.03Å; N342-P518 VanDerWaalsContact OD1-CD 3.23Å; N342-P518 WeakPolarHBondContact OD1-CD 3.39Å
343	T	98.4	Very high	96.7	Very high	4 Å²	4	12.3 Å²	12.3	3%	0.025	7%	0.068	C	C	.	.	H	α-helix	trans	-63.6	-47.9	177.7	-55	0	0	0	0	111	T339 T340 T345 W346 A347 T393 L394 V399 M486	T339-T343 PolarHBondContact O-N 3.49Å; T339-T343 PolarHBondContact O-OG1 3.28Å; T340-T343 PolarHBondContact O-N 2.93Å; T340-T343 VanDerWaalsContact O-N 3.12Å; T343-T345 VanDerWaalsContact C-N 3.31Å; T343-T345 PolarHBondContact O-N 2.91Å; T343-W346 PolarHBondContact O-N 3.38Å; T343-A347 WeakPolarHBondContact O-CB 3.38Å; T343-A347 PolarHBondContact O-N 3.45Å; T343-T393 HydrophobicContact CG2-CG2 4.02Å; T343-T393 WeakPolarHBondContact O-CG2 3.32Å; T343-L394 HydrophobicContact CG2-CD2 3.66Å; T343-L394 HydrophobicContact CG2-CG 3.86Å; T343-V399 VanDerWaalsContact OG1-CG2 3.27Å; T343-V399 WeakPolarHBondContact OG1-CG2 3.32Å; T343-M486 VanDerWaalsContact CB-SD 3.58Å; T343-M486 HydrophobicContact CG2-CE 4.34Å; T343-M486 HydrophobicContact CG2-SD 3.39Å; T343-M486 WeakPolarHBondContact CG2-SD 3.36Å
344	L	98.7	Very high	96.7	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-60	-41.1	175.8	-74.2	165.2	0	0	0	112.4	F209 F212 T340 A347 L348 M486 L489	F209-L344 HydrophobicContact CD1-CB 4.12Å; F209-L344 HydrophobicContact CD1-CD1 3.92Å; F209-L344 HydrophobicContact CD2-CB 3.92Å; F209-L344 HydrophobicContact CE1-CB 4.17Å; F209-L344 HydrophobicContact CE1-CD1 4.28Å; F209-L344 HydrophobicContact CE2-CB 3.93Å; F209-L344 HydrophobicContact CG-CB 4Å; F209-L344 HydrophobicContact CG-CD1 4.32Å; F209-L344 HydrophobicContact CZ-CB 4.05Å; F212-L344 HydrophobicContact CD1-CD1 4.15Å; F212-L344 HydrophobicContact CE1-CD1 4.24Å; T340-L344 HydrophobicContact CG2-CD1 3.8Å; T340-L344 HydrophobicContact CG2-CG 4.42Å; T340-L344 PolarHBondContact O-N 3.16Å; L344-A347 PolarHBondContact O-N 3.11Å; L344-L348 PolarHBondContact O-N 3.41Å; L344-M486 HydrophobicContact CD2-CB 4.19Å; L344-M486 HydrophobicContact CD2-CG 4.14Å; L344-M486 HydrophobicContact CG-CG 4.06Å; L344-L489 HydrophobicContact CD1-CD2 3.71Å; L344-L489 HydrophobicContact CD2-CD2 4.29Å
345	T	98.3	Very high	96.8	Very high	1 Å²	1	18 Å²	18	1%	0.006	10%	0.103	C	C	.	.	H	α-helix	trans	-59.9	-47.7	177.4	-58.3	0	0	0	0	111.5	A206 F209 S341 N342 T343 Y349 P518 V522	A206-T345 WeakPolarHBondContact CA-OG1 3.44Å; A206-T345 HydrophobicContact CB-CG2 4.11Å; F209-T345 WeakPolarHBondContact CD2-OG1 3.22Å; S341-T345 WeakPolarHBondContact O-CB 3.24Å; S341-T345 PolarHBondContact O-N 3.46Å; S341-T345 PolarHBondContact O-OG1 3.44Å; N342-T345 PolarHBondContact O-N 3.5Å; T343-T345 VanDerWaalsContact C-N 3.31Å; T343-T345 PolarHBondContact O-N 2.91Å; T345-Y349 WeakPolarHBondContact O-CB 3.43Å; T345-Y349 PolarHBondContact O-N 3.36Å; T345-P518 HydrophobicContact CG2-CG 3.87Å; T345-V522 HydrophobicContact CG2-CB 4.03Å; T345-V522 HydrophobicContact CG2-CG1 4.17Å; T345-V522 HydrophobicContact CG2-CG2 3.69Å
346	W	98.4	Very high	97	Very high	2 Å²	2	24.8 Å²	24.8	1%	0.008	13%	0.131	C	C	.	.	H	α-helix	trans	-68.2	-36.4	177.9	-72.4	119.2	0	0	0	112.7	N342 T343 Y349 H350 T393 Y397 L508 P518	N342-W346 PolarHBondContact O-N 2.69Å; T343-W346 PolarHBondContact O-N 3.38Å; W346-Y349 AromaticContact CE3-CD1 3.92Å; W346-Y349 HydrophobicContact CE3-CD1 3.92Å; W346-Y349 HydrophobicContact CE3-CG 4.38Å; W346-Y349 HydrophobicContact CZ3-CD1 4.03Å; W346-Y349 HydrophobicContact CZ3-CE1 4.32Å; W346-Y349 PolarHBondContact O-N 3.45Å; W346-H350 PolarHBondContact O-CD2 3.32Å; W346-H350 PolarHBondContact O-N 3.42Å; W346-H350 VanDerWaalsContact O-N 3.08Å; W346-T393 HydrophobicContact CB-CG2 3.67Å; W346-Y397 HydrophobicContact CB-CD2 3.73Å; W346-Y397 HydrophobicContact CB-CE2 4.2Å; W346-Y397 HydrophobicContact CB-CG 4.04Å; W346-Y397 AromaticContact CD1-CD1 3.95Å; W346-Y397 AromaticContact CD1-CG 3.65Å; W346-Y397 AromaticContact CD2-CD1 3.49Å; W346-Y397 HydrophobicContact CD2-CD1 3.49Å; W346-Y397 VanDerWaalsContact CD2-CD1 3.49Å; W346-Y397 AromaticContact CD2-CD2 3.95Å; W346-Y397 HydrophobicContact CD2-CD2 3.95Å; W346-Y397 AromaticContact CD2-CE1 3.56Å; W346-Y397 HydrophobicContact CD2-CE1 3.56Å; W346-Y397 HydrophobicContact CD2-CE2 4.06Å; W346-Y397 AromaticContact CD2-CG 3.67Å; W346-Y397 HydrophobicContact CD2-CG 3.67Å; W346-Y397 AromaticContact CD2-CZ 3.84Å; W346-Y397 AromaticContact CE2-CD1 3.4Å; W346-Y397 VanDerWaalsContact CE2-CD1 3.4Å; W346-Y397 AromaticContact CE2-CE1 3.69Å; W346-Y397 AromaticContact CE2-CG 3.92Å; W346-Y397 AromaticContact CE3-CD1 3.93Å; W346-Y397 HydrophobicContact CE3-CD1 3.93Å; W346-Y397 HydrophobicContact CE3-CD2 4.28Å; W346-Y397 AromaticContact CE3-CE1 3.46Å; W346-Y397 HydrophobicContact CE3-CE1 3.46Å; W346-Y397 VanDerWaalsContact CE3-CE1 3.46Å; W346-Y397 AromaticContact CE3-CE2 3.91Å; W346-Y397 HydrophobicContact CE3-CE2 3.91Å; W346-Y397 HydrophobicContact CE3-CG 4.3Å; W346-Y397 AromaticContact CE3-CZ 3.44Å; W346-Y397 VanDerWaalsContact CE3-CZ 3.44Å; W346-Y397 AromaticContact CG-CD1 3.87Å; W346-Y397 HydrophobicContact CG-CD1 3.87Å; W346-Y397 AromaticContact CG-CD2 3.71Å; W346-Y397 HydrophobicContact CG-CD2 3.71Å; W346-Y397 HydrophobicContact CG-CE1 4.31Å; W346-Y397 HydrophobicContact CG-CE2 4.2Å; W346-Y397 AromaticContact CG-CG 3.52Å; W346-Y397 HydrophobicContact CG-CG 3.52Å; W346-Y397 HydrophobicContact CH2-CD1 4.21Å; W346-Y397 AromaticContact CH2-CE1 3.69Å; W346-Y397 HydrophobicContact CH2-CE1 3.69Å; W346-Y397 AromaticContact CZ2-CD1 3.8Å; W346-Y397 HydrophobicContact CZ2-CD1 3.8Å; W346-Y397 AromaticContact CZ2-CE1 3.77Å; W346-Y397 HydrophobicContact CZ2-CE1 3.77Å; W346-Y397 HydrophobicContact CZ3-CD1 4.27Å; W346-Y397 AromaticContact CZ3-CE1 3.53Å; W346-Y397 HydrophobicContact CZ3-CE1 3.53Å; W346-Y397 AromaticContact CZ3-CZ 3.73Å; W346-Y397 AromaticContact NE1-CD1 3.71Å; W346-Y397 AromaticContact NE1-CG 3.89Å; W346-L508 HydrophobicContact CH2-CB 3.89Å; W346-L508 HydrophobicContact CZ3-CB 3.75Å; W346-L508 HydrophobicContact CZ3-CD1 4.08Å; W346-P518 HydrophobicContact CH2-CB 4.39Å; W346-P518 HydrophobicContact CH2-CG 4.41Å; W346-P518 HydrophobicContact CZ2-CB 4.16Å; W346-P518 HydrophobicContact CZ2-CG 3.88Å
347	A	98.6	Very high	97.1	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-61.2	-50.4	176.5	0	0	0	0	0	111	T343 L344 Y349 H350 L351 T393	T343-A347 WeakPolarHBondContact O-CB 3.38Å; T343-A347 PolarHBondContact O-N 3.45Å; L344-A347 PolarHBondContact O-N 3.11Å; A347-Y349 VanDerWaalsContact C-N 3.35Å; A347-Y349 PolarHBondContact O-N 3.05Å; A347-H350 PolarHBondContact O-N 3.33Å; A347-L351 WeakPolarHBondContact O-CB 3.42Å; A347-L351 VanDerWaalsContact O-CG 3.31Å; A347-L351 WeakPolarHBondContact O-CG 3.45Å; A347-L351 PolarHBondContact O-N 2.99Å; A347-T393 WeakPolarHBondContact CA-OG1 3.45Å; A347-T393 HydrophobicContact CB-CG2 4.1Å
348	L	98.5	Very high	97.3	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-66.1	-35.9	176.6	-75.2	-161.9	0	0	0	112.8	M205 F209 L344 H350 L351 S352 L490 L493 V499 L524 F526	M205-L348 HydrophobicContact CE-CD1 4.32Å; F209-L348 HydrophobicContact CE2-CD1 3.84Å; F209-L348 HydrophobicContact CE2-CG 4.31Å; F209-L348 HydrophobicContact CZ-CD1 3.49Å; F209-L348 VanDerWaalsContact CZ-CD1 3.49Å; F209-L348 HydrophobicContact CZ-CG 4.09Å; L344-L348 PolarHBondContact O-N 3.41Å; L348-H350 VanDerWaalsContact C-N 3.33Å; L348-H350 PolarHBondContact O-N 3.43Å; L348-L351 HydrophobicContact CD2-CD1 4.28Å; L348-L351 PolarHBondContact O-N 3.31Å; L348-S352 WeakPolarHBondContact O-CB 3.1Å; L348-S352 PolarHBondContact O-N 3.37Å; L348-S352 PolarHBondContact O-OG 2.96Å; L348-L490 HydrophobicContact CD2-CD1 3.61Å; L348-L493 HydrophobicContact CD1-CD1 4.16Å; L348-V499 HydrophobicContact CD1-CG1 4.48Å; L348-V499 HydrophobicContact CD2-CG2 4.22Å; L348-L524 HydrophobicContact CB-CD1 3.62Å; L348-L524 HydrophobicContact CD1-CD1 3.65Å; L348-L524 HydrophobicContact CG-CD1 4.34Å; L348-F526 HydrophobicContact CD1-CE1 4.19Å; L348-F526 HydrophobicContact CD1-CZ 4.11Å
349	Y	98.3	Very high	97.6	Very high	6 Å²	6	27.8 Å²	27.8	2%	0.024	14%	0.142	C	C	.	.	H	α-helix	trans	-56.6	-47.7	174.9	172.3	-105.6	0	0	0	111.5	T345 W346 A347 S352 K353 L501 L508	T345-Y349 WeakPolarHBondContact O-CB 3.43Å; T345-Y349 PolarHBondContact O-N 3.36Å; W346-Y349 AromaticContact CE3-CD1 3.92Å; W346-Y349 HydrophobicContact CE3-CD1 3.92Å; W346-Y349 HydrophobicContact CE3-CG 4.38Å; W346-Y349 HydrophobicContact CZ3-CD1 4.03Å; W346-Y349 HydrophobicContact CZ3-CE1 4.32Å; W346-Y349 PolarHBondContact O-N 3.45Å; A347-Y349 VanDerWaalsContact C-N 3.35Å; A347-Y349 PolarHBondContact O-N 3.05Å; Y349-S352 PolarHBondContact O-N 2.96Å; Y349-S352 PolarHBondContact O-OG 3.24Å; Y349-K353 HydrophobicContact CD2-CD 4.42Å; Y349-K353 HydrophobicContact CE1-CD 3.89Å; Y349-K353 HydrophobicContact CE2-CD 3.79Å; Y349-K353 VanDerWaalsContact CZ-CD 3.48Å; Y349-K353 WeakPolarHBondContact O-CG 3.18Å; Y349-K353 PolarHBondContact OH-NZ 3.09Å; Y349-K353 VanDerWaalsContact OH-NZ 3.12Å; Y349-L501 HydrophobicContact CD2-CD1 3.72Å; Y349-L501 HydrophobicContact CE2-CD1 3.93Å; Y349-L501 HydrophobicContact CE2-CD2 3.96Å; Y349-L508 HydrophobicContact CD1-CD1 4.43Å; Y349-L508 HydrophobicContact CD2-CB 4.48Å; Y349-L508 HydrophobicContact CD2-CD1 3.37Å; Y349-L508 HydrophobicContact CD2-CG 3.87Å; Y349-L508 HydrophobicContact CE1-CB 4.44Å; Y349-L508 HydrophobicContact CE2-CB 4.04Å; Y349-L508 HydrophobicContact CE2-CD1 3.7Å; Y349-L508 HydrophobicContact CE2-CG 3.63Å; Y349-L508 HydrophobicContact CG-CD1 3.78Å; Y349-L508 PolarHBondContact OH-N 3.34Å
350	H	98.1	Very high	97.8	Very high	22 Å²	22	27.3 Å²	27.3	10%	0.102	14%	0.142	C	C	.	.	H	α-helix	trans	-70	-44	178.6	-81.8	-71.5	0	0	0	112.9	W346 A347 L348 S352 K353 D354 Y397 F444	W346-H350 PolarHBondContact O-CD2 3.32Å; W346-H350 PolarHBondContact O-N 3.42Å; W346-H350 VanDerWaalsContact O-N 3.08Å; A347-H350 PolarHBondContact O-N 3.33Å; L348-H350 VanDerWaalsContact C-N 3.33Å; L348-H350 PolarHBondContact O-N 3.43Å; H350-S352 PolarHBondContact O-N 3.1Å; H350-K353 PolarHBondContact O-N 3.21Å; H350-D354 PolarHBondContact O-N 3.3Å; H350-D354 VanDerWaalsContact O-N 3.13Å; H350-Y397 AromaticContact CD2-CE2 3.63Å; H350-Y397 AromaticContact NE2-CE2 3.15Å; H350-Y397 WeakPolarHBondContact NE2-CE2 3.31Å; H350-Y397 AromaticContact NE2-CZ 3.43Å; H350-Y397 PolarHBondContact NE2-OH 3.4Å; H350-F444 HydrophobicContact CB-CB 4.38Å; H350-F444 HydrophobicContact CB-CD1 3.75Å; H350-F444 HydrophobicContact CB-CD2 3.68Å; H350-F444 HydrophobicContact CB-CE1 3.84Å; H350-F444 HydrophobicContact CB-CE2 3.81Å; H350-F444 HydrophobicContact CB-CG 3.68Å; H350-F444 HydrophobicContact CB-CZ 3.89Å; H350-F444 AromaticContact CD2-CD2 3.83Å; H350-F444 AromaticContact CG-CD2 3.49Å; H350-F444 VanDerWaalsContact CG-CD2 3.49Å; H350-F444 AromaticContact CG-CG 3.6Å; H350-F444 WeakPolarHBondContact ND1-CB 3.49Å; H350-F444 AromaticContact ND1-CD2 3.91Å; H350-F444 AromaticContact ND1-CG 3.66Å
351	L	98.4	Very high	97.8	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-58.8	-37.3	175.4	-71.4	168	0	0	0	111.9	A347 L348 K353 D354 I357 Q358 L361 V389 L490 I494	A347-L351 WeakPolarHBondContact O-CB 3.42Å; A347-L351 VanDerWaalsContact O-CG 3.31Å; A347-L351 WeakPolarHBondContact O-CG 3.45Å; A347-L351 PolarHBondContact O-N 2.99Å; L348-L351 HydrophobicContact CD2-CD1 4.28Å; L348-L351 PolarHBondContact O-N 3.31Å; L351-K353 PolarHBondContact O-N 3.2Å; L351-D354 CarbonylContact O-C 3.58Å; L351-D354 PolarHBondContact O-N 3.32Å; L351-I357 HydrophobicContact CD2-CG2 3.82Å; L351-Q358 HydrophobicContact CB-CG 4.27Å; L351-Q358 HydrophobicContact CD2-CB 4.34Å; L351-Q358 HydrophobicContact CD2-CG 4.46Å; L351-Q358 PolarHBondContact O-NE2 3.18Å; L351-L361 HydrophobicContact CD1-CD2 3.99Å; L351-L361 HydrophobicContact CD2-CD2 3.96Å; L351-V389 HydrophobicContact CD1-CG1 4.13Å; L351-V389 HydrophobicContact CD2-CG1 4.41Å; L351-V389 HydrophobicContact CD2-CG2 4.41Å; L351-V389 HydrophobicContact CG-CG1 4.39Å; L351-L490 HydrophobicContact CD1-CD1 3.84Å; L351-L490 HydrophobicContact CD1-CD2 4.36Å; L351-I494 HydrophobicContact CD1-CD1 4.02Å; L351-I494 HydrophobicContact CD1-CG1 4.49Å
352	S	97.7	Very high	97.8	Very high	13 Å²	13	28.4 Å²	28.4	9%	0.091	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-17.2	178.7	78.3	0	0	0	0	114.3	L348 Y349 H350 V499	L348-S352 WeakPolarHBondContact O-CB 3.1Å; L348-S352 PolarHBondContact O-N 3.37Å; L348-S352 PolarHBondContact O-OG 2.96Å; Y349-S352 PolarHBondContact O-N 2.96Å; Y349-S352 PolarHBondContact O-OG 3.24Å; H350-S352 PolarHBondContact O-N 3.1Å; S352-V499 WeakPolarHBondContact CA-O 3.41Å
353	K	96.1	Very high	97.9	Very high	113 Å²	113	34 Å²	34	49%	0.491	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.3	-12.5	179.3	-68.5	178.9	67.6	-171.4	0	113.3	Y349 H350 L351 L501	Y349-K353 HydrophobicContact CD2-CD 4.42Å; Y349-K353 HydrophobicContact CE1-CD 3.89Å; Y349-K353 HydrophobicContact CE2-CD 3.79Å; Y349-K353 VanDerWaalsContact CZ-CD 3.48Å; Y349-K353 WeakPolarHBondContact O-CG 3.18Å; Y349-K353 PolarHBondContact OH-NZ 3.09Å; Y349-K353 VanDerWaalsContact OH-NZ 3.12Å; H350-K353 PolarHBondContact O-N 3.21Å; L351-K353 PolarHBondContact O-N 3.2Å; K353-L501 HydrophobicContact CD-CD2 4.47Å; K353-L501 HydrophobicContact CG-CD2 4.36Å
354	D	96.8	Very high	97.9	Very high	47 Å²	47	35.7 Å²	35.7	25%	0.251	18%	0.18	S	C	.	.			trans	-124.8	86.4	-178.2	-164.4	-40.7	0	0	0	110.1	H350 L351 E356 I357 Q358	H350-D354 PolarHBondContact O-N 3.3Å; H350-D354 VanDerWaalsContact O-N 3.13Å; L351-D354 CarbonylContact O-C 3.58Å; L351-D354 PolarHBondContact O-N 3.32Å; D354-E356 PolarHBondContact O-N 2.88Å; D354-E356 PolarHBondContact OD1-N 2.93Å; D354-I357 HydrophobicContact CB-CB 4.27Å; D354-I357 HydrophobicContact CB-CD1 4.15Å; D354-I357 HydrophobicContact CB-CG1 4.39Å; D354-I357 VanDerWaalsContact CG-CD1 3.46Å; D354-I357 PolarHBondContact O-N 3.39Å; D354-I357 WeakPolarHBondContact OD1-CG1 3.41Å; D354-I357 PolarHBondContact OD1-N 3.08Å; D354-I357 WeakPolarHBondContact OD2-CD1 3.3Å; D354-Q358 WeakPolarHBondContact O-CB 3.29Å; D354-Q358 PolarHBondContact O-N 2.76Å
355	P	95.8	Very high	97.8	Very high	77 Å²	77	35.7 Å²	35.7	50%	0.5	18%	0.18	S	C	.	.	H	α-helix	trans	-61.3	-29.2	-179.3	-23.4	34.3	0	0	0	113.4	E359	P355-E359 WeakPolarHBondContact O-CB 3.43Å; P355-E359 PolarHBondContact O-N 3.36Å
356	E	97.4	Very high	97.8	Very high	167 Å²	167	37.6 Å²	37.6	78%	0.78	19%	0.192	S	C	*	.	H	α-helix	trans	-70.5	-49.6	-178.2	-65	179.9	-173	0	0	110.7	D354 Q358 E359 A360	D354-E356 PolarHBondContact O-N 2.88Å; D354-E356 PolarHBondContact OD1-N 2.93Å; E356-Q358 VanDerWaalsContact C-N 3.28Å; E356-Q358 PolarHBondContact O-N 3.14Å; E356-E359 PolarHBondContact O-N 2.95Å; E356-A360 WeakPolarHBondContact O-CB 3.21Å; E356-A360 PolarHBondContact O-N 3.49Å
357	I	97.9	Very high	97.7	Very high	10 Å²	10	40.7 Å²	40.7	5%	0.051	22%	0.224	C	C	.	.	H	α-helix	trans	-61.7	-41.1	174.3	-65.6	174.1	0	0	0	110.4	L351 D354 E359 A360 L361 V389 F444 P446	L351-I357 HydrophobicContact CD2-CG2 3.82Å; D354-I357 HydrophobicContact CB-CB 4.27Å; D354-I357 HydrophobicContact CB-CD1 4.15Å; D354-I357 HydrophobicContact CB-CG1 4.39Å; D354-I357 VanDerWaalsContact CG-CD1 3.46Å; D354-I357 PolarHBondContact O-N 3.39Å; D354-I357 WeakPolarHBondContact OD1-CG1 3.41Å; D354-I357 PolarHBondContact OD1-N 3.08Å; D354-I357 WeakPolarHBondContact OD2-CD1 3.3Å; I357-E359 VanDerWaalsContact C-N 3.33Å; I357-E359 PolarHBondContact O-N 3.42Å; I357-A360 PolarHBondContact O-N 3.06Å; I357-L361 VanDerWaalsContact O-CB 3.28Å; I357-L361 WeakPolarHBondContact O-CB 3.1Å; I357-L361 PolarHBondContact O-N 2.87Å; I357-V389 HydrophobicContact CG2-CG2 4.18Å; I357-F444 HydrophobicContact CD1-CD1 3.94Å; I357-F444 HydrophobicContact CD1-CE1 4.15Å; I357-P446 HydrophobicContact CD1-CG 4.06Å; I357-P446 HydrophobicContact CG2-CG 4.11Å
358	Q	98.4	Very high	97.7	Very high	3 Å²	3	43 Å²	43	1%	0.014	24%	0.238	C	C	.	.	H	α-helix	trans	-65.2	-38.1	-178.7	-160.8	-170.9	139.1	0	0	112.2	L351 D354 E356 H362 I494 K498 V499	L351-Q358 HydrophobicContact CB-CG 4.27Å; L351-Q358 HydrophobicContact CD2-CB 4.34Å; L351-Q358 HydrophobicContact CD2-CG 4.46Å; L351-Q358 PolarHBondContact O-NE2 3.18Å; D354-Q358 WeakPolarHBondContact O-CB 3.29Å; D354-Q358 PolarHBondContact O-N 2.76Å; E356-Q358 VanDerWaalsContact C-N 3.28Å; E356-Q358 PolarHBondContact O-N 3.14Å; Q358-H362 WeakPolarHBondContact O-CB 3.29Å; Q358-H362 PolarHBondContact O-N 3.45Å; Q358-I494 HydrophobicContact CG-CD1 3.98Å; Q358-K498 VanDerWaalsContact OE1-CA 3.27Å; Q358-V499 PolarHBondContact NE2-O 3.17Å
359	E	97.9	Very high	97.5	Very high	64 Å²	64	43.1 Å²	43.1	30%	0.299	24%	0.239	S	C	.	.	H	α-helix	trans	-71.2	-45.1	176.8	-161.7	56.1	-136	0	0	111.8	P355 E356 I357 L361 H362 E363 R529	P355-E359 WeakPolarHBondContact O-CB 3.43Å; P355-E359 PolarHBondContact O-N 3.36Å; E356-E359 PolarHBondContact O-N 2.95Å; I357-E359 VanDerWaalsContact C-N 3.33Å; I357-E359 PolarHBondContact O-N 3.42Å; E359-L361 PolarHBondContact O-N 3.15Å; E359-H362 WeakPolarHBondContact O-CA 3.36Å; E359-H362 WeakPolarHBondContact O-CB 3.32Å; E359-H362 PolarHBondContact O-N 3Å; E359-H362 IonicContact OE1-CE1 3.9Å; E359-H362 IonicContact OE1-CG 3.74Å; E359-H362 IonicContact OE1-ND1 3.94Å; E359-H362 PolarHBondContact OE1-ND1 3.43Å; E359-E363 WeakPolarHBondContact O-CG 3.33Å; E359-E363 PolarHBondContact O-N 3.45Å; E359-R529 VanDerWaalsContact CD-NH1 3.3Å; E359-R529 IonicContact OE1-NH1 3.03Å; E359-R529 PolarHBondContact OE1-NH1 3.14Å; E359-R529 IonicContact OE2-CZ 2.63Å; E359-R529 IonicContact OE2-NH1 2.75Å; E359-R529 PolarHBondContact OE2-NH1 3.42Å; E359-R529 IonicContact OE2-NH2 3.04Å; E359-R529 PolarHBondContact OE2-NH2 3.07Å
360	A	98.1	Very high	97.2	Very high	33 Å²	33	45.7 Å²	45.7	27%	0.273	26%	0.256	S	S	.	.	H	α-helix	trans	-58.8	-37.8	174.3	0	0	0	0	0	112.2	E356 I357 E364 L385	E356-A360 WeakPolarHBondContact O-CB 3.21Å; E356-A360 PolarHBondContact O-N 3.49Å; I357-A360 PolarHBondContact O-N 3.06Å; A360-E364 WeakPolarHBondContact O-CB 3.49Å; A360-E364 PolarHBondContact O-N 3.07Å; A360-L385 HydrophobicContact CB-CD2 3.82Å
361	L	98.2	Very high	96.6	Very high	0 Å²	0	47 Å²	47	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-68	-39.9	175.1	-178.1	63.7	0	0	0	111.9	L351 I357 E359 E364 V365 L385 L386 V389 I494	L351-L361 HydrophobicContact CD1-CD2 3.99Å; L351-L361 HydrophobicContact CD2-CD2 3.96Å; I357-L361 VanDerWaalsContact O-CB 3.28Å; I357-L361 WeakPolarHBondContact O-CB 3.1Å; I357-L361 PolarHBondContact O-N 2.87Å; E359-L361 PolarHBondContact O-N 3.15Å; L361-E364 PolarHBondContact O-N 3.32Å; L361-V365 HydrophobicContact CD1-CG2 4.35Å; L361-V365 WeakPolarHBondContact O-CB 3.05Å; L361-V365 VanDerWaalsContact O-CG2 3.26Å; L361-V365 WeakPolarHBondContact O-CG2 3.13Å; L361-V365 PolarHBondContact O-N 3.04Å; L361-L385 HydrophobicContact CB-CD2 4.23Å; L361-L385 HydrophobicContact CD1-CB 4.48Å; L361-L385 HydrophobicContact CD1-CG 4.25Å; L361-L386 VanDerWaalsContact CD1-CA 3.47Å; L361-L386 HydrophobicContact CD1-CB 3.77Å; L361-L386 HydrophobicContact CD1-CD1 3.92Å; L361-L386 HydrophobicContact CD1-CG 4.49Å; L361-L386 HydrophobicContact CD2-CD1 4.36Å; L361-V389 HydrophobicContact CD2-CG2 4.33Å; L361-I494 HydrophobicContact CB-CG2 4.4Å; L361-I494 HydrophobicContact CD2-CB 4.49Å; L361-I494 HydrophobicContact CD2-CD1 4.44Å; L361-I494 HydrophobicContact CD2-CG1 3.91Å; L361-I494 HydrophobicContact CD2-CG2 4.21Å; L361-I494 HydrophobicContact CG-CG2 4.02Å
362	H	97.9	Very high	95.9	Very high	27 Å²	27	50.7 Å²	50.7	13%	0.125	31%	0.309	C	S	.	.	H	α-helix	trans	-61	-50.1	174.1	167.9	-104.9	0	0	0	111.4	Q358 E359 E364 V365 V366 I494 R529	Q358-H362 WeakPolarHBondContact O-CB 3.29Å; Q358-H362 PolarHBondContact O-N 3.45Å; E359-H362 WeakPolarHBondContact O-CA 3.36Å; E359-H362 WeakPolarHBondContact O-CB 3.32Å; E359-H362 PolarHBondContact O-N 3Å; E359-H362 IonicContact OE1-CE1 3.9Å; E359-H362 IonicContact OE1-CG 3.74Å; E359-H362 IonicContact OE1-ND1 3.94Å; E359-H362 PolarHBondContact OE1-ND1 3.43Å; H362-E364 VanDerWaalsContact C-N 3.34Å; H362-E364 PolarHBondContact O-N 3.14Å; H362-V365 PolarHBondContact O-N 3.35Å; H362-V365 VanDerWaalsContact O-N 3.15Å; H362-V366 WeakPolarHBondContact NE2-CG1 3.38Å; H362-V366 WeakPolarHBondContact O-CG2 3.15Å; H362-V366 PolarHBondContact O-N 3.21Å; H362-I494 HydrophobicContact CB-CG2 3.84Å; H362-I494 PolarHBondContact CD2-O 3.06Å; H362-I494 VanDerWaalsContact CD2-O 3.31Å; H362-R529 WeakPolarHBondContact CD2-CD 3.48Å; H362-R529 VanDerWaalsContact CG-CZ 3.47Å; H362-R529 VanDerWaalsContact CG-NH1 3.29Å; H362-R529 PolarHBondContact ND1-NH1 3.35Å; H362-R529 VanDerWaalsContact ND1-NH1 3.2Å; H362-R529 WeakPolarHBondContact NE2-CD 3.42Å
363	E	97.6	Very high	95.7	Very high	124 Å²	124	55.5 Å²	55.5	58%	0.579	33%	0.33	S	S	*	.	H	α-helix	trans	-56.6	-44.7	176.2	-70.8	176.9	179.4	0	0	112.2	E359 G367	E359-E363 WeakPolarHBondContact O-CG 3.33Å; E359-E363 PolarHBondContact O-N 3.45Å; E363-G367 PolarHBondContact O-N 3.37Å
364	E	97.9	Very high	95.7	Very high	40 Å²	40	52.8 Å²	52.8	19%	0.187	32%	0.323	C	S	.	.	H	α-helix	trans	-59.5	-48.1	175.1	-176.4	-175.8	-103	0	0	111.4	A360 L361 H362 V368 L383 P384 L385 L386	A360-E364 WeakPolarHBondContact O-CB 3.49Å; A360-E364 PolarHBondContact O-N 3.07Å; L361-E364 PolarHBondContact O-N 3.32Å; H362-E364 VanDerWaalsContact C-N 3.34Å; H362-E364 PolarHBondContact O-N 3.14Å; E364-V368 PolarHBondContact O-N 2.89Å; E364-L383 HydrophobicContact CG-CD2 3.74Å; E364-L383 WeakPolarHBondContact O-CD2 3.49Å; E364-L383 VanDerWaalsContact OE2-C 3.26Å; E364-L383 WeakPolarHBondContact OE2-CA 3.42Å; E364-P384 WeakPolarHBondContact OE1-CD 3.29Å; E364-P384 WeakPolarHBondContact OE1-CG 3.4Å; E364-L385 VanDerWaalsContact CD-CB 3.42Å; E364-L385 VanDerWaalsContact CD-N 3.34Å; E364-L385 WeakPolarHBondContact OE1-CB 3.38Å; E364-L385 PolarHBondContact OE1-N 2.78Å; E364-L385 WeakPolarHBondContact OE2-CA 3.32Å; E364-L385 WeakPolarHBondContact OE2-CB 3.3Å; E364-L385 PolarHBondContact OE2-N 2.87Å; E364-L385 VanDerWaalsContact OE2-N 3.08Å; E364-L386 PolarHBondContact OE2-N 3.48Å
365	V	97.9	Very high	95.7	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-65.1	-49.9	-177.4	170	0	0	0	0	111.3	L361 H362 G367 V368 V369 L383 A491 Q495	L361-V365 HydrophobicContact CD1-CG2 4.35Å; L361-V365 WeakPolarHBondContact O-CB 3.05Å; L361-V365 VanDerWaalsContact O-CG2 3.26Å; L361-V365 WeakPolarHBondContact O-CG2 3.13Å; L361-V365 PolarHBondContact O-N 3.04Å; H362-V365 PolarHBondContact O-N 3.35Å; H362-V365 VanDerWaalsContact O-N 3.15Å; V365-G367 VanDerWaalsContact C-N 3.29Å; V365-G367 PolarHBondContact O-N 3.03Å; V365-V368 PolarHBondContact O-N 3.3Å; V365-V369 PolarHBondContact O-N 3.46Å; V365-L383 HydrophobicContact CG2-CD2 4.3Å; V365-A491 HydrophobicContact CG1-CB 4.22Å; V365-A491 HydrophobicContact CG2-CB 4.37Å; V365-Q495 HydrophobicContact CG1-CB 4.02Å; V365-Q495 HydrophobicContact CG1-CG 4.45Å
366	V	97.1	Very high	95.7	Very high	42 Å²	42	49.6 Å²	49.6	26%	0.255	30%	0.3	S	S	.	.	H	α-helix	trans	-70.3	-27.1	-178.3	-58.9	0	0	0	0	112.7	H362 V368 V369 P370 Q495	H362-V366 WeakPolarHBondContact NE2-CG1 3.38Å; H362-V366 WeakPolarHBondContact O-CG2 3.15Å; H362-V366 PolarHBondContact O-N 3.21Å; V366-V368 VanDerWaalsContact C-N 3.29Å; V366-V368 PolarHBondContact O-N 3.22Å; V366-V369 WeakPolarHBondContact CA-O 3.4Å; V366-V369 CarbonylContact O-C 3.04Å; V366-P370 WeakPolarHBondContact O-CA 3.3Å; V366-Q495 HydrophobicContact CG1-CG 4.18Å
367	G	97.1	Very high	95.6	Very high	67 Å²	67	45.5 Å²	45.5	69%	0.691	28%	0.281	S	S	*	.	H	α-helix	trans	-67.5	-27.6	174.7	0	0	0	0	0	113.6	E363 V365	E363-G367 PolarHBondContact O-N 3.37Å; V365-G367 VanDerWaalsContact C-N 3.29Å; V365-G367 PolarHBondContact O-N 3.03Å
368	V	97.7	Very high	95.5	Very high	48 Å²	48	52.4 Å²	52.4	29%	0.291	31%	0.31	S	S	.	.	H	α-helix	trans	-97.7	-43	176.8	178.9	0	0	0	0	111.6	E364 V365 V366 D379 H382 L383	E364-V368 PolarHBondContact O-N 2.89Å; V365-V368 PolarHBondContact O-N 3.3Å; V366-V368 VanDerWaalsContact C-N 3.29Å; V366-V368 PolarHBondContact O-N 3.22Å; V368-D379 HydrophobicContact CG1-CB 3.97Å; V368-H382 HydrophobicContact CG1-CB 4Å; V368-H382 HydrophobicContact CG2-CB 3.81Å; V368-L383 HydrophobicContact CB-CD2 3.83Å; V368-L383 HydrophobicContact CB-CG 4.43Å; V368-L383 HydrophobicContact CG1-CD2 4.37Å; V368-L383 HydrophobicContact CG1-CG 4.45Å; V368-L383 HydrophobicContact CG2-CD2 3.69Å; V368-L383 HydrophobicContact CG2-CG 4.39Å
369	V	95.7	Very high	95.5	Very high	3 Å²	3	53.5 Å²	53.5	2%	0.018	32%	0.316	C	S	.	.	S	Bend	trans	-124.5	91.2	-178.1	-171.2	0	0	0	0	108.4	V365 V366 Q373 P375 D379 Q495	V365-V369 PolarHBondContact O-N 3.46Å; V366-V369 WeakPolarHBondContact CA-O 3.4Å; V366-V369 CarbonylContact O-C 3.04Å; V369-Q373 HydrophobicContact CG1-CB 3.76Å; V369-P375 HydrophobicContact CB-CG 4.49Å; V369-P375 HydrophobicContact CG1-CB 4.48Å; V369-P375 HydrophobicContact CG1-CG 4.06Å; V369-P375 HydrophobicContact CG2-CB 4.28Å; V369-P375 HydrophobicContact CG2-CG 4.47Å; V369-D379 HydrophobicContact CG2-CB 3.85Å; V369-Q495 PolarHBondContact O-NE2 3.29Å
370	P	92.5	Very high	95.4	Very high	59 Å²	59	50.6 Å²	50.6	38%	0.383	30%	0.302	S	S	.	.			trans	-54.1	153.4	-178.9	-27.6	35.2	0	0	0	113	V366 G372 Q373 Q495	V366-P370 WeakPolarHBondContact O-CA 3.3Å; P370-G372 PolarHBondContact O-N 2.91Å; P370-Q373 WeakPolarHBondContact O-CB 3.46Å; P370-Q373 PolarHBondContact O-N 3.29Å; P370-Q495 PolarHBondContact O-NE2 3.41Å
371	A	85.6	Confident	95.2	Very high	50 Å²	50	52.6 Å²	52.6	41%	0.413	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.6	133.5	178.6	0	0	0	0	0	111.6	Q373 C531	A371-Q373 VanDerWaalsContact C-N 3.34Å; A371-C531 HydrophobicContact CB-CB 4.41Å
372	G	82	Confident	95.2	Very high	78 Å²	78	58.8 Å²	58.8	80%	0.804	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.8	-12.3	-176.6	0	0	0	0	0	114.8	P370	P370-G372 PolarHBondContact O-N 2.91Å
373	Q	93.9	Very high	95.2	Very high	114 Å²	114	57.5 Å²	57.5	53%	0.533	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-90.4	148.8	170.1	-60.6	-173.1	20.2	0	0	111.4	V369 P370 A371 Q495	V369-Q373 HydrophobicContact CG1-CB 3.76Å; P370-Q373 WeakPolarHBondContact O-CB 3.46Å; P370-Q373 PolarHBondContact O-N 3.29Å; A371-Q373 VanDerWaalsContact C-N 3.34Å; Q373-Q495 PolarHBondContact O-NE2 3.22Å
374	V	95.8	Very high	95.2	Very high	55 Å²	55	54.8 Å²	54.8	33%	0.333	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-92.8	123.9	179.1	-168.8	0	0	0	0	109.2	N179	N179-V374 HydrophobicContact CB-CG1 4Å; N179-V374 WeakPolarHBondContact ND2-CG1 3.4Å; N179-V374 WeakPolarHBondContact OD1-CG1 3.44Å
375	P	96.6	Very high	95.2	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-59.3	143.2	175.8	-22.2	33.4	0	0	0	112.2	N179 V369 F380 L488 A491 R492	N179-P375 PolarHBondContact ND2-O 3.3Å; V369-P375 HydrophobicContact CB-CG 4.49Å; V369-P375 HydrophobicContact CG1-CB 4.48Å; V369-P375 HydrophobicContact CG1-CG 4.06Å; V369-P375 HydrophobicContact CG2-CB 4.28Å; V369-P375 HydrophobicContact CG2-CG 4.47Å; P375-F380 HydrophobicContact CB-CZ 4.41Å; P375-L488 HydrophobicContact CB-CD2 4.3Å; P375-L488 WeakPolarHBondContact O-CD2 3.3Å; P375-A491 HydrophobicContact CB-CB 4.34Å; P375-A491 HydrophobicContact CG-CB 3.91Å; P375-R492 VanDerWaalsContact CD-CD 3.43Å; P375-R492 HydrophobicContact CG-CG 4.22Å
376	Q	96.8	Very high	95.2	Very high	57 Å²	57	53.3 Å²	53.3	27%	0.266	33%	0.329	S	S	.	.			trans	-123.8	160.3	-179	-67.7	-67	-34.1	0	0	110.5	T175 N179 K378 D379	T175-Q376 VanDerWaalsContact CG2-OE1 3.25Å; N179-Q376 PolarHBondContact ND2-NE2 3.11Å; Q376-K378 HydrophobicContact CB-CG 4.21Å; Q376-K378 PolarHBondContact O-N 3.04Å; Q376-K378 VanDerWaalsContact O-N 3.1Å; Q376-D379 WeakPolarHBondContact CA-OD2 3.2Å; Q376-D379 WeakPolarHBondContact CB-OD2 3.45Å; Q376-D379 PolarHBondContact N-OD2 2.75Å; Q376-D379 WeakPolarHBondContact O-CB 3.32Å; Q376-D379 PolarHBondContact O-N 2.83Å
377	H	95.8	Very high	95.3	Very high	81 Å²	81	54.7 Å²	54.7	38%	0.375	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-52.3	-39.8	-177.6	178.3	78.9	0	0	0	113.6	A172 T175 D379 F380 L484	A172-H377 HydrophobicContact CB-CB 4.04Å; A172-H377 VanDerWaalsContact CB-CD2 3.45Å; A172-H377 WeakPolarHBondContact CB-CD2 3.48Å; T175-H377 HydrophobicContact CG2-CB 4.49Å; T175-H377 WeakPolarHBondContact OG1-CB 3.47Å; H377-D379 PolarHBondContact O-N 3.2Å; H377-F380 WeakPolarHBondContact O-CD2 3.42Å; H377-F380 PolarHBondContact O-N 3.21Å; H377-L484 HydrophobicContact CB-CD1 4.34Å
378	K	95.8	Very high	95.3	Very high	155 Å²	155	51.6 Å²	51.6	67%	0.674	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-61.5	-32.1	-179.6	66.4	-176.8	-179.2	178.6	0	112.7	Q376 F380 A381	Q376-K378 HydrophobicContact CB-CG 4.21Å; Q376-K378 PolarHBondContact O-N 3.04Å; Q376-K378 VanDerWaalsContact O-N 3.1Å; K378-F380 VanDerWaalsContact C-N 3.27Å; K378-F380 PolarHBondContact O-N 3.17Å; K378-A381 WeakPolarHBondContact O-CB 3.43Å; K378-A381 PolarHBondContact O-N 3.36Å
379	D	97	Very high	95.4	Very high	26 Å²	26	49.3 Å²	49.3	14%	0.139	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-69.7	-29.4	-173.2	-54.8	-31	0	0	0	111.1	V368 V369 Q376 H377 A381 H382	V368-D379 HydrophobicContact CG1-CB 3.97Å; V369-D379 HydrophobicContact CG2-CB 3.85Å; Q376-D379 WeakPolarHBondContact CA-OD2 3.2Å; Q376-D379 WeakPolarHBondContact CB-OD2 3.45Å; Q376-D379 PolarHBondContact N-OD2 2.75Å; Q376-D379 WeakPolarHBondContact O-CB 3.32Å; Q376-D379 PolarHBondContact O-N 2.83Å; H377-D379 PolarHBondContact O-N 3.2Å; D379-A381 PolarHBondContact O-N 3.47Å; D379-H382 WeakPolarHBondContact O-CA 3.46Å; D379-H382 PolarHBondContact O-N 2.85Å
380	F	95.9	Very high	95.5	Very high	3 Å²	3	49.6 Å²	49.6	1%	0.013	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-63.4	-17.2	-180	-58.7	-51.6	0	0	0	113.6	P375 H377 K378 H382 L383 L386 K387 L484 Q487 L488 A491	P375-F380 HydrophobicContact CB-CZ 4.41Å; H377-F380 WeakPolarHBondContact O-CD2 3.42Å; H377-F380 PolarHBondContact O-N 3.21Å; K378-F380 VanDerWaalsContact C-N 3.27Å; K378-F380 PolarHBondContact O-N 3.17Å; F380-H382 PolarHBondContact O-N 3.16Å; F380-L383 HydrophobicContact CD1-CD1 3.66Å; F380-L383 HydrophobicContact CE1-CD1 4Å; F380-L383 PolarHBondContact O-N 3.18Å; F380-L386 HydrophobicContact CD1-CD2 3.84Å; F380-L386 HydrophobicContact CE1-CD2 3.84Å; F380-K387 VanDerWaalsContact C-NZ 3.34Å; F380-K387 WeakPolarHBondContact O-CE 3.33Å; F380-K387 PolarHBondContact O-NZ 3Å; F380-L484 HydrophobicContact CD2-CD1 4.17Å; F380-L484 HydrophobicContact CE2-CD1 3.67Å; F380-Q487 HydrophobicContact CD1-CB 3.83Å; F380-Q487 HydrophobicContact CD1-CG 4.44Å; F380-Q487 HydrophobicContact CD2-CB 4.29Å; F380-Q487 HydrophobicContact CE1-CB 3.58Å; F380-Q487 HydrophobicContact CE2-CB 4.03Å; F380-Q487 HydrophobicContact CG-CB 4.22Å; F380-Q487 VanDerWaalsContact CG-OE1 3.25Å; F380-Q487 HydrophobicContact CZ-CB 3.68Å; F380-L488 HydrophobicContact CE2-CD2 3.79Å; F380-L488 HydrophobicContact CE2-CG 3.87Å; F380-L488 HydrophobicContact CZ-CB 4.32Å; F380-L488 HydrophobicContact CZ-CD2 3.54Å; F380-L488 HydrophobicContact CZ-CG 3.69Å; F380-A491 HydrophobicContact CE1-CB 4.49Å
381	A	95.4	Very high	95.7	Very high	76 Å²	76	51.6 Å²	51.6	63%	0.628	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-58.5	-26.2	169	0	0	0	0	0	112.3	K378 D379	K378-A381 WeakPolarHBondContact O-CB 3.43Å; K378-A381 PolarHBondContact O-N 3.36Å; D379-A381 PolarHBondContact O-N 3.47Å
382	H	97	Very high	96.3	Very high	130 Å²	130	49.2 Å²	49.2	60%	0.602	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-108.6	7.8	-176.3	-55.9	-75.6	0	0	0	113.7	V368 D379 F380 P384	V368-H382 HydrophobicContact CG1-CB 4Å; V368-H382 HydrophobicContact CG2-CB 3.81Å; D379-H382 WeakPolarHBondContact O-CA 3.46Å; D379-H382 PolarHBondContact O-N 2.85Å; F380-H382 PolarHBondContact O-N 3.16Å; H382-P384 WeakPolarHBondContact O-CD 3.34Å
383	L	97.6	Very high	97.1	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.231	C	C	.	.			trans	-114.8	62.3	179.2	-61.1	173.9	0	0	0	112.1	E364 V365 V368 F380 L386 K387	E364-L383 HydrophobicContact CG-CD2 3.74Å; E364-L383 WeakPolarHBondContact O-CD2 3.49Å; E364-L383 VanDerWaalsContact OE2-C 3.26Å; E364-L383 WeakPolarHBondContact OE2-CA 3.42Å; V365-L383 HydrophobicContact CG2-CD2 4.3Å; V368-L383 HydrophobicContact CB-CD2 3.83Å; V368-L383 HydrophobicContact CB-CG 4.43Å; V368-L383 HydrophobicContact CG1-CD2 4.37Å; V368-L383 HydrophobicContact CG1-CG 4.45Å; V368-L383 HydrophobicContact CG2-CD2 3.69Å; V368-L383 HydrophobicContact CG2-CG 4.39Å; F380-L383 HydrophobicContact CD1-CD1 3.66Å; F380-L383 HydrophobicContact CE1-CD1 4Å; F380-L383 PolarHBondContact O-N 3.18Å; L383-L386 HydrophobicContact CB-CB 3.98Å; L383-L386 HydrophobicContact CB-CD2 4.22Å; L383-L386 HydrophobicContact CD1-CD2 4.09Å; L383-K387 PolarHBondContact O-N 2.81Å
384	P	97.6	Very high	97.3	Very high	67 Å²	67	40.7 Å²	40.7	44%	0.435	21%	0.209	S	C	.	.	H	α-helix	trans	-67.8	-33.3	-176.1	29	-36.9	0	0	0	114.1	E364 H382 K387 A388 L450	E364-P384 WeakPolarHBondContact OE1-CD 3.29Å; E364-P384 WeakPolarHBondContact OE1-CG 3.4Å; H382-P384 WeakPolarHBondContact O-CD 3.34Å; P384-K387 PolarHBondContact O-N 2.79Å; P384-A388 VanDerWaalsContact O-CB 3.3Å; P384-A388 WeakPolarHBondContact O-CB 3.36Å; P384-A388 PolarHBondContact O-N 2.79Å; P384-L450 HydrophobicContact CB-CD2 3.88Å
385	L	98.2	Very high	97.4	Very high	9 Å²	9	38 Å²	38	5%	0.047	19%	0.193	C	C	.	.	H	α-helix	trans	-69.4	-40.4	176.7	-178.3	60.1	0	0	0	110.9	A360 L361 E364 K387 A388 V389 P446 L450	A360-L385 HydrophobicContact CB-CD2 3.82Å; L361-L385 HydrophobicContact CB-CD2 4.23Å; L361-L385 HydrophobicContact CD1-CB 4.48Å; L361-L385 HydrophobicContact CD1-CG 4.25Å; E364-L385 VanDerWaalsContact CD-CB 3.42Å; E364-L385 VanDerWaalsContact CD-N 3.34Å; E364-L385 WeakPolarHBondContact OE1-CB 3.38Å; E364-L385 PolarHBondContact OE1-N 2.78Å; E364-L385 WeakPolarHBondContact OE2-CA 3.32Å; E364-L385 WeakPolarHBondContact OE2-CB 3.3Å; E364-L385 PolarHBondContact OE2-N 2.87Å; E364-L385 VanDerWaalsContact OE2-N 3.08Å; L385-K387 VanDerWaalsContact C-N 3.32Å; L385-K387 PolarHBondContact O-N 3.45Å; L385-A388 CarbonylContact O-C 3.56Å; L385-A388 WeakPolarHBondContact O-CA 3.27Å; L385-A388 WeakPolarHBondContact O-CB 3.37Å; L385-A388 PolarHBondContact O-N 2.87Å; L385-V389 HydrophobicContact CD1-CG2 4.48Å; L385-V389 WeakPolarHBondContact O-CG2 3.48Å; L385-V389 PolarHBondContact O-N 2.96Å; L385-P446 HydrophobicContact CD1-CB 3.96Å; L385-L450 HydrophobicContact CD1-CD1 4.42Å
386	L	98.6	Very high	97.5	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-54.9	-48.5	171.6	-176.3	74.2	0	0	0	111.5	L361 E364 F380 L383 A388 V389 L390 Q487 L490 A491	L361-L386 VanDerWaalsContact CD1-CA 3.47Å; L361-L386 HydrophobicContact CD1-CB 3.77Å; L361-L386 HydrophobicContact CD1-CD1 3.92Å; L361-L386 HydrophobicContact CD1-CG 4.49Å; L361-L386 HydrophobicContact CD2-CD1 4.36Å; E364-L386 PolarHBondContact OE2-N 3.48Å; F380-L386 HydrophobicContact CD1-CD2 3.84Å; F380-L386 HydrophobicContact CE1-CD2 3.84Å; L383-L386 HydrophobicContact CB-CB 3.98Å; L383-L386 HydrophobicContact CB-CD2 4.22Å; L383-L386 HydrophobicContact CD1-CD2 4.09Å; L386-A388 VanDerWaalsContact C-N 3.29Å; L386-A388 PolarHBondContact O-N 3.18Å; L386-V389 PolarHBondContact O-N 3.11Å; L386-L390 PolarHBondContact O-N 2.86Å; L386-Q487 HydrophobicContact CD2-CB 4.01Å; L386-Q487 HydrophobicContact CD2-CG 4.16Å; L386-L490 HydrophobicContact CD1-CB 4.02Å; L386-L490 HydrophobicContact CD1-CD2 3.74Å; L386-L490 HydrophobicContact CD1-CG 3.81Å; L386-A491 HydrophobicContact CD2-CB 4.22Å
387	K	98.2	Very high	97.5	Very high	71 Å²	71	36.7 Å²	36.7	31%	0.309	19%	0.186	S	C	.	.	H	α-helix	trans	-63.2	-36.8	176	-72.8	174.9	173.2	170.4	0	112	F380 L383 P384 L385 K391	F380-K387 VanDerWaalsContact C-NZ 3.34Å; F380-K387 WeakPolarHBondContact O-CE 3.33Å; F380-K387 PolarHBondContact O-NZ 3Å; L383-K387 PolarHBondContact O-N 2.81Å; P384-K387 PolarHBondContact O-N 2.79Å; L385-K387 VanDerWaalsContact C-N 3.32Å; L385-K387 PolarHBondContact O-N 3.45Å; K387-K391 VanDerWaalsContact O-CG 3.3Å; K387-K391 WeakPolarHBondContact O-CG 3.41Å; K387-K391 PolarHBondContact O-N 3.31Å
388	A	97.9	Very high	97.5	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.008	17%	0.17	C	C	.	.	H	α-helix	trans	-67.3	-40.2	177.7	0	0	0	0	0	112.5	P384 L385 L386 L390 K391 E392 P446 W449 L450	P384-A388 VanDerWaalsContact O-CB 3.3Å; P384-A388 WeakPolarHBondContact O-CB 3.36Å; P384-A388 PolarHBondContact O-N 2.79Å; L385-A388 CarbonylContact O-C 3.56Å; L385-A388 WeakPolarHBondContact O-CA 3.27Å; L385-A388 WeakPolarHBondContact O-CB 3.37Å; L385-A388 PolarHBondContact O-N 2.87Å; L386-A388 VanDerWaalsContact C-N 3.29Å; L386-A388 PolarHBondContact O-N 3.18Å; A388-L390 PolarHBondContact O-N 3.02Å; A388-K391 PolarHBondContact O-N 3.4Å; A388-E392 WeakPolarHBondContact O-CB 3.03Å; A388-E392 PolarHBondContact O-N 2.89Å; A388-P446 HydrophobicContact CB-CB 4.07Å; A388-P446 WeakPolarHBondContact CB-O 3.48Å; A388-W449 HydrophobicContact CB-CB 3.78Å; A388-W449 HydrophobicContact CB-CG 4.47Å; A388-L450 HydrophobicContact CB-CD2 3.97Å; A388-L450 HydrophobicContact CB-CG 4.43Å
389	V	98.7	Very high	97.5	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-59.5	-45.5	175.1	161.6	0	0	0	0	110.9	L351 I357 L361 L385 L386 E392 T393 F444 P446 L490	L351-V389 HydrophobicContact CD1-CG1 4.13Å; L351-V389 HydrophobicContact CD2-CG1 4.41Å; L351-V389 HydrophobicContact CD2-CG2 4.41Å; L351-V389 HydrophobicContact CG-CG1 4.39Å; I357-V389 HydrophobicContact CG2-CG2 4.18Å; L361-V389 HydrophobicContact CD2-CG2 4.33Å; L385-V389 HydrophobicContact CD1-CG2 4.48Å; L385-V389 WeakPolarHBondContact O-CG2 3.48Å; L385-V389 PolarHBondContact O-N 2.96Å; L386-V389 PolarHBondContact O-N 3.11Å; V389-E392 PolarHBondContact O-N 2.9Å; V389-T393 WeakPolarHBondContact O-CB 3.26Å; V389-T393 PolarHBondContact O-N 3.35Å; V389-T393 PolarHBondContact O-OG1 3.45Å; V389-F444 HydrophobicContact CG1-CZ 4.19Å; V389-P446 HydrophobicContact CG2-CB 3.89Å; V389-P446 HydrophobicContact CG2-CG 3.74Å; V389-L490 HydrophobicContact CG1-CD2 3.93Å
390	L	98.6	Very high	97.4	Very high	9 Å²	9	28.3 Å²	28.3	5%	0.047	15%	0.154	C	C	.	.	H	α-helix	trans	-66.9	-41.3	176.8	-67.5	175	0	0	0	112.2	L386 A388 E392 T393 L394 M486 Q487 L490	L386-L390 PolarHBondContact O-N 2.86Å; A388-L390 PolarHBondContact O-N 3.02Å; L390-E392 PolarHBondContact O-N 2.62Å; L390-T393 PolarHBondContact O-N 3.34Å; L390-L394 WeakPolarHBondContact O-CB 3.31Å; L390-L394 WeakPolarHBondContact O-CG 3.27Å; L390-L394 PolarHBondContact O-N 2.58Å; L390-M486 HydrophobicContact CD1-CB 3.93Å; L390-M486 HydrophobicContact CD2-CB 4.04Å; L390-M486 HydrophobicContact CD2-SD 4.3Å; L390-Q487 HydrophobicContact CD1-CG 3.55Å; L390-L490 HydrophobicContact CD2-CD2 4.04Å; L390-L490 HydrophobicContact CG-CD2 4.37Å
391	K	97.9	Very high	97.3	Very high	102 Å²	102	28.5 Å²	28.5	44%	0.443	16%	0.155	S	C	.	.	H	α-helix	trans	-62.8	-41.6	175.9	-76	176.9	178.6	-178.6	0	112.5	K387 A388 L394 R395 W449	K387-K391 VanDerWaalsContact O-CG 3.3Å; K387-K391 WeakPolarHBondContact O-CG 3.41Å; K387-K391 PolarHBondContact O-N 3.31Å; A388-K391 PolarHBondContact O-N 3.4Å; K391-L394 PolarHBondContact O-N 3.19Å; K391-R395 WeakPolarHBondContact O-CB 3.37Å; K391-R395 PolarHBondContact O-N 2.82Å; K391-W449 HydrophobicContact CB-CD2 3.68Å; K391-W449 HydrophobicContact CB-CE3 4.06Å; K391-W449 HydrophobicContact CB-CG 3.95Å; K391-W449 HydrophobicContact CB-CZ2 4.33Å; K391-W449 HydrophobicContact CD-CB 4.35Å; K391-W449 HydrophobicContact CD-CD2 3.98Å; K391-W449 HydrophobicContact CD-CE3 3.69Å; K391-W449 HydrophobicContact CD-CG 4.25Å; K391-W449 HydrophobicContact CD-CZ3 4.37Å; K391-W449 HydrophobicContact CG-CD2 4.47Å; K391-W449 HydrophobicContact CG-CE3 4.42Å
392	E	98.2	Very high	97.2	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-70.2	-38.7	178.4	-172.5	66.6	171.6	0	0	111.8	A388 V389 L390 L394 R395 L396 F444 Q445 P446 R448 W449	A388-E392 WeakPolarHBondContact O-CB 3.03Å; A388-E392 PolarHBondContact O-N 2.89Å; V389-E392 PolarHBondContact O-N 2.9Å; L390-E392 PolarHBondContact O-N 2.62Å; E392-L394 PolarHBondContact O-N 3.2Å; E392-R395 VanDerWaalsContact CD-NE 3.29Å; E392-R395 WeakPolarHBondContact O-CB 3.39Å; E392-R395 PolarHBondContact O-N 3.08Å; E392-R395 IonicContact OE1-CZ 2.7Å; E392-R395 IonicContact OE1-NE 3.97Å; E392-R395 PolarHBondContact OE1-NE 2.82Å; E392-R395 IonicContact OE1-NH2 3.89Å; E392-R395 PolarHBondContact OE1-NH2 3.44Å; E392-R395 IonicContact OE2-CZ 3.42Å; E392-R395 IonicContact OE2-NE 3.2Å; E392-R395 PolarHBondContact OE2-NE 3.04Å; E392-R395 IonicContact OE2-NH2 3.73Å; E392-L396 PolarHBondContact O-N 3.04Å; E392-F444 HydrophobicContact CB-CD2 4.35Å; E392-F444 HydrophobicContact CB-CE2 3.99Å; E392-F444 HydrophobicContact CB-CZ 4.45Å; E392-F444 HydrophobicContact CG-CD2 3.69Å; E392-F444 HydrophobicContact CG-CE2 3.85Å; E392-F444 HydrophobicContact CG-CG 4.17Å; E392-F444 HydrophobicContact CG-CZ 4.49Å; E392-Q445 PolarHBondContact OE1-N 3.35Å; E392-P446 HydrophobicContact CB-CG 4.32Å; E392-P446 HydrophobicContact CG-CG 4.5Å; E392-R448 IonicContact OE1-CZ 2.61Å; E392-R448 IonicContact OE1-NE 3.12Å; E392-R448 PolarHBondContact OE1-NE 3.36Å; E392-R448 IonicContact OE1-NH2 2.76Å; E392-R448 WeakPolarHBondContact OE2-CD 3.46Å; E392-R448 IonicContact OE2-NE 3.86Å; E392-W449 PolarHBondContact OE2-NE1 2.91Å
393	T	98.6	Very high	96.9	Very high	1 Å²	1	22.5 Å²	22.5	1%	0.006	12%	0.119	C	C	.	.	H	α-helix	trans	-56.4	-51.1	170.8	-59.5	0	0	0	0	110.7	T343 W346 A347 V389 L390 R395 L396 Y397	T343-T393 HydrophobicContact CG2-CG2 4.02Å; T343-T393 WeakPolarHBondContact O-CG2 3.32Å; W346-T393 HydrophobicContact CB-CG2 3.67Å; A347-T393 WeakPolarHBondContact CA-OG1 3.45Å; A347-T393 HydrophobicContact CB-CG2 4.1Å; V389-T393 WeakPolarHBondContact O-CB 3.26Å; V389-T393 PolarHBondContact O-N 3.35Å; V389-T393 PolarHBondContact O-OG1 3.45Å; L390-T393 PolarHBondContact O-N 3.34Å; T393-R395 VanDerWaalsContact C-N 3.29Å; T393-R395 PolarHBondContact O-N 3.4Å; T393-L396 PolarHBondContact O-N 3Å; T393-Y397 WeakPolarHBondContact O-CD2 3.25Å; T393-Y397 PolarHBondContact O-N 3.03Å
394	L	98.3	Very high	96.8	Very high	11 Å²	11	22.9 Å²	22.9	6%	0.058	12%	0.122	C	C	.	.	H	α-helix	trans	-68.5	-25.4	-179.9	-73.5	170.1	0	0	0	113.6	T343 L390 K391 E392 Y397 P398 V399 P468 F469	T343-L394 HydrophobicContact CG2-CD2 3.66Å; T343-L394 HydrophobicContact CG2-CG 3.86Å; L390-L394 WeakPolarHBondContact O-CB 3.31Å; L390-L394 WeakPolarHBondContact O-CG 3.27Å; L390-L394 PolarHBondContact O-N 2.58Å; K391-L394 PolarHBondContact O-N 3.19Å; E392-L394 PolarHBondContact O-N 3.2Å; L394-Y397 CarbonylContact O-C 3.51Å; L394-P398 VanDerWaalsContact O-CA 3.28Å; L394-P398 WeakPolarHBondContact O-CA 3.3Å; L394-P398 VanDerWaalsContact O-N 3.15Å; L394-V399 HydrophobicContact CD2-CG2 4.18Å; L394-P468 HydrophobicContact CB-CB 3.73Å; L394-P468 HydrophobicContact CB-CG 3.81Å; L394-P468 HydrophobicContact CD1-CB 4.25Å; L394-P468 HydrophobicContact CD1-CG 4.02Å; L394-P468 HydrophobicContact CD2-CB 4.21Å; L394-P468 HydrophobicContact CG-CB 4.29Å; L394-P468 HydrophobicContact CG-CG 4.45Å; L394-F469 HydrophobicContact CD1-CE2 3.62Å; L394-F469 HydrophobicContact CD1-CZ 3.95Å
395	R	97.8	Very high	96.8	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-67.7	-50.6	171.6	-175.6	-165	64.5	79.2	-6.7	110.4	K391 E392 T393 S432 F438 P441 S443 W449	K391-R395 WeakPolarHBondContact O-CB 3.37Å; K391-R395 PolarHBondContact O-N 2.82Å; E392-R395 VanDerWaalsContact CD-NE 3.29Å; E392-R395 WeakPolarHBondContact O-CB 3.39Å; E392-R395 PolarHBondContact O-N 3.08Å; E392-R395 IonicContact OE1-CZ 2.7Å; E392-R395 IonicContact OE1-NE 3.97Å; E392-R395 PolarHBondContact OE1-NE 2.82Å; E392-R395 IonicContact OE1-NH2 3.89Å; E392-R395 PolarHBondContact OE1-NH2 3.44Å; E392-R395 IonicContact OE2-CZ 3.42Å; E392-R395 IonicContact OE2-NE 3.2Å; E392-R395 PolarHBondContact OE2-NE 3.04Å; E392-R395 IonicContact OE2-NH2 3.73Å; T393-R395 VanDerWaalsContact C-N 3.29Å; T393-R395 PolarHBondContact O-N 3.4Å; R395-S432 WeakPolarHBondContact CG-O 3.32Å; R395-S432 PolarHBondContact NH1-O 3.22Å; R395-S432 WeakPolarHBondContact O-CB 3.35Å; R395-S432 PolarHBondContact O-OG 3.23Å; R395-F438 VanDerWaalsContact CD-CD1 3.48Å; R395-F438 HydrophobicContact CG-CE1 4.25Å; R395-F438 HydrophobicContact CG-CE2 4.31Å; R395-F438 HydrophobicContact CG-CZ 4.07Å; R395-P441 VanDerWaalsContact CZ-O 3.31Å; R395-P441 PolarHBondContact NH1-O 3.18Å; R395-P441 PolarHBondContact NH2-O 2.96Å; R395-S443 PolarHBondContact NH2-O 3.44Å; R395-W449 HydrophobicContact CB-CZ2 4.04Å; R395-W449 HydrophobicContact CG-CZ2 4.35Å
396	L	97.5	Very high	96.6	Very high	2 Å²	2	20.8 Å²	20.8	1%	0.01	11%	0.106	C	C	.	.	H	α-helix	trans	-71.9	-36.4	179.8	-75.8	171.4	0	0	0	111.9	E392 T393 P398 R433 P441 F444	E392-L396 PolarHBondContact O-N 3.04Å; T393-L396 PolarHBondContact O-N 3Å; L396-P398 VanDerWaalsContact C-CD 3.42Å; L396-P398 VanDerWaalsContact O-CD 3.31Å; L396-P398 WeakPolarHBondContact O-CD 3.41Å; L396-R433 PolarHBondContact O-NH1 3.06Å; L396-R433 PolarHBondContact O-NH2 2.98Å; L396-P441 WeakPolarHBondContact CD2-O 3.41Å; L396-F444 HydrophobicContact CD1-CB 3.94Å; L396-F444 HydrophobicContact CD1-CD2 3.91Å; L396-F444 HydrophobicContact CD1-CG 4.44Å
397	Y	97.1	Very high	96.4	Very high	27 Å²	27	21 Å²	21	11%	0.106	11%	0.108	C	C	.	.	S	Bend	trans	-124.6	70.6	-177.6	-52	-85.5	0	0	0	109.8	W346 H350 T393 L394 V399	W346-Y397 HydrophobicContact CB-CD2 3.73Å; W346-Y397 HydrophobicContact CB-CE2 4.2Å; W346-Y397 HydrophobicContact CB-CG 4.04Å; W346-Y397 AromaticContact CD1-CD1 3.95Å; W346-Y397 AromaticContact CD1-CG 3.65Å; W346-Y397 AromaticContact CD2-CD1 3.49Å; W346-Y397 HydrophobicContact CD2-CD1 3.49Å; W346-Y397 VanDerWaalsContact CD2-CD1 3.49Å; W346-Y397 AromaticContact CD2-CD2 3.95Å; W346-Y397 HydrophobicContact CD2-CD2 3.95Å; W346-Y397 AromaticContact CD2-CE1 3.56Å; W346-Y397 HydrophobicContact CD2-CE1 3.56Å; W346-Y397 HydrophobicContact CD2-CE2 4.06Å; W346-Y397 AromaticContact CD2-CG 3.67Å; W346-Y397 HydrophobicContact CD2-CG 3.67Å; W346-Y397 AromaticContact CD2-CZ 3.84Å; W346-Y397 AromaticContact CE2-CD1 3.4Å; W346-Y397 VanDerWaalsContact CE2-CD1 3.4Å; W346-Y397 AromaticContact CE2-CE1 3.69Å; W346-Y397 AromaticContact CE2-CG 3.92Å; W346-Y397 AromaticContact CE3-CD1 3.93Å; W346-Y397 HydrophobicContact CE3-CD1 3.93Å; W346-Y397 HydrophobicContact CE3-CD2 4.28Å; W346-Y397 AromaticContact CE3-CE1 3.46Å; W346-Y397 HydrophobicContact CE3-CE1 3.46Å; W346-Y397 VanDerWaalsContact CE3-CE1 3.46Å; W346-Y397 AromaticContact CE3-CE2 3.91Å; W346-Y397 HydrophobicContact CE3-CE2 3.91Å; W346-Y397 HydrophobicContact CE3-CG 4.3Å; W346-Y397 AromaticContact CE3-CZ 3.44Å; W346-Y397 VanDerWaalsContact CE3-CZ 3.44Å; W346-Y397 AromaticContact CG-CD1 3.87Å; W346-Y397 HydrophobicContact CG-CD1 3.87Å; W346-Y397 AromaticContact CG-CD2 3.71Å; W346-Y397 HydrophobicContact CG-CD2 3.71Å; W346-Y397 HydrophobicContact CG-CE1 4.31Å; W346-Y397 HydrophobicContact CG-CE2 4.2Å; W346-Y397 AromaticContact CG-CG 3.52Å; W346-Y397 HydrophobicContact CG-CG 3.52Å; W346-Y397 HydrophobicContact CH2-CD1 4.21Å; W346-Y397 AromaticContact CH2-CE1 3.69Å; W346-Y397 HydrophobicContact CH2-CE1 3.69Å; W346-Y397 AromaticContact CZ2-CD1 3.8Å; W346-Y397 HydrophobicContact CZ2-CD1 3.8Å; W346-Y397 AromaticContact CZ2-CE1 3.77Å; W346-Y397 HydrophobicContact CZ2-CE1 3.77Å; W346-Y397 HydrophobicContact CZ3-CD1 4.27Å; W346-Y397 AromaticContact CZ3-CE1 3.53Å; W346-Y397 HydrophobicContact CZ3-CE1 3.53Å; W346-Y397 AromaticContact CZ3-CZ 3.73Å; W346-Y397 AromaticContact NE1-CD1 3.71Å; W346-Y397 AromaticContact NE1-CG 3.89Å; H350-Y397 AromaticContact CD2-CE2 3.63Å; H350-Y397 AromaticContact NE2-CE2 3.15Å; H350-Y397 WeakPolarHBondContact NE2-CE2 3.31Å; H350-Y397 AromaticContact NE2-CZ 3.43Å; H350-Y397 PolarHBondContact NE2-OH 3.4Å; T393-Y397 WeakPolarHBondContact O-CD2 3.25Å; T393-Y397 PolarHBondContact O-N 3.03Å; L394-Y397 CarbonylContact O-C 3.51Å; Y397-V399 PolarHBondContact O-N 2.93Å
398	P	96.4	Very high	96.1	Very high	6 Å²	6	23.2 Å²	23.2	4%	0.039	12%	0.119	C	C	.	.			trans	-64.1	110.6	173.3	26.9	-32.1	0	0	0	107.7	L394 L396 V400 H428 Y429 L516	L394-P398 VanDerWaalsContact O-CA 3.28Å; L394-P398 WeakPolarHBondContact O-CA 3.3Å; L394-P398 VanDerWaalsContact O-N 3.15Å; L396-P398 VanDerWaalsContact C-CD 3.42Å; L396-P398 VanDerWaalsContact O-CD 3.31Å; L396-P398 WeakPolarHBondContact O-CD 3.41Å; P398-V400 CarbonylContact O-C 3.55Å; P398-V400 PolarHBondContact O-N 3.49Å; P398-H428 HydrophobicContact CB-CB 4.46Å; P398-Y429 HydrophobicContact CG-CD2 4.39Å; P398-L516 HydrophobicContact CG-CD1 4.21Å; P398-L516 VanDerWaalsContact O-CD1 3.25Å; P398-L516 WeakPolarHBondContact O-CD1 3.33Å
399	V	95.1	Very high	95.9	Very high	14 Å²	14	28.2 Å²	28.2	9%	0.085	14%	0.141	C	C	.	.	S	Bend	trans	-49	-41.5	-174.2	177.2	0	0	0	0	111.3	T339 T343 L394 Y397 P401 V515 L516	T339-V399 HydrophobicContact CG2-CG1 3.76Å; T343-V399 VanDerWaalsContact OG1-CG2 3.27Å; T343-V399 WeakPolarHBondContact OG1-CG2 3.32Å; L394-V399 HydrophobicContact CD2-CG2 4.18Å; Y397-V399 PolarHBondContact O-N 2.93Å; V399-P401 WeakPolarHBondContact O-CD 3.29Å; V399-V515 HydrophobicContact CG1-CB 4.02Å; V399-V515 HydrophobicContact CG1-CG1 3.86Å; V399-V515 CarbonylContact O-C 3.57Å; V399-V515 WeakPolarHBondContact O-CA 3.06Å; V399-V515 WeakPolarHBondContact O-CB 3.13Å; V399-L516 PolarHBondContact O-N 3.28Å
400	V	94	Very high	95.8	Very high	65 Å²	65	34 Å²	34	39%	0.394	17%	0.168	S	C	.	.	S	Bend	trans	-102.1	99.7	170.4	178.6	0	0	0	0	108.4	P398 T402 N403	P398-V400 CarbonylContact O-C 3.55Å; P398-V400 PolarHBondContact O-N 3.49Å; V400-T402 WeakPolarHBondContact CG1-O 3.27Å; V400-T402 PolarHBondContact O-N 3.07Å; V400-N403 HydrophobicContact CG1-CB 4.34Å
401	P	94.7	Very high	95.7	Very high	7 Å²	7	33.8 Å²	33.8	5%	0.045	17%	0.167	C	C	.	.	S	Bend	trans	-72.6	-18.5	-173.7	28	-34.4	0	0	0	113.4	H82 Q85 V399 H428 Y429 A512 L516	H82-P401 HydrophobicContact CB-CB 3.99Å; H82-P401 HydrophobicContact CB-CG 4.47Å; Q85-P401 PolarHBondContact NE2-O 2.8Å; V399-P401 WeakPolarHBondContact O-CD 3.29Å; P401-H428 PolarHBondContact O-N 2.86Å; P401-H428 VanDerWaalsContact O-N 3.09Å; P401-Y429 PolarHBondContact O-N 2.84Å; P401-A512 HydrophobicContact CG-CB 4.4Å; P401-L516 HydrophobicContact CB-CD1 4.1Å; P401-L516 HydrophobicContact CB-CD2 4.33Å; P401-L516 HydrophobicContact CB-CG 4.02Å; P401-L516 HydrophobicContact CG-CD2 4.22Å; P401-L516 HydrophobicContact CG-CG 4.01Å
402	T	93.2	Very high	95.6	Very high	52 Å²	52	33 Å²	33	32%	0.319	17%	0.165	S	C	.	.			trans	-141.1	134	179.1	-48.4	0	0	0	0	109.6	Q85 V400 V425 F426	Q85-T402 PolarHBondContact NE2-OG1 3.29Å; V400-T402 WeakPolarHBondContact CG1-O 3.27Å; V400-T402 PolarHBondContact O-N 3.07Å; T402-V425 HydrophobicContact CG2-CG1 3.24Å; T402-F426 WeakPolarHBondContact CA-O 3.47Å
403	N	91.8	Very high	95.6	Very high	29 Å²	29	33 Å²	33	16%	0.155	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	-176.3	162	67.6	15.5	0	0	0	109.6	V400 F426 H428	V400-N403 HydrophobicContact CG1-CB 4.34Å; N403-F426 PolarHBondContact N-O 2.93Å; N403-F426 PolarHBondContact O-N 2.84Å; N403-F426 WeakPolarHBondContact OD1-CB 3.48Å; N403-F426 WeakPolarHBondContact OD1-CD2 3.31Å; N403-H428 PolarHBondContact ND2-NE2 3.31Å; N403-H428 VanDerWaalsContact ND2-NE2 3.2Å; N403-H428 PolarHBondContact OD1-NE2 3.39Å
404	S	95.1	Very high	95.4	Very high	7 Å²	7	36.5 Å²	36.5	5%	0.049	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	168.8	-176	53.6	0	0	0	0	113.5	R127 F424	R127-S404 VanDerWaalsContact CA-O 3.32Å; R127-S404 WeakPolarHBondContact CA-O 3.42Å; R127-S404 CarbonylContact O-C 3.58Å; R127-S404 VanDerWaalsContact O-C 3.23Å; R127-S404 VanDerWaalsContact O-CB 3.32Å; R127-S404 WeakPolarHBondContact O-CB 3.26Å; R127-S404 PolarHBondContact O-OG 3.14Å; S404-F424 CarbonylContact C-O 3.58Å; S404-F424 WeakPolarHBondContact CA-O 3.23Å; S404-F424 WeakPolarHBondContact CB-O 3.38Å
405	R	96	Very high	95.3	Very high	2 Å²	2	36.6 Å²	36.6	1%	0.008	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	136.1	165.9	-71.2	-68.8	-176.8	-80.2	0.2	110.3	E121 V126 R127 I407 Q423 F424 F426 Y471	E121-R405 IonicContact OE2-CZ 2.93Å; E121-R405 IonicContact OE2-NE 3.76Å; E121-R405 PolarHBondContact OE2-NE 3.32Å; E121-R405 VanDerWaalsContact OE2-NE 3.11Å; E121-R405 IonicContact OE2-NH2 3.94Å; V126-R405 CarbonylContact O-C 3.49Å; V126-R405 VanDerWaalsContact O-CA 3.26Å; V126-R405 WeakPolarHBondContact O-CA 3.31Å; R127-R405 PolarHBondContact O-N 2.9Å; R405-I407 HydrophobicContact CB-CD1 4.03Å; R405-Q423 CarbonylContact O-C 3.54Å; R405-Q423 WeakPolarHBondContact O-CA 3.45Å; R405-F424 PolarHBondContact N-O 2.73Å; R405-F424 PolarHBondContact O-N 2.86Å; R405-F426 HydrophobicContact CB-CE2 4.21Å; R405-F426 HydrophobicContact CB-CZ 3.91Å; R405-F426 HydrophobicContact CG-CE2 3.53Å; R405-F426 HydrophobicContact CG-CZ 3.65Å; R405-Y471 PolarHBondContact NH2-O 3.44Å
406	I	95.6	Very high	95.2	Very high	30 Å²	30	36.8 Å²	36.8	15%	0.154	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	123.1	161.5	-59.1	178.2	0	0	0	106.9	V126 N421 Q423	V126-I406 HydrophobicContact CB-CB 4.19Å; V126-I406 HydrophobicContact CG1-CB 4.2Å; V126-I406 HydrophobicContact CG1-CD1 3.98Å; V126-I406 HydrophobicContact CG1-CG1 4.32Å; V126-I406 PolarHBondContact O-N 2.99Å; I406-N421 HydrophobicContact CG2-CB 4.45Å; I406-Q423 HydrophobicContact CG1-CB 4.07Å; I406-Q423 HydrophobicContact CG1-CG 4.16Å
407	I	94.6	Very high	95.2	Very high	6 Å²	6	39.1 Å²	39.1	3%	0.031	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	113.6	-179.7	-55.3	-64.2	0	0	0	109.1	V117 R405 K409 I411 N421 T422 F424	V117-I407 HydrophobicContact CG1-CD1 3.87Å; V117-I407 HydrophobicContact CG1-CG1 3.99Å; R405-I407 HydrophobicContact CB-CD1 4.03Å; I407-K409 HydrophobicContact CG2-CG 3.97Å; I407-K409 WeakPolarHBondContact CG2-O 3.32Å; I407-K409 PolarHBondContact O-N 3.35Å; I407-K409 VanDerWaalsContact O-N 3.14Å; I407-I411 HydrophobicContact CB-CD1 4.34Å; I407-I411 HydrophobicContact CG1-CD1 3.98Å; I407-I411 HydrophobicContact CG2-CD1 4.07Å; I407-I411 HydrophobicContact CG2-CG1 4.17Å; I407-I411 HydrophobicContact CG2-CG2 3.61Å; I407-N421 WeakPolarHBondContact O-CA 3.44Å; I407-N421 PolarHBondContact O-N 3.22Å; I407-T422 PolarHBondContact N-O 3.33Å; I407-T422 VanDerWaalsContact N-O 3.11Å; I407-F424 HydrophobicContact CB-CE2 4.31Å; I407-F424 HydrophobicContact CG1-CD2 3.71Å; I407-F424 HydrophobicContact CG1-CE2 3.86Å
408	E	91.4	Very high	95.1	Very high	117 Å²	117	37.9 Å²	37.9	55%	0.547	20%	0.195	S	C	.	.	S	Bend	trans	-78.5	9.1	-173.1	-59.4	-179.3	153.7	0	0	114.1
409	K	93.9	Very high	95.1	Very high	106 Å²	106	40.7 Å²	40.7	46%	0.461	21%	0.213	S	C	.	.	S	Bend	trans	-137.1	162.5	176.6	64.2	178	179.1	-176.1	0	110.4	Q120 I407 I411	Q120-K409 WeakPolarHBondContact O-CE 3.47Å; Q120-K409 PolarHBondContact O-NZ 3Å; I407-K409 HydrophobicContact CG2-CG 3.97Å; I407-K409 WeakPolarHBondContact CG2-O 3.32Å; I407-K409 PolarHBondContact O-N 3.35Å; I407-K409 VanDerWaalsContact O-N 3.14Å; K409-I411 HydrophobicContact CD-CG2 4.44Å; K409-I411 HydrophobicContact CG-CG2 3.93Å
410	E	96	Very high	95	Very high	122 Å²	122	47 Å²	47	57%	0.57	24%	0.239	S	C	*	.			trans	-66.1	135.3	169.2	-173.2	177.4	77.1	0	0	109.8	L417 F418	E410-L417 HydrophobicContact CG-CD1 3.56Å; E410-L417 HydrophobicContact CG-CD2 4.3Å; E410-L417 HydrophobicContact CG-CG 3.75Å; E410-F418 WeakPolarHBondContact CA-O 3.3Å; E410-F418 WeakPolarHBondContact CG-O 3.46Å
411	I	96.6	Very high	95	Very high	4 Å²	4	48.6 Å²	48.6	2%	0.021	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	150.2	178.5	61.5	162.3	0	0	0	112	V117 Q120 I407 K409 V413 F418 F424	V117-I411 HydrophobicContact CG1-CD1 4.42Å; V117-I411 HydrophobicContact CG2-CD1 4.18Å; Q120-I411 HydrophobicContact CB-CG2 3.98Å; I407-I411 HydrophobicContact CB-CD1 4.34Å; I407-I411 HydrophobicContact CG1-CD1 3.98Å; I407-I411 HydrophobicContact CG2-CD1 4.07Å; I407-I411 HydrophobicContact CG2-CG1 4.17Å; I407-I411 HydrophobicContact CG2-CG2 3.61Å; K409-I411 HydrophobicContact CD-CG2 4.44Å; K409-I411 HydrophobicContact CG-CG2 3.93Å; I411-V413 HydrophobicContact CD1-CG2 3.66Å; I411-V413 HydrophobicContact CG1-CG2 4.16Å; I411-F418 HydrophobicContact CG1-CB 4.43Å; I411-F418 PolarHBondContact N-O 3.02Å; I411-F418 VanDerWaalsContact N-O 3.13Å; I411-F418 PolarHBondContact O-N 3.45Å; I411-F424 HydrophobicContact CD1-CE2 3.69Å; I411-F424 HydrophobicContact CD1-CZ 3.79Å; I411-F424 HydrophobicContact CG1-CE2 4.16Å; I411-F424 HydrophobicContact CG1-CZ 4.12Å
412	E	96.6	Very high	95	Very high	86 Å²	86	48.6 Å²	48.6	40%	0.402	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	131.5	170.1	-169.4	179.3	145.3	0	0	110	Q120 G415 F416	Q120-E412 PolarHBondContact NE2-O 3.45Å; E412-G415 WeakPolarHBondContact OE1-CA 3.4Å; E412-F416 CarbonylContact C-O 3.58Å; E412-F416 VanDerWaalsContact CA-O 3.3Å; E412-F416 WeakPolarHBondContact CA-O 3.21Å
413	V	96.8	Very high	95.2	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	123.6	174.5	-173.5	0	0	0	0	108.3	M95 L113 Q116 V117 I411 G415 F416 F418 F424	M95-V413 HydrophobicContact CE-CG1 3.9Å; L113-V413 HydrophobicContact CD2-CG1 3.97Å; Q116-V413 HydrophobicContact CB-CG1 4.23Å; V117-V413 HydrophobicContact CG2-CG1 4.19Å; V117-V413 HydrophobicContact CG2-CG2 3.64Å; I411-V413 HydrophobicContact CD1-CG2 3.66Å; I411-V413 HydrophobicContact CG1-CG2 4.16Å; V413-G415 PolarHBondContact O-N 3.41Å; V413-F416 PolarHBondContact N-O 2.91Å; V413-F416 WeakPolarHBondContact O-CB 3.47Å; V413-F416 WeakPolarHBondContact O-CD2 3.38Å; V413-F416 PolarHBondContact O-N 3.29Å; V413-F418 HydrophobicContact CB-CD2 4.13Å; V413-F418 HydrophobicContact CB-CE2 3.88Å; V413-F418 HydrophobicContact CG2-CD2 4.15Å; V413-F418 HydrophobicContact CG2-CE2 4.34Å; V413-F424 HydrophobicContact CG2-CE1 4.21Å; V413-F424 HydrophobicContact CG2-CZ 4.27Å
414	D	95.5	Very high	95.5	Very high	74 Å²	74	45.3 Å²	45.3	40%	0.396	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	52	34.2	-178	-163.4	47.1	0	0	0	114.9	R55 M95 L113 F416	R55-D414 PolarHBondContact NH1-O 2.87Å; R55-D414 IonicContact NH1-OD2 3.26Å; R55-D414 PolarHBondContact NH1-OD2 3.39Å; M95-D414 HydrophobicContact CE-CB 4.05Å; L113-D414 HydrophobicContact CD2-CB 3.7Å; D414-F416 VanDerWaalsContact C-N 3.27Å; D414-F416 HydrophobicContact CB-CD2 4.17Å; D414-F416 HydrophobicContact CB-CE2 4.46Å; D414-F416 WeakPolarHBondContact O-CD2 3.43Å; D414-F416 PolarHBondContact O-N 3.38Å
415	G	94.8	Very high	95.6	Very high	12 Å²	12	45.6 Å²	45.6	12%	0.124	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.9	6	-177.7	0	0	0	0	0	115	R55 E412 V413	R55-G415 PolarHBondContact N-O 2.97Å; E412-G415 WeakPolarHBondContact OE1-CA 3.4Å; V413-G415 PolarHBondContact O-N 3.41Å
416	F	96.5	Very high	95.6	Very high	5 Å²	5	45.5 Å²	45.5	2%	0.022	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	134.4	172.3	-61.3	-81.5	0	0	0	110.9	R55 S56 L57 E59 I60 M95 E412 V413 D414 F418	R55-F416 HydrophobicContact CB-CD1 3.53Å; R55-F416 HydrophobicContact CB-CE1 3.42Å; R55-F416 VanDerWaalsContact CB-CE1 3.42Å; R55-F416 HydrophobicContact CB-CG 4.2Å; R55-F416 HydrophobicContact CB-CZ 4.03Å; R55-F416 HydrophobicContact CG-CE1 4.49Å; R55-F416 VanDerWaalsContact CZ-CE2 3.44Å; R55-F416 VanDerWaalsContact NH1-CE2 3.25Å; S56-F416 WeakPolarHBondContact O-CE1 3.48Å; L57-F416 HydrophobicContact CD2-CB 3.93Å; L57-F416 HydrophobicContact CD2-CD1 4.24Å; L57-F416 HydrophobicContact CD2-CG 4.43Å; E59-F416 HydrophobicContact CB-CE1 4.15Å; I60-F416 HydrophobicContact CD1-CD1 3.96Å; I60-F416 HydrophobicContact CD1-CD2 4.26Å; I60-F416 HydrophobicContact CD1-CE1 4.11Å; I60-F416 HydrophobicContact CD1-CE2 4.38Å; I60-F416 HydrophobicContact CD1-CG 4.03Å; I60-F416 HydrophobicContact CD1-CZ 4.29Å; I60-F416 HydrophobicContact CG1-CD1 4.07Å; I60-F416 HydrophobicContact CG1-CD2 4.49Å; I60-F416 HydrophobicContact CG1-CE1 3.68Å; I60-F416 HydrophobicContact CG1-CE2 4.13Å; I60-F416 HydrophobicContact CG1-CG 4.44Å; I60-F416 HydrophobicContact CG1-CZ 3.68Å; M95-F416 HydrophobicContact SD-CD2 4.22Å; M95-F416 HydrophobicContact SD-CE2 4.36Å; E412-F416 CarbonylContact C-O 3.58Å; E412-F416 VanDerWaalsContact CA-O 3.3Å; E412-F416 WeakPolarHBondContact CA-O 3.21Å; V413-F416 PolarHBondContact N-O 2.91Å; V413-F416 WeakPolarHBondContact O-CB 3.47Å; V413-F416 WeakPolarHBondContact O-CD2 3.38Å; V413-F416 PolarHBondContact O-N 3.29Å; D414-F416 VanDerWaalsContact C-N 3.27Å; D414-F416 HydrophobicContact CB-CD2 4.17Å; D414-F416 HydrophobicContact CB-CE2 4.46Å; D414-F416 WeakPolarHBondContact O-CD2 3.43Å; D414-F416 PolarHBondContact O-N 3.38Å; F416-F418 HydrophobicContact CB-CD2 4.23Å; F416-F418 HydrophobicContact CB-CE2 3.57Å; F416-F418 HydrophobicContact CB-CZ 3.99Å
417	L	96.7	Very high	95.7	Very high	51 Å²	51	44.2 Å²	44.2	27%	0.267	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	116.6	173.9	-166.8	66.6	0	0	0	109.9	E410	E410-L417 HydrophobicContact CG-CD1 3.56Å; E410-L417 HydrophobicContact CG-CD2 4.3Å; E410-L417 HydrophobicContact CG-CG 3.75Å
418	F	96.3	Very high	95.9	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	131.6	178.7	-69.6	-85.1	0	0	0	110.8	L57 I60 M95 V106 E410 I411 V413 F416 T422 F424	L57-F418 HydrophobicContact CD1-CD1 4.45Å; L57-F418 HydrophobicContact CD2-CD1 3.76Å; L57-F418 HydrophobicContact CD2-CE1 3.48Å; L57-F418 VanDerWaalsContact CD2-CE1 3.48Å; L57-F418 HydrophobicContact CD2-CE2 4.37Å; L57-F418 HydrophobicContact CD2-CG 4.32Å; L57-F418 HydrophobicContact CD2-CZ 3.83Å; I60-F418 HydrophobicContact CD1-CE1 3.94Å; I60-F418 HydrophobicContact CD1-CZ 3.61Å; M95-F418 HydrophobicContact SD-CE2 4.47Å; M95-F418 HydrophobicContact SD-CZ 3.9Å; V106-F418 HydrophobicContact CB-CE1 4.32Å; V106-F418 HydrophobicContact CG1-CE1 3.9Å; V106-F418 HydrophobicContact CG1-CZ 3.92Å; V106-F418 HydrophobicContact CG2-CD1 3.87Å; V106-F418 HydrophobicContact CG2-CE1 3.49Å; V106-F418 VanDerWaalsContact CG2-CE1 3.49Å; V106-F418 HydrophobicContact CG2-CZ 4.35Å; E410-F418 WeakPolarHBondContact CA-O 3.3Å; E410-F418 WeakPolarHBondContact CG-O 3.46Å; I411-F418 HydrophobicContact CG1-CB 4.43Å; I411-F418 PolarHBondContact N-O 3.02Å; I411-F418 VanDerWaalsContact N-O 3.13Å; I411-F418 PolarHBondContact O-N 3.45Å; V413-F418 HydrophobicContact CB-CD2 4.13Å; V413-F418 HydrophobicContact CB-CE2 3.88Å; V413-F418 HydrophobicContact CG2-CD2 4.15Å; V413-F418 HydrophobicContact CG2-CE2 4.34Å; F416-F418 HydrophobicContact CB-CD2 4.23Å; F416-F418 HydrophobicContact CB-CE2 3.57Å; F416-F418 HydrophobicContact CB-CZ 3.99Å; F418-T422 HydrophobicContact CB-CG2 4.39Å; F418-T422 HydrophobicContact CD1-CG2 4.04Å; F418-F424 HydrophobicContact CB-CE2 4.48Å; F418-F424 HydrophobicContact CB-CZ 3.74Å; F418-F424 HydrophobicContact CD1-CE1 4.21Å; F418-F424 HydrophobicContact CD1-CZ 4.02Å; F418-F424 AromaticContact CD2-CE1 3.93Å; F418-F424 HydrophobicContact CD2-CE1 3.93Å; F418-F424 AromaticContact CD2-CZ 3.72Å; F418-F424 HydrophobicContact CD2-CZ 3.72Å; F418-F424 HydrophobicContact CE1-CE1 4.33Å; F418-F424 HydrophobicContact CE2-CE1 4.05Å; F418-F424 HydrophobicContact CE2-CZ 4.32Å; F418-F424 HydrophobicContact CG-CE1 4Å; F418-F424 AromaticContact CG-CZ 3.55Å; F418-F424 HydrophobicContact CG-CZ 3.55Å; F418-F424 HydrophobicContact CZ-CE1 4.24Å
419	P	95.1	Very high	96.1	Very high	66 Å²	66	40 Å²	40	43%	0.429	20%	0.2	S	C	.	.	P	Polyproline II helix	trans	-66.7	161	179.6	29.9	-35.5	0	0	0	111.4	T422	P419-T422 WeakPolarHBondContact O-CB 3.31Å; P419-T422 PolarHBondContact O-N 3.44Å; P419-T422 PolarHBondContact O-OG1 2.9Å
420	K	94.9	Very high	96.3	Very high	145 Å²	145	35.4 Å²	35.4	63%	0.63	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.6	150.3	170.1	70.7	178.7	-175.7	179.2	0	111.4	T422	K420-T422 PolarHBondContact O-N 3.04Å
421	N	93.1	Very high	96.3	Very high	100 Å²	100	29.7 Å²	29.7	54%	0.535	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.9	20.2	-178.4	-54.4	-27.2	0	0	0	114.3	I406 I407 Q423	I406-N421 HydrophobicContact CG2-CB 4.45Å; I407-N421 WeakPolarHBondContact O-CA 3.44Å; I407-N421 PolarHBondContact O-N 3.22Å; N421-Q423 PolarHBondContact O-N 2.71Å
422	T	95.2	Very high	96.3	Very high	6 Å²	6	29.7 Å²	29.7	4%	0.037	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	128.8	168	-63.5	0	0	0	0	109.7	M104 V106 I407 F418 P419 K420 F424	M104-T422 HydrophobicContact CE-CG2 3.91Å; V106-T422 HydrophobicContact CB-CG2 4.43Å; V106-T422 HydrophobicContact CG2-CG2 3.54Å; I407-T422 PolarHBondContact N-O 3.33Å; I407-T422 VanDerWaalsContact N-O 3.11Å; F418-T422 HydrophobicContact CB-CG2 4.39Å; F418-T422 HydrophobicContact CD1-CG2 4.04Å; P419-T422 WeakPolarHBondContact O-CB 3.31Å; P419-T422 PolarHBondContact O-N 3.44Å; P419-T422 PolarHBondContact O-OG1 2.9Å; K420-T422 PolarHBondContact O-N 3.04Å; T422-F424 HydrophobicContact CG2-CD2 3.99Å; T422-F424 HydrophobicContact CG2-CE1 4.25Å; T422-F424 HydrophobicContact CG2-CE2 3.53Å; T422-F424 HydrophobicContact CG2-CZ 3.69Å
423	Q	96.5	Very high	96.3	Very high	12 Å²	12	26.4 Å²	26.4	6%	0.056	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	114.2	172.7	-179.1	166.3	-44.6	0	0	110.4	H105 V106 R405 I406 N421	H105-Q423 WeakPolarHBondContact CA-O 3.25Å; H105-Q423 PolarHBondContact NE2-NE2 3.35Å; V106-Q423 PolarHBondContact N-O 2.89Å; R405-Q423 CarbonylContact O-C 3.54Å; R405-Q423 WeakPolarHBondContact O-CA 3.45Å; I406-Q423 HydrophobicContact CG1-CB 4.07Å; I406-Q423 HydrophobicContact CG1-CG 4.16Å; N421-Q423 PolarHBondContact O-N 2.71Å
424	F	97.8	Very high	96.2	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	127.3	173.5	-65.3	-91.3	0	0	0	109.9	V106 L108 V117 S404 R405 I407 I411 V413 F418 T422 F426	V106-F424 HydrophobicContact CB-CD1 3.65Å; V106-F424 HydrophobicContact CB-CE1 3.9Å; V106-F424 HydrophobicContact CB-CG 4.42Å; V106-F424 HydrophobicContact CG1-CD1 3.8Å; V106-F424 HydrophobicContact CG1-CE1 3.85Å; V106-F424 HydrophobicContact CG2-CD1 4.37Å; V106-F424 HydrophobicContact CG2-CE1 4.21Å; V106-F424 CarbonylContact O-C 3.6Å; V106-F424 VanDerWaalsContact O-CA 3.3Å; V106-F424 WeakPolarHBondContact O-CA 3.26Å; L108-F424 HydrophobicContact CD1-CB 4.29Å; L108-F424 HydrophobicContact CD1-CD1 3.96Å; L108-F424 HydrophobicContact CD2-CD1 4.28Å; L108-F424 HydrophobicContact CG-CD1 4.28Å; V117-F424 HydrophobicContact CG1-CB 3.99Å; V117-F424 HydrophobicContact CG1-CD2 3.96Å; V117-F424 HydrophobicContact CG1-CG 3.93Å; V117-F424 HydrophobicContact CG2-CB 4.5Å; V117-F424 HydrophobicContact CG2-CD1 3.8Å; V117-F424 HydrophobicContact CG2-CD2 4.42Å; V117-F424 HydrophobicContact CG2-CE1 4.05Å; V117-F424 HydrophobicContact CG2-CG 3.98Å; V117-F424 HydrophobicContact CG2-CZ 4.45Å; S404-F424 CarbonylContact C-O 3.58Å; S404-F424 WeakPolarHBondContact CA-O 3.23Å; S404-F424 WeakPolarHBondContact CB-O 3.38Å; R405-F424 PolarHBondContact N-O 2.73Å; R405-F424 PolarHBondContact O-N 2.86Å; I407-F424 HydrophobicContact CB-CE2 4.31Å; I407-F424 HydrophobicContact CG1-CD2 3.71Å; I407-F424 HydrophobicContact CG1-CE2 3.86Å; I411-F424 HydrophobicContact CD1-CE2 3.69Å; I411-F424 HydrophobicContact CD1-CZ 3.79Å; I411-F424 HydrophobicContact CG1-CE2 4.16Å; I411-F424 HydrophobicContact CG1-CZ 4.12Å; V413-F424 HydrophobicContact CG2-CE1 4.21Å; V413-F424 HydrophobicContact CG2-CZ 4.27Å; F418-F424 HydrophobicContact CB-CE2 4.48Å; F418-F424 HydrophobicContact CB-CZ 3.74Å; F418-F424 HydrophobicContact CD1-CE1 4.21Å; F418-F424 HydrophobicContact CD1-CZ 4.02Å; F418-F424 AromaticContact CD2-CE1 3.93Å; F418-F424 HydrophobicContact CD2-CE1 3.93Å; F418-F424 AromaticContact CD2-CZ 3.72Å; F418-F424 HydrophobicContact CD2-CZ 3.72Å; F418-F424 HydrophobicContact CE1-CE1 4.33Å; F418-F424 HydrophobicContact CE2-CE1 4.05Å; F418-F424 HydrophobicContact CE2-CZ 4.32Å; F418-F424 HydrophobicContact CG-CE1 4Å; F418-F424 AromaticContact CG-CZ 3.55Å; F418-F424 HydrophobicContact CG-CZ 3.55Å; F418-F424 HydrophobicContact CZ-CE1 4.24Å; T422-F424 HydrophobicContact CG2-CD2 3.99Å; T422-F424 HydrophobicContact CG2-CE1 4.25Å; T422-F424 HydrophobicContact CG2-CE2 3.53Å; T422-F424 HydrophobicContact CG2-CZ 3.69Å; F424-F426 HydrophobicContact CB-CE1 3.81Å; F424-F426 HydrophobicContact CB-CZ 4.43Å
425	V	97.4	Very high	96.2	Very high	14 Å²	14	27.8 Å²	27.8	9%	0.085	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	123.1	179.8	177.3	0	0	0	0	108.4	H105 V106 N107 L108 T402	H105-V425 HydrophobicContact CB-CG2 3.85Å; V106-V425 PolarHBondContact O-N 2.81Å; N107-V425 CarbonylContact C-O 3.57Å; N107-V425 WeakPolarHBondContact CA-O 3.22Å; L108-V425 PolarHBondContact N-O 3.38Å; T402-V425 HydrophobicContact CG2-CG1 3.24Å
426	F	97.5	Very high	96	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	114.6	-178.1	-51.4	-34.6	0	0	0	110	L108 L114 V117 M118 T402 N403 R405 F424 H428	L108-F426 HydrophobicContact CB-CD1 4.43Å; L108-F426 HydrophobicContact CD1-CD1 3.95Å; L108-F426 HydrophobicContact CD1-CE1 3.82Å; L108-F426 HydrophobicContact CG-CD1 4.47Å; L114-F426 HydrophobicContact CD1-CB 4.31Å; L114-F426 HydrophobicContact CD1-CD1 4.25Å; L114-F426 HydrophobicContact CD2-CB 4.07Å; L114-F426 HydrophobicContact CG-CB 3.99Å; L114-F426 HydrophobicContact CG-CD1 3.97Å; L114-F426 HydrophobicContact CG-CG 4.03Å; V117-F426 HydrophobicContact CB-CE1 4.04Å; V117-F426 HydrophobicContact CB-CZ 4.2Å; V117-F426 HydrophobicContact CG1-CE1 3.84Å; V117-F426 HydrophobicContact CG1-CZ 3.72Å; M118-F426 HydrophobicContact CE-CD2 3.18Å; M118-F426 HydrophobicContact CE-CE2 3.3Å; M118-F426 HydrophobicContact CE-CG 4.03Å; M118-F426 HydrophobicContact CE-CZ 4.19Å; M118-F426 HydrophobicContact CG-CE2 3.81Å; M118-F426 HydrophobicContact CG-CZ 3.94Å; M118-F426 HydrophobicContact SD-CE2 4.39Å; T402-F426 WeakPolarHBondContact CA-O 3.47Å; N403-F426 PolarHBondContact N-O 2.93Å; N403-F426 PolarHBondContact O-N 2.84Å; N403-F426 WeakPolarHBondContact OD1-CB 3.48Å; N403-F426 WeakPolarHBondContact OD1-CD2 3.31Å; R405-F426 HydrophobicContact CB-CE2 4.21Å; R405-F426 HydrophobicContact CB-CZ 3.91Å; R405-F426 HydrophobicContact CG-CE2 3.53Å; R405-F426 HydrophobicContact CG-CZ 3.65Å; F424-F426 HydrophobicContact CB-CE1 3.81Å; F424-F426 HydrophobicContact CB-CZ 4.43Å; F426-H428 VanDerWaalsContact C-N 3.32Å; F426-H428 PolarHBondContact O-N 3.37Å; F426-H428 VanDerWaalsContact O-N 3.08Å
427	C	97.6	Very high	95.9	Very high	2 Å²	2	31.5 Å²	31.5	1%	0.014	17%	0.171	C	C	.	.			trans	-84.8	70.2	-178.1	-59.7	0	0	0	0	110.9	Q85 L108 A109 Y429 V430 V431	Q85-C427 HydrophobicContact CB-CB 4.25Å; Q85-C427 HydrophobicContact CG-CB 4.05Å; Q85-C427 VanDerWaalsContact OE1-CA 3.29Å; Q85-C427 VanDerWaalsContact OE1-CB 3.27Å; Q85-C427 PolarHBondContact OE1-O 3.11Å; L108-C427 VanDerWaalsContact O-CB 3.31Å; L108-C427 WeakPolarHBondContact O-CB 3.31Å; L108-C427 PolarHBondContact O-N 2.92Å; A109-C427 HydrophobicContact CB-CB 4.16Å; C427-Y429 VanDerWaalsContact C-N 3.29Å; C427-Y429 PolarHBondContact O-N 2.94Å; C427-V430 HydrophobicContact CB-CG1 3.7Å; C427-V430 WeakPolarHBondContact O-CG1 3.17Å; C427-V430 PolarHBondContact O-N 2.85Å; C427-V431 VanDerWaalsContact O-CG2 3.29Å; C427-V431 WeakPolarHBondContact O-CG2 3.43Å; C427-V431 PolarHBondContact O-N 2.83Å
428	H	97	Very high	95.7	Very high	10 Å²	10	29.1 Å²	29.1	5%	0.046	16%	0.159	C	C	.	.	H	α-helix	trans	-56.9	-39.3	-174	-69.7	-57.6	0	0	0	113.5	P398 P401 N403 F426 V430 V431 S432	P398-H428 HydrophobicContact CB-CB 4.46Å; P401-H428 PolarHBondContact O-N 2.86Å; P401-H428 VanDerWaalsContact O-N 3.09Å; N403-H428 PolarHBondContact ND2-NE2 3.31Å; N403-H428 VanDerWaalsContact ND2-NE2 3.2Å; N403-H428 PolarHBondContact OD1-NE2 3.39Å; F426-H428 VanDerWaalsContact C-N 3.32Å; F426-H428 PolarHBondContact O-N 3.37Å; F426-H428 VanDerWaalsContact O-N 3.08Å; H428-V430 VanDerWaalsContact C-N 3.31Å; H428-V430 PolarHBondContact O-N 3.46Å; H428-V431 PolarHBondContact O-N 3Å; H428-S432 WeakPolarHBondContact O-CB 3.41Å; H428-S432 PolarHBondContact O-N 2.58Å; H428-S432 PolarHBondContact O-OG 2.67Å
429	Y	96.9	Very high	95.5	Very high	25 Å²	25	31 Å²	31	10%	0.098	17%	0.172	C	C	.	.	H	α-helix	trans	-59.3	-40.2	-177.9	-178.3	-94.3	0	0	0	113.2	H82 V86 P398 P401 C427 S432 R433 L516	H82-Y429 HydrophobicContact CB-CD1 4.06Å; H82-Y429 HydrophobicContact CB-CD2 4.06Å; H82-Y429 HydrophobicContact CB-CE2 4.49Å; H82-Y429 HydrophobicContact CB-CG 3.82Å; H82-Y429 AromaticContact CD2-CE1 3.9Å; H82-Y429 AromaticContact CD2-CE2 3.72Å; H82-Y429 AromaticContact CD2-CZ 3.6Å; H82-Y429 WeakPolarHBondContact O-CD1 3.25Å; V86-Y429 HydrophobicContact CG2-CD1 4.04Å; V86-Y429 HydrophobicContact CG2-CE1 3.83Å; P398-Y429 HydrophobicContact CG-CD2 4.39Å; P401-Y429 PolarHBondContact O-N 2.84Å; C427-Y429 VanDerWaalsContact C-N 3.29Å; C427-Y429 PolarHBondContact O-N 2.94Å; Y429-S432 PolarHBondContact O-OG 3.44Å; Y429-R433 VanDerWaalsContact CD2-NH1 3.32Å; Y429-R433 WeakPolarHBondContact O-CD 3.33Å; Y429-R433 PolarHBondContact O-NH1 3.38Å; Y429-L516 HydrophobicContact CD2-CD1 3.68Å; Y429-L516 HydrophobicContact CE2-CD1 4.04Å
430	V	96.8	Very high	95.4	Very high	10 Å²	10	34 Å²	34	6%	0.061	18%	0.18	C	C	.	.	H	α-helix	trans	-87.7	-26.8	179.9	76.8	0	0	0	0	112.7	Q85 V86 K89 A109 C427 H428 R433 D434	Q85-V430 HydrophobicContact CB-CB 4.21Å; Q85-V430 HydrophobicContact CB-CG1 4.15Å; V86-V430 HydrophobicContact CG2-CG2 4.32Å; K89-V430 HydrophobicContact CB-CG1 4.49Å; K89-V430 HydrophobicContact CB-CG2 4.12Å; K89-V430 HydrophobicContact CD-CB 4.29Å; K89-V430 HydrophobicContact CD-CG1 3.97Å; K89-V430 HydrophobicContact CD-CG2 3.32Å; K89-V430 HydrophobicContact CG-CG2 4.35Å; A109-V430 HydrophobicContact CB-CG1 3.64Å; C427-V430 HydrophobicContact CB-CG1 3.7Å; C427-V430 WeakPolarHBondContact O-CG1 3.17Å; C427-V430 PolarHBondContact O-N 2.85Å; H428-V430 VanDerWaalsContact C-N 3.31Å; H428-V430 PolarHBondContact O-N 3.46Å; V430-R433 CarbonylContact O-C 3.56Å; V430-R433 PolarHBondContact O-N 3.34Å; V430-D434 PolarHBondContact O-N 2.82Å
431	V	97.4	Very high	95.5	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.006	16%	0.157	C	C	.	.	H	α-helix	trans	-66.2	-41.7	172.1	171.5	0	0	0	0	110.4	A109 A111 L114 C427 H428 R433 D434	A109-V431 VanDerWaalsContact C-CG2 3.43Å; A111-V431 HydrophobicContact CB-CG1 4.09Å; L114-V431 HydrophobicContact CD1-CG2 4.02Å; L114-V431 HydrophobicContact CD2-CG1 4.29Å; L114-V431 HydrophobicContact CD2-CG2 4.11Å; C427-V431 VanDerWaalsContact O-CG2 3.29Å; C427-V431 WeakPolarHBondContact O-CG2 3.43Å; C427-V431 PolarHBondContact O-N 2.83Å; H428-V431 PolarHBondContact O-N 3Å; V431-R433 PolarHBondContact O-N 3.2Å; V431-R433 VanDerWaalsContact O-N 3.15Å; V431-D434 WeakPolarHBondContact O-CB 3.47Å; V431-D434 PolarHBondContact O-N 3.07Å; V431-D434 VanDerWaalsContact O-N 3.16Å
432	S	96.4	Very high	95.6	Very high	4 Å²	4	29.1 Å²	29.1	3%	0.028	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-8.6	179.2	75	0	0	0	0	114.1	R395 H428 Y429 F438 G465	R395-S432 WeakPolarHBondContact CG-O 3.32Å; R395-S432 PolarHBondContact NH1-O 3.22Å; R395-S432 WeakPolarHBondContact O-CB 3.35Å; R395-S432 PolarHBondContact O-OG 3.23Å; H428-S432 WeakPolarHBondContact O-CB 3.41Å; H428-S432 PolarHBondContact O-N 2.58Å; H428-S432 PolarHBondContact O-OG 2.67Å; Y429-S432 PolarHBondContact O-OG 3.44Å; S432-F438 WeakPolarHBondContact O-CD2 3.41Å; S432-G465 VanDerWaalsContact CA-O 3.3Å; S432-G465 WeakPolarHBondContact CA-O 3.38Å
433	R	96.2	Very high	95.6	Very high	18 Å²	18	31.1 Å²	31.1	7%	0.068	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.5	14.3	176.3	-72.3	171.2	166.6	72.8	2.9	113.3	L396 Y429 V430 V431 P435 P441 E442	L396-R433 PolarHBondContact O-NH1 3.06Å; L396-R433 PolarHBondContact O-NH2 2.98Å; Y429-R433 VanDerWaalsContact CD2-NH1 3.32Å; Y429-R433 WeakPolarHBondContact O-CD 3.33Å; Y429-R433 PolarHBondContact O-NH1 3.38Å; V430-R433 CarbonylContact O-C 3.56Å; V430-R433 PolarHBondContact O-N 3.34Å; V431-R433 PolarHBondContact O-N 3.2Å; V431-R433 VanDerWaalsContact O-N 3.15Å; R433-P435 VanDerWaalsContact O-CD 3.31Å; R433-P435 WeakPolarHBondContact O-CD 3.35Å; R433-P441 HydrophobicContact CB-CB 4.38Å; R433-P441 VanDerWaalsContact O-CB 3.26Å; R433-P441 WeakPolarHBondContact O-CB 3.24Å; R433-P441 WeakPolarHBondContact O-CG 3.3Å; R433-E442 WeakPolarHBondContact CD-OE1 3.42Å; R433-E442 IonicContact CZ-OE2 2.93Å; R433-E442 IonicContact NE-OE1 2.58Å; R433-E442 IonicContact NE-OE2 3.65Å; R433-E442 PolarHBondContact NE-OE2 2.89Å
434	D	95.4	Very high	95.6	Very high	13 Å²	13	31.5 Å²	31.5	7%	0.07	17%	0.174	C	C	.	.			trans	-72.5	118.3	-179.3	-162	-40.4	0	0	0	110.5	K89 V430 V431 T436 T437 F438	K89-D434 IonicContact NZ-OD2 3.96Å; K89-D434 PolarHBondContact NZ-OD2 3.3Å; V430-D434 PolarHBondContact O-N 2.82Å; V431-D434 WeakPolarHBondContact O-CB 3.47Å; V431-D434 PolarHBondContact O-N 3.07Å; V431-D434 VanDerWaalsContact O-N 3.16Å; D434-T436 PolarHBondContact O-N 2.9Å; D434-T436 WeakPolarHBondContact OD1-CB 3.36Å; D434-T436 WeakPolarHBondContact OD1-CG2 3.48Å; D434-T436 PolarHBondContact OD1-N 3.11Å; D434-T436 PolarHBondContact OD1-OG1 3.47Å; D434-T437 PolarHBondContact O-N 2.91Å; D434-F438 PolarHBondContact O-N 3.42Å
435	P	93.9	Very high	95.5	Very high	90 Å²	90	34.4 Å²	34.4	58%	0.584	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-20.1	179.1	27	-35.3	0	0	0	113	R433 T437 F438 P441	R433-P435 VanDerWaalsContact O-CD 3.31Å; R433-P435 WeakPolarHBondContact O-CD 3.35Å; P435-T437 PolarHBondContact O-N 3.38Å; P435-F438 WeakPolarHBondContact CA-O 3.42Å; P435-P441 HydrophobicContact CB-CG 4.21Å
436	T	92	Very high	95.4	Very high	88 Å²	88	33.8 Å²	33.8	54%	0.54	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-20	172.2	67.6	0	0	0	0	112.2	D434 Q461	D434-T436 PolarHBondContact O-N 2.9Å; D434-T436 WeakPolarHBondContact OD1-CB 3.36Å; D434-T436 WeakPolarHBondContact OD1-CG2 3.48Å; D434-T436 PolarHBondContact OD1-N 3.11Å; D434-T436 PolarHBondContact OD1-OG1 3.47Å; T436-Q461 PolarHBondContact O-NE2 3Å; T436-Q461 PolarHBondContact O-OE1 3.2Å
437	T	92.9	Very high	95.2	Very high	6 Å²	6	37.7 Å²	37.7	4%	0.037	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.4	-34.7	179.4	-53.9	0	0	0	0	112.6	D434 P435 I460 Q461 H462	D434-T437 PolarHBondContact O-N 2.91Å; P435-T437 PolarHBondContact O-N 3.38Å; T437-I460 HydrophobicContact CG2-CG2 4.4Å; T437-Q461 PolarHBondContact O-N 3.06Å; T437-H462 HydrophobicContact CG2-CB 3.91Å
438	F	94.1	Very high	94.9	Very high	2 Å²	2	38.2 Å²	38.2	1%	0.009	20%	0.203	C	C	.	.	S	Bend	trans	-130.2	119.8	-177.2	-55.9	-80.4	0	0	0	110.4	R395 S432 D434 P435 P441 W449 I460 G465	R395-F438 VanDerWaalsContact CD-CD1 3.48Å; R395-F438 HydrophobicContact CG-CE1 4.25Å; R395-F438 HydrophobicContact CG-CE2 4.31Å; R395-F438 HydrophobicContact CG-CZ 4.07Å; S432-F438 WeakPolarHBondContact O-CD2 3.41Å; D434-F438 PolarHBondContact O-N 3.42Å; P435-F438 WeakPolarHBondContact CA-O 3.42Å; F438-P441 HydrophobicContact CB-CB 4.31Å; F438-P441 WeakPolarHBondContact O-CD 3.49Å; F438-W449 HydrophobicContact CE1-CH2 4.15Å; F438-W449 HydrophobicContact CE1-CZ2 4.15Å; F438-I460 HydrophobicContact CD1-CG1 4.45Å; F438-I460 HydrophobicContact CE1-CG1 4.08Å; F438-I460 HydrophobicContact CE1-CG2 3.87Å; F438-I460 HydrophobicContact CZ-CG2 4.29Å; F438-G465 WeakPolarHBondContact CE2-O 3.48Å
439	S	91.2	Very high	94.7	Very high	40 Å²	40	40.1 Å²	40.1	28%	0.28	21%	0.21	S	C	.	.	S	Bend	trans	-64	144.3	168.1	63.6	0	0	0	0	110.8	R448 P458	S439-R448 PolarHBondContact O-NH1 3.21Å; S439-R448 PolarHBondContact O-NH2 3.31Å; S439-R448 PolarHBondContact OG-NH1 2.93Å; S439-P458 VanDerWaalsContact CB-CG 3.42Å; S439-P458 WeakPolarHBondContact OG-CG 3.39Å
440	E	93.8	Very high	94.5	Very high	127 Å²	127	40.5 Å²	40.5	59%	0.593	21%	0.214	S	C	*	.	S	Bend	trans	44.7	59.8	-176.7	-61.1	-57.6	116.4	0	0	111.2	E442 S443	E440-E442 PolarHBondContact O-N 2.95Å; E440-E442 VanDerWaalsContact O-N 3.1Å; E440-S443 WeakPolarHBondContact O-CB 3.47Å; E440-S443 PolarHBondContact O-N 3.04Å
441	P	95.4	Very high	93.5	Very high	22 Å²	22	51.7 Å²	51.7	14%	0.143	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-21	-164.5	24	-33.8	0	0	0	113.9	R395 L396 R433 P435 F438	R395-P441 VanDerWaalsContact CZ-O 3.31Å; R395-P441 PolarHBondContact NH1-O 3.18Å; R395-P441 PolarHBondContact NH2-O 2.96Å; L396-P441 WeakPolarHBondContact CD2-O 3.41Å; R433-P441 HydrophobicContact CB-CB 4.38Å; R433-P441 VanDerWaalsContact O-CB 3.26Å; R433-P441 WeakPolarHBondContact O-CB 3.24Å; R433-P441 WeakPolarHBondContact O-CG 3.3Å; P435-P441 HydrophobicContact CB-CG 4.21Å; F438-P441 HydrophobicContact CB-CB 4.31Å; F438-P441 WeakPolarHBondContact O-CD 3.49Å
442	E	95.6	Very high	91.9	Very high	121 Å²	121	57 Å²	57	57%	0.565	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-11.9	177.1	-58.5	-57.7	154.6	0	0	113	R433 E440	R433-E442 WeakPolarHBondContact CD-OE1 3.42Å; R433-E442 IonicContact CZ-OE2 2.93Å; R433-E442 IonicContact NE-OE1 2.58Å; R433-E442 IonicContact NE-OE2 3.65Å; R433-E442 PolarHBondContact NE-OE2 2.89Å; E440-E442 PolarHBondContact O-N 2.95Å; E440-E442 VanDerWaalsContact O-N 3.1Å
443	S	95.4	Very high	90.1	Very high	49 Å²	49	58 Å²	58	34%	0.343	30%	0.299	S	S	.	.	S	Bend	trans	-85.4	140.3	179.9	-57.9	0	0	0	0	111.7	R395 E440 Q445	R395-S443 PolarHBondContact NH2-O 3.44Å; E440-S443 WeakPolarHBondContact O-CB 3.47Å; E440-S443 PolarHBondContact O-N 3.04Å; S443-Q445 PolarHBondContact O-N 2.9Å
444	F	97	Very high	88.1	Confident	19 Å²	19	63.9 Å²	63.9	8%	0.083	33%	0.327	C	S	.	.			trans	-77.9	103.3	172.9	-175.6	-97.9	0	0	0	109.9	H350 I357 V389 E392 L396 P446	H350-F444 HydrophobicContact CB-CB 4.38Å; H350-F444 HydrophobicContact CB-CD1 3.75Å; H350-F444 HydrophobicContact CB-CD2 3.68Å; H350-F444 HydrophobicContact CB-CE1 3.84Å; H350-F444 HydrophobicContact CB-CE2 3.81Å; H350-F444 HydrophobicContact CB-CG 3.68Å; H350-F444 HydrophobicContact CB-CZ 3.89Å; H350-F444 AromaticContact CD2-CD2 3.83Å; H350-F444 AromaticContact CG-CD2 3.49Å; H350-F444 VanDerWaalsContact CG-CD2 3.49Å; H350-F444 AromaticContact CG-CG 3.6Å; H350-F444 WeakPolarHBondContact ND1-CB 3.49Å; H350-F444 AromaticContact ND1-CD2 3.91Å; H350-F444 AromaticContact ND1-CG 3.66Å; I357-F444 HydrophobicContact CD1-CD1 3.94Å; I357-F444 HydrophobicContact CD1-CE1 4.15Å; V389-F444 HydrophobicContact CG1-CZ 4.19Å; E392-F444 HydrophobicContact CB-CD2 4.35Å; E392-F444 HydrophobicContact CB-CE2 3.99Å; E392-F444 HydrophobicContact CB-CZ 4.45Å; E392-F444 HydrophobicContact CG-CD2 3.69Å; E392-F444 HydrophobicContact CG-CE2 3.85Å; E392-F444 HydrophobicContact CG-CG 4.17Å; E392-F444 HydrophobicContact CG-CZ 4.49Å; L396-F444 HydrophobicContact CD1-CB 3.94Å; L396-F444 HydrophobicContact CD1-CD2 3.91Å; L396-F444 HydrophobicContact CD1-CG 4.44Å; F444-P446 HydrophobicContact CD1-CG 3.94Å; F444-P446 HydrophobicContact CE1-CG 3.33Å; F444-P446 HydrophobicContact CZ-CG 3.7Å
445	Q	95	Very high	86.2	Confident	62 Å²	62	70.2 Å²	70.2	29%	0.29	37%	0.369	S	S	.	.			trans	-130.9	85	-179.4	-57.6	-175.4	27.4	0	0	112	E392 S443 H447 R448	E392-Q445 PolarHBondContact OE1-N 3.35Å; S443-Q445 PolarHBondContact O-N 2.9Å; Q445-H447 VanDerWaalsContact C-N 3.25Å; Q445-H447 PolarHBondContact O-N 3.3Å; Q445-R448 WeakPolarHBondContact O-CG 3.31Å; Q445-R448 PolarHBondContact O-N 3.11Å; Q445-R448 PolarHBondContact O-NE 2.97Å
446	P	95.7	Very high	84.3	Confident	0 Å²	0	70 Å²	70	0%	0	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-55.5	-36.7	176.9	-28.1	37.9	0	0	0	113.7	I357 L385 A388 V389 E392 F444 R448 W449	I357-P446 HydrophobicContact CD1-CG 4.06Å; I357-P446 HydrophobicContact CG2-CG 4.11Å; L385-P446 HydrophobicContact CD1-CB 3.96Å; A388-P446 HydrophobicContact CB-CB 4.07Å; A388-P446 WeakPolarHBondContact CB-O 3.48Å; V389-P446 HydrophobicContact CG2-CB 3.89Å; V389-P446 HydrophobicContact CG2-CG 3.74Å; E392-P446 HydrophobicContact CB-CG 4.32Å; E392-P446 HydrophobicContact CG-CG 4.5Å; F444-P446 HydrophobicContact CD1-CG 3.94Å; F444-P446 HydrophobicContact CE1-CG 3.33Å; F444-P446 HydrophobicContact CZ-CG 3.7Å; P446-R448 PolarHBondContact O-N 3.35Å; P446-W449 WeakPolarHBondContact O-CB 3.39Å; P446-W449 VanDerWaalsContact O-CD1 3.27Å; P446-W449 PolarHBondContact O-N 2.89Å
447	H	93.1	Very high	82.7	Confident	83 Å²	83	67.9 Å²	67.9	38%	0.384	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-54.6	-24.6	-177.4	-65.5	95.9	0	0	0	114.3	Q445 W449 L450 S453	Q445-H447 VanDerWaalsContact C-N 3.25Å; Q445-H447 PolarHBondContact O-N 3.3Å; H447-W449 PolarHBondContact O-N 2.9Å; H447-W449 VanDerWaalsContact O-N 3.11Å; H447-L450 WeakPolarHBondContact O-CB 3.49Å; H447-L450 PolarHBondContact O-N 3.44Å; H447-L450 VanDerWaalsContact O-N 3.08Å; H447-S453 WeakPolarHBondContact O-CB 3.49Å
448	R	92.2	Very high	81	Confident	12 Å²	12	70.5 Å²	70.5	5%	0.045	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-61.6	-18.6	175.5	79.9	-179.3	62	-113.7	14.3	114.1	E392 S439 Q445 P446	E392-R448 IonicContact OE1-CZ 2.61Å; E392-R448 IonicContact OE1-NE 3.12Å; E392-R448 PolarHBondContact OE1-NE 3.36Å; E392-R448 IonicContact OE1-NH2 2.76Å; E392-R448 WeakPolarHBondContact OE2-CD 3.46Å; E392-R448 IonicContact OE2-NE 3.86Å; S439-R448 PolarHBondContact O-NH1 3.21Å; S439-R448 PolarHBondContact O-NH2 3.31Å; S439-R448 PolarHBondContact OG-NH1 2.93Å; Q445-R448 WeakPolarHBondContact O-CG 3.31Å; Q445-R448 PolarHBondContact O-N 3.11Å; Q445-R448 PolarHBondContact O-NE 2.97Å; P446-R448 PolarHBondContact O-N 3.35Å
449	W	93.1	Very high	79.7	Confident	50 Å²	50	79.5 Å²	79.5	19%	0.189	41%	0.413	C	S	.	.	G	3₁₀ helix	trans	-92.6	-6.7	179.6	-58.5	97.5	0	0	0	113.4	A388 K391 E392 R395 F438 P446 H447 I460	A388-W449 HydrophobicContact CB-CB 3.78Å; A388-W449 HydrophobicContact CB-CG 4.47Å; K391-W449 HydrophobicContact CB-CD2 3.68Å; K391-W449 HydrophobicContact CB-CE3 4.06Å; K391-W449 HydrophobicContact CB-CG 3.95Å; K391-W449 HydrophobicContact CB-CZ2 4.33Å; K391-W449 HydrophobicContact CD-CB 4.35Å; K391-W449 HydrophobicContact CD-CD2 3.98Å; K391-W449 HydrophobicContact CD-CE3 3.69Å; K391-W449 HydrophobicContact CD-CG 4.25Å; K391-W449 HydrophobicContact CD-CZ3 4.37Å; K391-W449 HydrophobicContact CG-CD2 4.47Å; K391-W449 HydrophobicContact CG-CE3 4.42Å; E392-W449 PolarHBondContact OE2-NE1 2.91Å; R395-W449 HydrophobicContact CB-CZ2 4.04Å; R395-W449 HydrophobicContact CG-CZ2 4.35Å; F438-W449 HydrophobicContact CE1-CH2 4.15Å; F438-W449 HydrophobicContact CE1-CZ2 4.15Å; P446-W449 WeakPolarHBondContact O-CB 3.39Å; P446-W449 VanDerWaalsContact O-CD1 3.27Å; P446-W449 PolarHBondContact O-N 2.89Å; H447-W449 PolarHBondContact O-N 2.9Å; H447-W449 VanDerWaalsContact O-N 3.11Å; W449-I460 HydrophobicContact CD2-CD1 3.67Å; W449-I460 HydrophobicContact CE3-CD1 3.15Å; W449-I460 HydrophobicContact CE3-CG1 4.5Å; W449-I460 HydrophobicContact CG-CD1 4.47Å; W449-I460 HydrophobicContact CH2-CD1 3.78Å; W449-I460 HydrophobicContact CZ2-CD1 4.25Å; W449-I460 HydrophobicContact CZ3-CD1 3.23Å; W449-I460 HydrophobicContact CZ3-CG1 4.39Å
450	L	91.1	Very high	79.2	Confident	34 Å²	34	80.1 Å²	80.1	18%	0.178	41%	0.413	C	S	.	.			trans	-86	137.5	-179.1	-57.9	179.3	0	0	0	111	P384 L385 A388 H447 S452 S453	P384-L450 HydrophobicContact CB-CD2 3.88Å; L385-L450 HydrophobicContact CD1-CD1 4.42Å; A388-L450 HydrophobicContact CB-CD2 3.97Å; A388-L450 HydrophobicContact CB-CG 4.43Å; H447-L450 WeakPolarHBondContact O-CB 3.49Å; H447-L450 PolarHBondContact O-N 3.44Å; H447-L450 VanDerWaalsContact O-N 3.08Å; L450-S452 VanDerWaalsContact C-N 3.31Å; L450-S452 PolarHBondContact O-N 3.49Å; L450-S453 WeakPolarHBondContact O-CB 3.46Å; L450-S453 PolarHBondContact O-N 2.79Å; L450-S453 PolarHBondContact O-OG 2.89Å
451	R	75.8	Confident	78.5	Confident	245 Å²	245	80.5 Å²	80.5	93%	0.925	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-30.1	-178.8	-70.7	-177.1	177.7	177.6	-0.7	113.3
452	S	63.9	Low	78.4	Confident	111 Å²	111	80.9 Å²	80.9	78%	0.776	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	12.5	-177.4	49.6	0	0	0	0	113.7	L450 Q454	L450-S452 VanDerWaalsContact C-N 3.31Å; L450-S452 PolarHBondContact O-N 3.49Å; S452-Q454 PolarHBondContact O-N 3.29Å
453	S	58.4	Low	78.1	Confident	25 Å²	25	80 Å²	80	18%	0.175	42%	0.419	C	S	.	.			trans	-60.2	135.8	177.3	57.5	0	0	0	0	109.7	H447 L450 T457	H447-S453 WeakPolarHBondContact O-CB 3.49Å; L450-S453 WeakPolarHBondContact O-CB 3.46Å; L450-S453 PolarHBondContact O-N 2.79Å; L450-S453 PolarHBondContact O-OG 2.89Å; S453-T457 WeakPolarHBondContact CB-OG1 3.3Å; S453-T457 PolarHBondContact OG-OG1 3.32Å
454	Q	55.6	Low	78.1	Confident	142 Å²	142	77.9 Å²	77.9	66%	0.664	40%	0.404	S	S	*	.			trans	-48.9	157.8	-169.2	-67.9	-179.5	-0.6	0	0	112.2	S452 A456 T457	S452-Q454 PolarHBondContact O-N 3.29Å; Q454-A456 PolarHBondContact O-N 3.38Å; Q454-T457 PolarHBondContact N-OG1 2.75Å; Q454-T457 PolarHBondContact O-N 2.78Å; Q454-T457 PolarHBondContact O-OG1 2.63Å
455	P	54.8	Low	78	Confident	147 Å²	147	77 Å²	77	96%	0.955	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.2	-24.4	175.9	-24.1	31.8	0	0	0	114.1
456	A	55.3	Low	78.1	Confident	85 Å²	85	75.2 Å²	75.2	70%	0.702	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-14	179.4	0	0	0	0	0	115.3	Q454 P458	Q454-A456 PolarHBondContact O-N 3.38Å; A456-P458 WeakPolarHBondContact O-CD 3.47Å
457	T	57.3	Low	78	Confident	43 Å²	43	76.2 Å²	76.2	26%	0.264	40%	0.4	S	S	.	.	S	Bend	trans	-88.9	115.7	177.3	45.7	0	0	0	0	110.3	S453 Q454 R459	S453-T457 WeakPolarHBondContact CB-OG1 3.3Å; S453-T457 PolarHBondContact OG-OG1 3.32Å; Q454-T457 PolarHBondContact N-OG1 2.75Å; Q454-T457 PolarHBondContact O-N 2.78Å; Q454-T457 PolarHBondContact O-OG1 2.63Å; T457-R459 PolarHBondContact O-N 3.47Å
458	P	56.9	Low	78.1	Confident	61 Å²	61	74.5 Å²	74.5	40%	0.396	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-66.3	123.5	-178	25.1	-32.2	0	0	0	110.2	S439 A456	S439-P458 VanDerWaalsContact CB-CG 3.42Å; S439-P458 WeakPolarHBondContact OG-CG 3.39Å; A456-P458 WeakPolarHBondContact O-CD 3.47Å
459	R	67.3	Low	78.3	Confident	192 Å²	192	75.6 Å²	75.6	73%	0.725	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-63.2	151	174.5	-68.9	-178.2	175.5	179.2	-1.1	110.1	T457 Q461	T457-R459 PolarHBondContact O-N 3.47Å; R459-Q461 PolarHBondContact O-N 3.33Å; R459-Q461 VanDerWaalsContact O-N 3.11Å
460	I	79.9	Confident	78.4	Confident	53 Å²	53	74.2 Å²	74.2	27%	0.272	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-59.8	117	174.5	-60.3	153.1	0	0	0	108.3	T437 F438 W449 H462	T437-I460 HydrophobicContact CG2-CG2 4.4Å; F438-I460 HydrophobicContact CD1-CG1 4.45Å; F438-I460 HydrophobicContact CE1-CG1 4.08Å; F438-I460 HydrophobicContact CE1-CG2 3.87Å; F438-I460 HydrophobicContact CZ-CG2 4.29Å; W449-I460 HydrophobicContact CD2-CD1 3.67Å; W449-I460 HydrophobicContact CE3-CD1 3.15Å; W449-I460 HydrophobicContact CE3-CG1 4.5Å; W449-I460 HydrophobicContact CG-CD1 4.47Å; W449-I460 HydrophobicContact CH2-CD1 3.78Å; W449-I460 HydrophobicContact CZ2-CD1 4.25Å; W449-I460 HydrophobicContact CZ3-CD1 3.23Å; W449-I460 HydrophobicContact CZ3-CG1 4.39Å; I460-H462 VanDerWaalsContact C-N 3.32Å; I460-H462 PolarHBondContact O-N 2.95Å
461	Q	80.5	Confident	78.5	Confident	135 Å²	135	76.2 Å²	76.2	63%	0.631	41%	0.408	S	S	*	.	S	Bend	trans	-75.6	-23.4	-169.7	-56	-167.6	15.4	0	0	112.8	T436 T437 R459	T436-Q461 PolarHBondContact O-NE2 3Å; T436-Q461 PolarHBondContact O-OE1 3.2Å; T437-Q461 PolarHBondContact O-N 3.06Å; R459-Q461 PolarHBondContact O-N 3.33Å; R459-Q461 VanDerWaalsContact O-N 3.11Å
462	H	91.4	Very high	79.3	Confident	30 Å²	30	66.1 Å²	66.1	14%	0.139	38%	0.38	C	S	.	.			trans	-142.9	125.3	-173.5	-156.7	-74.5	0	0	0	112.9	A111 E115 T437 I460 F464 G465	A111-H462 HydrophobicContact CB-CB 3.91Å; A111-H462 WeakPolarHBondContact CB-ND1 3.19Å; A111-H462 PolarHBondContact O-CE1 3.27Å; E115-H462 IonicContact OE2-CE1 3.45Å; E115-H462 PolarHBondContact OE2-CE1 2.61Å; E115-H462 IonicContact OE2-NE2 2.92Å; E115-H462 PolarHBondContact OE2-NE2 3.44Å; E115-H462 VanDerWaalsContact OE2-NE2 3.13Å; T437-H462 HydrophobicContact CG2-CB 3.91Å; I460-H462 VanDerWaalsContact C-N 3.32Å; I460-H462 PolarHBondContact O-N 2.95Å; H462-F464 VanDerWaalsContact C-N 3.29Å; H462-F464 AromaticContact CE1-CD2 3.9Å; H462-F464 PolarHBondContact ND1-N 3.37Å; H462-F464 PolarHBondContact O-N 3.06Å; H462-G465 PolarHBondContact O-N 3.24Å
463	P	91.2	Very high	80.7	Confident	101 Å²	101	64.3 Å²	64.3	66%	0.656	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-59.3	-35.1	-179.5	-25.9	34.7	0	0	0	114.2	G465	P463-G465 PolarHBondContact O-N 2.82Å
464	F	95.1	Very high	82.4	Confident	6 Å²	6	63.3 Å²	63.3	3%	0.026	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-78.7	3.7	175.5	-67.9	-99.8	0	0	0	114.3	A111 E115 M118 H462 S466 V467 Y471	A111-F464 HydrophobicContact CB-CB 4.22Å; E115-F464 HydrophobicContact CB-CB 4.41Å; E115-F464 HydrophobicContact CB-CD1 4.28Å; E115-F464 HydrophobicContact CB-CD2 3.54Å; E115-F464 HydrophobicContact CB-CE1 4.45Å; E115-F464 HydrophobicContact CB-CE2 3.75Å; E115-F464 HydrophobicContact CB-CG 3.83Å; E115-F464 HydrophobicContact CB-CZ 4.21Å; E115-F464 HydrophobicContact CG-CD2 3.73Å; E115-F464 HydrophobicContact CG-CE2 3.47Å; E115-F464 VanDerWaalsContact CG-CE2 3.47Å; E115-F464 HydrophobicContact CG-CG 4.47Å; E115-F464 HydrophobicContact CG-CZ 4.01Å; M118-F464 HydrophobicContact CB-CE1 3.92Å; M118-F464 HydrophobicContact CG-CE1 4.34Å; M118-F464 HydrophobicContact SD-CD1 3.66Å; M118-F464 HydrophobicContact SD-CE1 3.5Å; M118-F464 VanDerWaalsContact SD-CE1 3.5Å; H462-F464 VanDerWaalsContact C-N 3.29Å; H462-F464 AromaticContact CE1-CD2 3.9Å; H462-F464 PolarHBondContact ND1-N 3.37Å; H462-F464 PolarHBondContact O-N 3.06Å; F464-S466 PolarHBondContact O-N 3.22Å; F464-V467 HydrophobicContact CD1-CG1 4.23Å; F464-Y471 HydrophobicContact CE1-CD1 4.12Å; F464-Y471 AromaticContact CE1-CD2 3.67Å; F464-Y471 HydrophobicContact CE1-CD2 3.67Å; F464-Y471 HydrophobicContact CE1-CE1 4.46Å; F464-Y471 HydrophobicContact CE1-CE2 4.04Å; F464-Y471 AromaticContact CE1-CG 3.71Å; F464-Y471 HydrophobicContact CE1-CG 3.71Å; F464-Y471 HydrophobicContact CE2-CE2 4.49Å; F464-Y471 HydrophobicContact CZ-CD1 4.37Å; F464-Y471 AromaticContact CZ-CD2 3.67Å; F464-Y471 HydrophobicContact CZ-CD2 3.67Å; F464-Y471 HydrophobicContact CZ-CE1 4.27Å; F464-Y471 AromaticContact CZ-CE2 3.55Å; F464-Y471 HydrophobicContact CZ-CE2 3.55Å; F464-Y471 HydrophobicContact CZ-CG 4.09Å; F464-Y471 AromaticContact CZ-CZ 3.86Å
465	G	95.1	Very high	84.3	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.01	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-64	-27.8	172.7	0	0	0	0	0	113.2	S432 F438 H462 P463	S432-G465 VanDerWaalsContact CA-O 3.3Å; S432-G465 WeakPolarHBondContact CA-O 3.38Å; F438-G465 WeakPolarHBondContact CE2-O 3.48Å; H462-G465 PolarHBondContact O-N 3.24Å; P463-G465 PolarHBondContact O-N 2.82Å
466	S	95.5	Very high	86.3	Confident	24 Å²	24	52.6 Å²	52.6	17%	0.168	30%	0.302	C	S	.	.			trans	-147	107.1	174.3	-174.9	0	0	0	0	109.8	F464 P468	F464-S466 PolarHBondContact O-N 3.22Å; S466-P468 VanDerWaalsContact C-CD 3.4Å
467	V	95.3	Very high	88.3	Confident	20 Å²	20	49.1 Å²	49.1	12%	0.121	27%	0.271	C	S	.	.			trans	-124.4	63	175.6	-74.4	0	0	0	0	110.2	M118 F464 F469 G470	M118-V467 HydrophobicContact CE-CG2 4.39Å; F464-V467 HydrophobicContact CD1-CG1 4.23Å; V467-F469 PolarHBondContact O-N 3.33Å; V467-G470 WeakPolarHBondContact O-CA 3.28Å; V467-G470 PolarHBondContact O-N 3.36Å
468	P	94.3	Very high	90.1	Very high	48 Å²	48	48.2 Å²	48.2	31%	0.312	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-25.8	-170.1	26.5	-35.7	0	0	0	113.4	L394 S466	L394-P468 HydrophobicContact CB-CB 3.73Å; L394-P468 HydrophobicContact CB-CG 3.81Å; L394-P468 HydrophobicContact CD1-CB 4.25Å; L394-P468 HydrophobicContact CD1-CG 4.02Å; L394-P468 HydrophobicContact CD2-CB 4.21Å; L394-P468 HydrophobicContact CG-CB 4.29Å; L394-P468 HydrophobicContact CG-CG 4.45Å; S466-P468 VanDerWaalsContact C-CD 3.4Å
469	F	96.3	Very high	92	Very high	35 Å²	35	49.9 Å²	49.9	15%	0.154	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95	9.7	173.5	-65.2	-76	0	0	0	113.1	L394 V467 A475 C476 R479 A482 E483 M486	L394-F469 HydrophobicContact CD1-CE2 3.62Å; L394-F469 HydrophobicContact CD1-CZ 3.95Å; V467-F469 PolarHBondContact O-N 3.33Å; F469-A475 CarbonylContact O-C 3.57Å; F469-A475 WeakPolarHBondContact O-CA 3.5Å; F469-A475 WeakPolarHBondContact O-CB 3.37Å; F469-C476 HydrophobicContact CB-CB 3.91Å; F469-C476 HydrophobicContact CD1-CB 3.75Å; F469-C476 HydrophobicContact CG-CB 4.33Å; F469-C476 WeakPolarHBondContact O-CB 3.43Å; F469-C476 PolarHBondContact O-N 2.74Å; F469-R479 HydrophobicContact CB-CB 4.37Å; F469-R479 HydrophobicContact CB-CG 4.12Å; F469-R479 HydrophobicContact CD1-CB 3.9Å; F469-R479 HydrophobicContact CD1-CG 3.88Å; F469-R479 HydrophobicContact CD2-CG 3.93Å; F469-R479 HydrophobicContact CE1-CB 4.38Å; F469-R479 HydrophobicContact CE1-CG 4.24Å; F469-R479 HydrophobicContact CE2-CG 4.29Å; F469-R479 HydrophobicContact CG-CB 4.12Å; F469-R479 HydrophobicContact CG-CG 3.7Å; F469-R479 HydrophobicContact CZ-CG 4.43Å; F469-A482 HydrophobicContact CE1-CB 4.18Å; F469-E483 HydrophobicContact CE2-CG 4.18Å; F469-E483 HydrophobicContact CZ-CG 4.22Å; F469-M486 HydrophobicContact CZ-CE 4.25Å
470	G	94.6	Very high	93.4	Very high	20 Å²	20	44.8 Å²	44.8	21%	0.206	25%	0.25	C	S	.	.			trans	71.9	-170.3	-172.1	0	0	0	0	0	113.5	V467	V467-G470 WeakPolarHBondContact O-CA 3.28Å; V467-G470 PolarHBondContact O-N 3.36Å
471	Y	93.9	Very high	94.2	Very high	76 Å²	76	42.5 Å²	42.5	30%	0.298	24%	0.238	S	C	.	.	S	Bend	trans	-134.9	155.6	-177.3	177.8	-92.2	0	0	0	110.3	M118 R405 F464	M118-Y471 HydrophobicContact CB-CD1 3.79Å; M118-Y471 HydrophobicContact CB-CE1 4.24Å; M118-Y471 HydrophobicContact CB-CG 4.49Å; M118-Y471 HydrophobicContact CG-CD1 4.46Å; M118-Y471 VanDerWaalsContact SD-CB 3.57Å; M118-Y471 HydrophobicContact SD-CD1 4.27Å; M118-Y471 HydrophobicContact SD-CG 4.12Å; R405-Y471 PolarHBondContact NH2-O 3.44Å; F464-Y471 HydrophobicContact CE1-CD1 4.12Å; F464-Y471 AromaticContact CE1-CD2 3.67Å; F464-Y471 HydrophobicContact CE1-CD2 3.67Å; F464-Y471 HydrophobicContact CE1-CE1 4.46Å; F464-Y471 HydrophobicContact CE1-CE2 4.04Å; F464-Y471 AromaticContact CE1-CG 3.71Å; F464-Y471 HydrophobicContact CE1-CG 3.71Å; F464-Y471 HydrophobicContact CE2-CE2 4.49Å; F464-Y471 HydrophobicContact CZ-CD1 4.37Å; F464-Y471 AromaticContact CZ-CD2 3.67Å; F464-Y471 HydrophobicContact CZ-CD2 3.67Å; F464-Y471 HydrophobicContact CZ-CE1 4.27Å; F464-Y471 AromaticContact CZ-CE2 3.55Å; F464-Y471 HydrophobicContact CZ-CE2 3.55Å; F464-Y471 HydrophobicContact CZ-CG 4.09Å; F464-Y471 AromaticContact CZ-CZ 3.86Å
472	G	93.5	Very high	95	Very high	33 Å²	33	36.5 Å²	36.5	34%	0.34	21%	0.212	S	C	.	.	S	Bend	trans	76.2	-166.7	173.5	0	0	0	0	0	114.4	E121 R474 A475	E121-G472 WeakPolarHBondContact OE1-CA 3.3Å; G472-R474 PolarHBondContact O-N 2.85Å; G472-R474 VanDerWaalsContact O-N 3.17Å; G472-A475 WeakPolarHBondContact O-CB 3.33Å; G472-A475 PolarHBondContact O-N 2.83Å
473	V	93.1	Very high	95.3	Very high	73 Å²	73	36.9 Å²	36.9	44%	0.442	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-22.2	-175.4	-64.7	0	0	0	0	113.1	P125 W154	P125-V473 VanDerWaalsContact CD-CG2 3.41Å; P125-V473 HydrophobicContact CG-CG2 3.55Å; W154-V473 HydrophobicContact CH2-CB 4.36Å; W154-V473 HydrophobicContact CH2-CG2 3.96Å; W154-V473 HydrophobicContact CZ3-CG2 4.32Å
474	R	94.6	Very high	95.7	Very high	4 Å²	4	32.3 Å²	32.3	2%	0.015	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.4	21	176.3	-156.6	153.6	-172.4	163.9	-3.3	113.6	P125 R127 T149 E150 W154 G472	P125-R474 HydrophobicContact CB-CB 4.18Å; P125-R474 HydrophobicContact CG-CB 4.38Å; P125-R474 WeakPolarHBondContact O-CD 3.34Å; P125-R474 PolarHBondContact O-NH1 3.42Å; R127-R474 PolarHBondContact NH2-O 2.71Å; T149-R474 PolarHBondContact O-NH2 3.49Å; E150-R474 VanDerWaalsContact CD-NH2 3.31Å; E150-R474 IonicContact OE1-CZ 3.36Å; E150-R474 IonicContact OE1-NH1 3.88Å; E150-R474 IonicContact OE1-NH2 2.63Å; E150-R474 PolarHBondContact OE1-NH2 3.25Å; E150-R474 IonicContact OE2-CZ 2.87Å; E150-R474 IonicContact OE2-NH1 2.99Å; E150-R474 PolarHBondContact OE2-NH1 2.87Å; E150-R474 IonicContact OE2-NH2 2.69Å; E150-R474 PolarHBondContact OE2-NH2 2.99Å; W154-R474 HydrophobicContact CH2-CB 3.87Å; W154-R474 HydrophobicContact CH2-CG 4.11Å; W154-R474 HydrophobicContact CZ2-CB 3.71Å; W154-R474 VanDerWaalsContact CZ2-CD 3.49Å; W154-R474 HydrophobicContact CZ2-CG 3.46Å; W154-R474 VanDerWaalsContact CZ2-CG 3.46Å; G472-R474 PolarHBondContact O-N 2.85Å; G472-R474 VanDerWaalsContact O-N 3.17Å
475	A	95.2	Very high	95.8	Very high	19 Å²	19	32.2 Å²	32.2	16%	0.157	18%	0.184	C	C	.	.	S	Bend	trans	-58.8	166.8	163.5	0	0	0	0	0	111.3	R158 F469 G472 L477	R158-A475 PolarHBondContact NH1-O 3.04Å; R158-A475 PolarHBondContact NH2-O 3.06Å; F469-A475 CarbonylContact O-C 3.57Å; F469-A475 WeakPolarHBondContact O-CA 3.5Å; F469-A475 WeakPolarHBondContact O-CB 3.37Å; G472-A475 WeakPolarHBondContact O-CB 3.33Å; G472-A475 PolarHBondContact O-N 2.83Å; A475-L477 PolarHBondContact O-N 3.03Å
476	C	96.9	Very high	96	Very high	46 Å²	46	32.4 Å²	32.4	31%	0.311	18%	0.184	S	C	.	.			trans	-52.5	127.2	-179	-175.9	0	0	0	0	111.3	F469 G478 R479	F469-C476 HydrophobicContact CB-CB 3.91Å; F469-C476 HydrophobicContact CD1-CB 3.75Å; F469-C476 HydrophobicContact CG-CB 4.33Å; F469-C476 WeakPolarHBondContact O-CB 3.43Å; F469-C476 PolarHBondContact O-N 2.74Å; C476-G478 PolarHBondContact SG-N 3.12Å; C476-R479 HydrophobicContact CB-CB 4.29Å
477	L	96	Very high	96.1	Very high	11 Å²	11	32.1 Å²	32.1	6%	0.058	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-39.3	176.7	-178.4	70.8	0	0	0	111.4	L161 N162 L165 L166 L332 A475 R479	L161-L477 HydrophobicContact CB-CD1 4.18Å; L161-L477 HydrophobicContact CB-CD2 3.91Å; L161-L477 HydrophobicContact CD1-CD2 4.07Å; N162-L477 WeakPolarHBondContact OD1-CD1 3.15Å; L165-L477 HydrophobicContact CD1-CD1 4.46Å; L165-L477 HydrophobicContact CD1-CD2 3.74Å; L165-L477 HydrophobicContact CD1-CG 3.84Å; L166-L477 HydrophobicContact CD1-CD1 4.22Å; L166-L477 WeakPolarHBondContact CD2-O 3.44Å; L166-L477 HydrophobicContact CG-CD1 4.36Å; L166-L477 VanDerWaalsContact CG-O 3.24Å; L166-L477 WeakPolarHBondContact CG-O 3.37Å; L332-L477 HydrophobicContact CD1-CD2 3.89Å; L332-L477 HydrophobicContact CD2-CD2 3.51Å; L332-L477 HydrophobicContact CG-CD2 4.35Å; A475-L477 PolarHBondContact O-N 3.03Å; L477-R479 VanDerWaalsContact C-N 3.25Å; L477-R479 PolarHBondContact O-N 2.9Å
478	G	96.3	Very high	96.3	Very high	25 Å²	25	31.2 Å²	31.2	26%	0.258	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	11.6	-178.3	0	0	0	0	0	114.5	C476 R480 I481 A482	C476-G478 PolarHBondContact SG-N 3.12Å; G478-R480 VanDerWaalsContact C-N 3.35Å; G478-R480 PolarHBondContact O-N 2.77Å; G478-I481 PolarHBondContact O-N 3.23Å; G478-A482 WeakPolarHBondContact O-CB 3.49Å; G478-A482 PolarHBondContact O-N 2.91Å
479	R	96.8	Very high	96.5	Very high	96 Å²	96	28.9 Å²	28.9	36%	0.362	16%	0.16	S	C	.	.	H	α-helix	trans	-54.2	-47.4	-170.9	174.9	179.7	171.6	-172.9	-1.9	113	L166 F469 C476 L477 E483	L166-R479 HydrophobicContact CD2-CB 4.23Å; F469-R479 HydrophobicContact CB-CB 4.37Å; F469-R479 HydrophobicContact CB-CG 4.12Å; F469-R479 HydrophobicContact CD1-CB 3.9Å; F469-R479 HydrophobicContact CD1-CG 3.88Å; F469-R479 HydrophobicContact CD2-CG 3.93Å; F469-R479 HydrophobicContact CE1-CB 4.38Å; F469-R479 HydrophobicContact CE1-CG 4.24Å; F469-R479 HydrophobicContact CE2-CG 4.29Å; F469-R479 HydrophobicContact CG-CB 4.12Å; F469-R479 HydrophobicContact CG-CG 3.7Å; F469-R479 HydrophobicContact CZ-CG 4.43Å; C476-R479 HydrophobicContact CB-CB 4.29Å; L477-R479 VanDerWaalsContact C-N 3.25Å; L477-R479 PolarHBondContact O-N 2.9Å; R479-E483 HydrophobicContact CG-CG 4.34Å; R479-E483 IonicContact CZ-OE1 3.3Å; R479-E483 IonicContact NE-OE1 3.21Å; R479-E483 PolarHBondContact NE-OE1 3.22Å; R479-E483 IonicContact NE-OE2 3.23Å; R479-E483 IonicContact NH2-OE1 3.53Å; R479-E483 PolarHBondContact NH2-OE1 2.94Å; R479-E483 WeakPolarHBondContact O-CB 3.33Å; R479-E483 VanDerWaalsContact O-CG 3.28Å; R479-E483 WeakPolarHBondContact O-CG 3.4Å; R479-E483 PolarHBondContact O-N 3.1Å
480	R	96.4	Very high	96.6	Very high	85 Å²	85	27.3 Å²	27.3	32%	0.321	15%	0.153	S	C	.	.	H	α-helix	trans	-71.9	-40.2	-175.1	-61.1	-52.3	-170.3	176.8	8.7	112.1	L166 A171 G478 E483 L484	L166-R480 HydrophobicContact CD2-CG 4.19Å; L166-R480 WeakPolarHBondContact O-CG 3.37Å; A171-R480 HydrophobicContact CB-CB 3.65Å; G478-R480 VanDerWaalsContact C-N 3.35Å; G478-R480 PolarHBondContact O-N 2.77Å; R480-E483 IonicContact CZ-OE2 2.62Å; R480-E483 IonicContact NH1-OE2 3.57Å; R480-E483 PolarHBondContact NH1-OE2 3.04Å; R480-E483 PolarHBondContact O-N 2.99Å; R480-L484 VanDerWaalsContact O-CB 3.26Å; R480-L484 WeakPolarHBondContact O-CB 3.38Å; R480-L484 PolarHBondContact O-N 3.45Å
481	I	96.5	Very high	96.7	Very high	4 Å²	4	26.3 Å²	26.3	2%	0.021	14%	0.143	C	C	.	.	H	α-helix	trans	-58.4	-52.1	173.2	-57.5	-50.6	0	0	0	110	L165 A171 Y174 F178 I217 G478 E483 L484 E485	L165-I481 HydrophobicContact CB-CG1 4.45Å; L165-I481 HydrophobicContact CD2-CD1 4.26Å; L165-I481 HydrophobicContact CD2-CG1 3.88Å; A171-I481 HydrophobicContact CB-CD1 4.13Å; Y174-I481 HydrophobicContact CD2-CD1 3.47Å; Y174-I481 VanDerWaalsContact CD2-CD1 3.47Å; Y174-I481 HydrophobicContact CE2-CD1 3.79Å; F178-I481 HydrophobicContact CE2-CG2 4.4Å; F178-I481 HydrophobicContact CZ-CG2 3.64Å; I217-I481 HydrophobicContact CD1-CG2 4.47Å; G478-I481 PolarHBondContact O-N 3.23Å; I481-E483 PolarHBondContact O-N 3.11Å; I481-L484 PolarHBondContact O-N 3.47Å; I481-E485 PolarHBondContact O-N 3.04Å
482	A	97.9	Very high	96.9	Very high	9 Å²	9	24.4 Å²	24.4	7%	0.074	14%	0.135	C	C	.	.	H	α-helix	trans	-63	-44.1	178.1	0	0	0	0	0	112.9	F469 G478 L484 E485 M486	F469-A482 HydrophobicContact CE1-CB 4.18Å; G478-A482 WeakPolarHBondContact O-CB 3.49Å; G478-A482 PolarHBondContact O-N 2.91Å; A482-L484 VanDerWaalsContact C-N 3.31Å; A482-L484 PolarHBondContact O-N 3.43Å; A482-E485 WeakPolarHBondContact CA-OE1 3.5Å; A482-M486 HydrophobicContact CB-CE 4.2Å; A482-M486 WeakPolarHBondContact O-CB 2.94Å; A482-M486 WeakPolarHBondContact O-CE 3.14Å; A482-M486 WeakPolarHBondContact O-CG 3.11Å; A482-M486 PolarHBondContact O-N 3.38Å; A482-M486 VanDerWaalsContact O-N 3.16Å
483	E	98	Very high	97.1	Very high	38 Å²	38	22.8 Å²	22.8	18%	0.178	12%	0.119	C	C	.	.	H	α-helix	trans	-59.7	-42.5	175.4	-78.9	173.6	167.4	0	0	111.3	F469 R479 R480 I481 Q487	F469-E483 HydrophobicContact CE2-CG 4.18Å; F469-E483 HydrophobicContact CZ-CG 4.22Å; R479-E483 HydrophobicContact CG-CG 4.34Å; R479-E483 IonicContact CZ-OE1 3.3Å; R479-E483 IonicContact NE-OE1 3.21Å; R479-E483 PolarHBondContact NE-OE1 3.22Å; R479-E483 IonicContact NE-OE2 3.23Å; R479-E483 IonicContact NH2-OE1 3.53Å; R479-E483 PolarHBondContact NH2-OE1 2.94Å; R479-E483 WeakPolarHBondContact O-CB 3.33Å; R479-E483 VanDerWaalsContact O-CG 3.28Å; R479-E483 WeakPolarHBondContact O-CG 3.4Å; R479-E483 PolarHBondContact O-N 3.1Å; R480-E483 IonicContact CZ-OE2 2.62Å; R480-E483 IonicContact NH1-OE2 3.57Å; R480-E483 PolarHBondContact NH1-OE2 3.04Å; R480-E483 PolarHBondContact O-N 2.99Å; I481-E483 PolarHBondContact O-N 3.11Å; E483-Q487 WeakPolarHBondContact O-CB 3.5Å; E483-Q487 WeakPolarHBondContact O-CG 3.37Å; E483-Q487 PolarHBondContact O-N 2.59Å; E483-Q487 VanDerWaalsContact O-N 3.17Å; E483-Q487 PolarHBondContact O-NE2 3.17Å; E483-Q487 VanDerWaalsContact O-NE2 3.16Å
484	L	97.9	Very high	97.3	Very high	5 Å²	5	19.3 Å²	19.3	3%	0.026	10%	0.098	C	C	.	.	H	α-helix	trans	-68.5	-52.9	-178	-179.5	57	0	0	0	112	A171 F178 H377 F380 R480 I481 A482 M486 Q487 L488	A171-L484 WeakPolarHBondContact O-CD2 3.26Å; F178-L484 HydrophobicContact CD2-CD2 3.9Å; F178-L484 HydrophobicContact CD2-CG 3.99Å; F178-L484 HydrophobicContact CE2-CB 4.4Å; F178-L484 HydrophobicContact CE2-CD2 3.95Å; F178-L484 HydrophobicContact CE2-CG 4.15Å; H377-L484 HydrophobicContact CB-CD1 4.34Å; F380-L484 HydrophobicContact CD2-CD1 4.17Å; F380-L484 HydrophobicContact CE2-CD1 3.67Å; R480-L484 VanDerWaalsContact O-CB 3.26Å; R480-L484 WeakPolarHBondContact O-CB 3.38Å; R480-L484 PolarHBondContact O-N 3.45Å; I481-L484 PolarHBondContact O-N 3.47Å; A482-L484 VanDerWaalsContact C-N 3.31Å; A482-L484 PolarHBondContact O-N 3.43Å; L484-M486 VanDerWaalsContact C-N 3.31Å; L484-M486 PolarHBondContact O-N 2.9Å; L484-Q487 PolarHBondContact O-N 3.17Å; L484-L488 HydrophobicContact CD1-CD1 3.76Å; L484-L488 HydrophobicContact CD1-CG 4.03Å; L484-L488 HydrophobicContact CG-CD1 3.81Å; L484-L488 HydrophobicContact CG-CG 4.5Å; L484-L488 WeakPolarHBondContact O-CG 3.33Å; L484-L488 PolarHBondContact O-N 3.34Å
485	E	97.5	Very high	97.3	Very high	5 Å²	5	19.9 Å²	19.9	2%	0.023	10%	0.1	C	C	.	.	H	α-helix	trans	-62.2	-39.3	-177.9	75.5	-170.2	165.4	0	0	111.8	F178 T340 I481 A482 L489	F178-E485 HydrophobicContact CD1-CB 3.78Å; F178-E485 HydrophobicContact CD2-CB 4.44Å; F178-E485 HydrophobicContact CE1-CB 3.57Å; F178-E485 WeakPolarHBondContact CE1-OE2 3.49Å; F178-E485 HydrophobicContact CE2-CB 4.26Å; F178-E485 HydrophobicContact CG-CB 4.22Å; F178-E485 HydrophobicContact CZ-CB 3.82Å; T340-E485 WeakPolarHBondContact CB-OE1 3.32Å; T340-E485 HydrophobicContact CG2-CG 3.75Å; T340-E485 WeakPolarHBondContact CG2-OE1 3.37Å; T340-E485 PolarHBondContact OG1-OE1 2.99Å; I481-E485 PolarHBondContact O-N 3.04Å; A482-E485 WeakPolarHBondContact CA-OE1 3.5Å; E485-L489 WeakPolarHBondContact O-CB 3.48Å; E485-L489 PolarHBondContact O-N 3.33Å
486	M	98.7	Very high	97.3	Very high	4 Å²	4	22.5 Å²	22.5	2%	0.02	11%	0.108	C	C	.	.	H	α-helix	trans	-67.3	-38.2	177.3	-70.4	-171.3	-73.8	0	0	112.2	T340 T343 L344 L390 F469 A482 L484 L490	T340-M486 HydrophobicContact CG2-CG 3.74Å; T340-M486 HydrophobicContact CG2-SD 4.5Å; T343-M486 VanDerWaalsContact CB-SD 3.58Å; T343-M486 HydrophobicContact CG2-CE 4.34Å; T343-M486 HydrophobicContact CG2-SD 3.39Å; T343-M486 WeakPolarHBondContact CG2-SD 3.36Å; L344-M486 HydrophobicContact CD2-CB 4.19Å; L344-M486 HydrophobicContact CD2-CG 4.14Å; L344-M486 HydrophobicContact CG-CG 4.06Å; L390-M486 HydrophobicContact CD1-CB 3.93Å; L390-M486 HydrophobicContact CD2-CB 4.04Å; L390-M486 HydrophobicContact CD2-SD 4.3Å; F469-M486 HydrophobicContact CZ-CE 4.25Å; A482-M486 HydrophobicContact CB-CE 4.2Å; A482-M486 WeakPolarHBondContact O-CB 2.94Å; A482-M486 WeakPolarHBondContact O-CE 3.14Å; A482-M486 WeakPolarHBondContact O-CG 3.11Å; A482-M486 PolarHBondContact O-N 3.38Å; A482-M486 VanDerWaalsContact O-N 3.16Å; L484-M486 VanDerWaalsContact C-N 3.31Å; L484-M486 PolarHBondContact O-N 2.9Å; M486-L490 WeakPolarHBondContact O-CB 3.48Å; M486-L490 PolarHBondContact O-N 2.87Å
487	Q	98.6	Very high	97.3	Very high	19 Å²	19	20.4 Å²	20.4	9%	0.089	9%	0.094	C	C	.	.	H	α-helix	trans	-69	-46.9	178.9	-76	165.6	36.6	0	0	111.3	F380 L386 L390 E483 L484 A491	F380-Q487 HydrophobicContact CD1-CB 3.83Å; F380-Q487 HydrophobicContact CD1-CG 4.44Å; F380-Q487 HydrophobicContact CD2-CB 4.29Å; F380-Q487 HydrophobicContact CE1-CB 3.58Å; F380-Q487 HydrophobicContact CE2-CB 4.03Å; F380-Q487 HydrophobicContact CG-CB 4.22Å; F380-Q487 VanDerWaalsContact CG-OE1 3.25Å; F380-Q487 HydrophobicContact CZ-CB 3.68Å; L386-Q487 HydrophobicContact CD2-CB 4.01Å; L386-Q487 HydrophobicContact CD2-CG 4.16Å; L390-Q487 HydrophobicContact CD1-CG 3.55Å; E483-Q487 WeakPolarHBondContact O-CB 3.5Å; E483-Q487 WeakPolarHBondContact O-CG 3.37Å; E483-Q487 PolarHBondContact O-N 2.59Å; E483-Q487 VanDerWaalsContact O-N 3.17Å; E483-Q487 PolarHBondContact O-NE2 3.17Å; E483-Q487 VanDerWaalsContact O-NE2 3.16Å; L484-Q487 PolarHBondContact O-N 3.17Å; Q487-A491 VanDerWaalsContact O-CB 3.22Å; Q487-A491 WeakPolarHBondContact O-CB 3.08Å; Q487-A491 PolarHBondContact O-N 3.01Å
488	L	98.6	Very high	97.4	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-59.4	-51.5	177.8	-71	164.5	0	0	0	111.1	T175 F178 I182 P375 F380 L484 A491 R492	T175-L488 HydrophobicContact CG2-CD1 4.23Å; T175-L488 HydrophobicContact CG2-CD2 4.03Å; F178-L488 HydrophobicContact CB-CD1 3.57Å; F178-L488 HydrophobicContact CD2-CD1 4.14Å; F178-L488 HydrophobicContact CG-CD1 4.22Å; I182-L488 HydrophobicContact CD1-CB 3.38Å; P375-L488 HydrophobicContact CB-CD2 4.3Å; P375-L488 WeakPolarHBondContact O-CD2 3.3Å; F380-L488 HydrophobicContact CE2-CD2 3.79Å; F380-L488 HydrophobicContact CE2-CG 3.87Å; F380-L488 HydrophobicContact CZ-CB 4.32Å; F380-L488 HydrophobicContact CZ-CD2 3.54Å; F380-L488 HydrophobicContact CZ-CG 3.69Å; L484-L488 HydrophobicContact CD1-CD1 3.76Å; L484-L488 HydrophobicContact CD1-CG 4.03Å; L484-L488 HydrophobicContact CG-CD1 3.81Å; L484-L488 HydrophobicContact CG-CG 4.5Å; L484-L488 WeakPolarHBondContact O-CG 3.33Å; L484-L488 PolarHBondContact O-N 3.34Å; L488-A491 PolarHBondContact O-N 3.25Å; L488-R492 WeakPolarHBondContact O-CB 3.3Å; L488-R492 WeakPolarHBondContact O-CG 3.26Å; L488-R492 PolarHBondContact O-N 3.24Å
489	L	98.6	Very high	97.5	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-66	-44.2	-176.8	179.8	59.5	0	0	0	112.1	I182 F185 F209 F212 L344 E485 R492 L493	I182-L489 HydrophobicContact CD1-CB 4.14Å; I182-L489 HydrophobicContact CG1-CB 4.24Å; I182-L489 HydrophobicContact CG1-CD1 4.18Å; I182-L489 HydrophobicContact CG2-CD1 3.9Å; F185-L489 HydrophobicContact CD1-CD1 3.54Å; F185-L489 HydrophobicContact CE1-CD1 3.66Å; F185-L489 HydrophobicContact CG-CD1 4.23Å; F185-L489 HydrophobicContact CZ-CD1 4.37Å; F185-L489 HydrophobicContact CZ-CD2 4.45Å; F209-L489 HydrophobicContact CD1-CD2 3.89Å; F209-L489 HydrophobicContact CE1-CD2 3.65Å; F209-L489 HydrophobicContact CE1-CG 4.48Å; F212-L489 HydrophobicContact CD1-CD2 3.61Å; F212-L489 HydrophobicContact CD2-CD2 4.23Å; F212-L489 HydrophobicContact CE1-CB 4.38Å; F212-L489 HydrophobicContact CE1-CD2 3.54Å; F212-L489 HydrophobicContact CE2-CD2 4.16Å; F212-L489 HydrophobicContact CG-CD2 3.97Å; F212-L489 HydrophobicContact CZ-CB 4.13Å; F212-L489 HydrophobicContact CZ-CD2 3.82Å; F212-L489 HydrophobicContact CZ-CG 4.46Å; L344-L489 HydrophobicContact CD1-CD2 3.71Å; L344-L489 HydrophobicContact CD2-CD2 4.29Å; E485-L489 WeakPolarHBondContact O-CB 3.48Å; E485-L489 PolarHBondContact O-N 3.33Å; L489-R492 PolarHBondContact O-N 2.87Å; L489-L493 HydrophobicContact CD1-CD1 4.07Å; L489-L493 HydrophobicContact CD1-CG 4.15Å; L489-L493 HydrophobicContact CG-CD1 3.96Å; L489-L493 HydrophobicContact CG-CG 4.46Å; L489-L493 WeakPolarHBondContact O-CB 2.81Å; L489-L493 WeakPolarHBondContact O-CG 3.28Å; L489-L493 PolarHBondContact O-N 2.82Å
490	L	98.5	Very high	97.5	Very high	1 Å²	1	20.3 Å²	20.3	1%	0.005	9%	0.092	C	C	.	.	H	α-helix	trans	-67	-39	-179.1	-172.6	61.9	0	0	0	111.5	L348 L351 L386 V389 L390 M486 L493 I494	L348-L490 HydrophobicContact CD2-CD1 3.61Å; L351-L490 HydrophobicContact CD1-CD1 3.84Å; L351-L490 HydrophobicContact CD1-CD2 4.36Å; L386-L490 HydrophobicContact CD1-CB 4.02Å; L386-L490 HydrophobicContact CD1-CD2 3.74Å; L386-L490 HydrophobicContact CD1-CG 3.81Å; V389-L490 HydrophobicContact CG1-CD2 3.93Å; L390-L490 HydrophobicContact CD2-CD2 4.04Å; L390-L490 HydrophobicContact CG-CD2 4.37Å; M486-L490 WeakPolarHBondContact O-CB 3.48Å; M486-L490 PolarHBondContact O-N 2.87Å; L490-L493 PolarHBondContact O-N 2.68Å; L490-I494 HydrophobicContact CD1-CG1 3.98Å; L490-I494 HydrophobicContact CG-CG1 4.3Å; L490-I494 WeakPolarHBondContact O-CB 3.45Å; L490-I494 VanDerWaalsContact O-CG1 3.23Å; L490-I494 WeakPolarHBondContact O-CG1 3.2Å; L490-I494 PolarHBondContact O-N 3.17Å
491	A	98.2	Very high	97.5	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-59.9	-48.5	173.3	0	0	0	0	0	111.3	V365 P375 F380 L386 Q487 L488 L493 I494 Q495	V365-A491 HydrophobicContact CG1-CB 4.22Å; V365-A491 HydrophobicContact CG2-CB 4.37Å; P375-A491 HydrophobicContact CB-CB 4.34Å; P375-A491 HydrophobicContact CG-CB 3.91Å; F380-A491 HydrophobicContact CE1-CB 4.49Å; L386-A491 HydrophobicContact CD2-CB 4.22Å; Q487-A491 VanDerWaalsContact O-CB 3.22Å; Q487-A491 WeakPolarHBondContact O-CB 3.08Å; Q487-A491 PolarHBondContact O-N 3.01Å; L488-A491 PolarHBondContact O-N 3.25Å; A491-L493 PolarHBondContact O-N 3.17Å; A491-I494 PolarHBondContact O-N 3.45Å; A491-Q495 WeakPolarHBondContact O-CB 3.21Å; A491-Q495 PolarHBondContact O-N 3.35Å
492	R	97.6	Very high	97.5	Very high	35 Å²	35	17.7 Å²	17.7	13%	0.132	8%	0.084	C	C	.	.	H	α-helix	trans	-60.4	-41.6	178.6	-72.9	-78.5	-64.4	-155.4	-11	113.1	I182 D183 P375 L488 L489 K496	I182-R492 HydrophobicContact CG2-CB 4.02Å; I182-R492 HydrophobicContact CG2-CG 3.94Å; D183-R492 IonicContact OD1-CZ 3.87Å; D183-R492 IonicContact OD1-NH2 3.95Å; D183-R492 PolarHBondContact OD1-NH2 2.89Å; P375-R492 VanDerWaalsContact CD-CD 3.43Å; P375-R492 HydrophobicContact CG-CG 4.22Å; L488-R492 WeakPolarHBondContact O-CB 3.3Å; L488-R492 WeakPolarHBondContact O-CG 3.26Å; L488-R492 PolarHBondContact O-N 3.24Å; L489-R492 PolarHBondContact O-N 2.87Å; R492-K496 PolarHBondContact O-N 3.37Å
493	L	97.7	Very high	97.2	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-65.8	-48.6	177.1	-79.1	171.8	0	0	0	112.1	F185 M186 L189 F209 L348 L489 L490 A491 K496 Y497 F526	F185-L493 HydrophobicContact CE1-CD1 4.38Å; F185-L493 HydrophobicContact CE1-CD2 4.11Å; M186-L493 HydrophobicContact SD-CD2 3.87Å; M186-L493 HydrophobicContact SD-CG 4.39Å; L189-L493 HydrophobicContact CD2-CD2 3.52Å; F209-L493 HydrophobicContact CE1-CD1 4.13Å; F209-L493 HydrophobicContact CZ-CD1 4.12Å; L348-L493 HydrophobicContact CD1-CD1 4.16Å; L489-L493 HydrophobicContact CD1-CD1 4.07Å; L489-L493 HydrophobicContact CD1-CG 4.15Å; L489-L493 HydrophobicContact CG-CD1 3.96Å; L489-L493 HydrophobicContact CG-CG 4.46Å; L489-L493 WeakPolarHBondContact O-CB 2.81Å; L489-L493 WeakPolarHBondContact O-CG 3.28Å; L489-L493 PolarHBondContact O-N 2.82Å; L490-L493 PolarHBondContact O-N 2.68Å; A491-L493 PolarHBondContact O-N 3.17Å; L493-K496 PolarHBondContact O-N 3.43Å; L493-Y497 HydrophobicContact CD2-CD2 4.22Å; L493-Y497 WeakPolarHBondContact O-CB 3.49Å; L493-Y497 PolarHBondContact O-N 2.96Å; L493-F526 HydrophobicContact CD2-CD1 4.5Å; L493-F526 HydrophobicContact CD2-CE1 4.01Å
494	I	97.1	Very high	96.8	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-72.9	-31.9	-175.2	-64.1	-66.1	0	0	0	111.8	L351 Q358 L361 H362 L490 A491 K496 V499 R529	L351-I494 HydrophobicContact CD1-CD1 4.02Å; L351-I494 HydrophobicContact CD1-CG1 4.49Å; Q358-I494 HydrophobicContact CG-CD1 3.98Å; L361-I494 HydrophobicContact CB-CG2 4.4Å; L361-I494 HydrophobicContact CD2-CB 4.49Å; L361-I494 HydrophobicContact CD2-CD1 4.44Å; L361-I494 HydrophobicContact CD2-CG1 3.91Å; L361-I494 HydrophobicContact CD2-CG2 4.21Å; L361-I494 HydrophobicContact CG-CG2 4.02Å; H362-I494 HydrophobicContact CB-CG2 3.84Å; H362-I494 PolarHBondContact CD2-O 3.06Å; H362-I494 VanDerWaalsContact CD2-O 3.31Å; L490-I494 HydrophobicContact CD1-CG1 3.98Å; L490-I494 HydrophobicContact CG-CG1 4.3Å; L490-I494 WeakPolarHBondContact O-CB 3.45Å; L490-I494 VanDerWaalsContact O-CG1 3.23Å; L490-I494 WeakPolarHBondContact O-CG1 3.2Å; L490-I494 PolarHBondContact O-N 3.17Å; A491-I494 PolarHBondContact O-N 3.45Å; I494-K496 VanDerWaalsContact C-N 3.32Å; I494-K496 PolarHBondContact O-N 3.13Å; I494-V499 HydrophobicContact CD1-CG2 4.48Å; I494-R529 WeakPolarHBondContact O-CD 3.35Å; I494-R529 PolarHBondContact O-NE 3.02Å
495	Q	94.9	Very high	96.6	Very high	16 Å²	16	26 Å²	26	8%	0.075	13%	0.131	C	C	.	.	H	α-helix	trans	-59.5	-40.8	171.6	-169.1	-170.4	46.4	0	0	111.7	V365 V366 V369 P370 Q373 A491	V365-Q495 HydrophobicContact CG1-CB 4.02Å; V365-Q495 HydrophobicContact CG1-CG 4.45Å; V366-Q495 HydrophobicContact CG1-CG 4.18Å; V369-Q495 PolarHBondContact O-NE2 3.29Å; P370-Q495 PolarHBondContact O-NE2 3.41Å; Q373-Q495 PolarHBondContact O-NE2 3.22Å; A491-Q495 WeakPolarHBondContact O-CB 3.21Å; A491-Q495 PolarHBondContact O-N 3.35Å
496	K	95.6	Very high	96.3	Very high	74 Å²	74	27.3 Å²	27.3	32%	0.322	15%	0.146	S	C	.	.	H	α-helix	trans	-93.9	-31.4	-174.3	-165.5	176	-178.7	-168.2	0	114	M186 D190 R492 L493 I494 R529	M186-K496 HydrophobicContact CE-CB 4.15Å; M186-K496 HydrophobicContact CE-CD 3.57Å; M186-K496 HydrophobicContact CE-CG 4.46Å; D190-K496 IonicContact OD2-NZ 3.37Å; D190-K496 PolarHBondContact OD2-NZ 3.17Å; R492-K496 PolarHBondContact O-N 3.37Å; L493-K496 PolarHBondContact O-N 3.43Å; I494-K496 VanDerWaalsContact C-N 3.32Å; I494-K496 PolarHBondContact O-N 3.13Å; K496-R529 PolarHBondContact O-N 3.47Å
497	Y	96.8	Very high	96	Very high	1 Å²	1	33.8 Å²	33.8	0%	0.004	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	143.1	-167.2	-61.3	-59	0	0	0	113.8	M186 L189 D190 R193 L493 F526 L527 R529	M186-Y497 HydrophobicContact CE-CD2 4.28Å; M186-Y497 HydrophobicContact CE-CE2 3.68Å; L189-Y497 HydrophobicContact CD2-CD2 4.23Å; L189-Y497 HydrophobicContact CD2-CE2 3.82Å; D190-Y497 VanDerWaalsContact CG-OH 3.28Å; D190-Y497 PolarHBondContact OD1-OH 3.11Å; D190-Y497 PolarHBondContact OD2-OH 2.94Å; R193-Y497 VanDerWaalsContact CZ-CE1 3.45Å; R193-Y497 VanDerWaalsContact NH1-CZ 3.26Å; R193-Y497 PolarHBondContact NH1-OH 3.14Å; L493-Y497 HydrophobicContact CD2-CD2 4.22Å; L493-Y497 WeakPolarHBondContact O-CB 3.49Å; L493-Y497 PolarHBondContact O-N 2.96Å; Y497-F526 HydrophobicContact CD1-CB 3.98Å; Y497-F526 HydrophobicContact CD2-CB 4.4Å; Y497-F526 AromaticContact CD2-CD1 3.92Å; Y497-F526 HydrophobicContact CD2-CD1 3.92Å; Y497-F526 HydrophobicContact CG-CB 3.95Å; Y497-F526 AromaticContact CG-CD1 3.98Å; Y497-F526 HydrophobicContact CG-CD1 3.98Å; Y497-F526 HydrophobicContact CG-CG 4.45Å; Y497-L527 CarbonylContact C-O 3.49Å; Y497-L527 VanDerWaalsContact CA-O 3.32Å; Y497-L527 WeakPolarHBondContact CA-O 3.45Å; Y497-R529 PolarHBondContact O-NE 3.19Å; Y497-R529 VanDerWaalsContact O-NE 3.12Å
498	K	97.8	Very high	95.8	Very high	85 Å²	85	33.3 Å²	33.3	37%	0.37	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	119	154.1	-179.4	174	-175.8	169.3	0	108.2	Q358 L527 R529	Q358-K498 VanDerWaalsContact OE1-CA 3.27Å; K498-L527 HydrophobicContact CB-CB 4.31Å; K498-L527 PolarHBondContact N-O 3.19Å; K498-L527 PolarHBondContact O-N 3.15Å; K498-R529 HydrophobicContact CB-CG 4.29Å
499	V	97.9	Very high	95.6	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.006	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	131.1	-177.3	-173.3	0	0	0	0	109.4	L348 S352 Q358 I494 L524 Q525 F526	L348-V499 HydrophobicContact CD1-CG1 4.48Å; L348-V499 HydrophobicContact CD2-CG2 4.22Å; S352-V499 WeakPolarHBondContact CA-O 3.41Å; Q358-V499 PolarHBondContact NE2-O 3.17Å; I494-V499 HydrophobicContact CD1-CG2 4.48Å; V499-L524 HydrophobicContact CG1-CB 4.22Å; V499-L524 HydrophobicContact CG1-CD1 3.91Å; V499-L524 HydrophobicContact CG1-CD2 4.29Å; V499-L524 HydrophobicContact CG1-CG 4.38Å; V499-Q525 CarbonylContact C-O 3.59Å; V499-Q525 WeakPolarHBondContact CA-O 3.26Å; V499-F526 HydrophobicContact CG1-CE1 4.36Å; V499-F526 HydrophobicContact CG2-CD1 3.95Å; V499-F526 HydrophobicContact CG2-CE1 3.88Å
500	V	97.1	Very high	95.3	Very high	45 Å²	45	40.1 Å²	40.1	27%	0.273	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	141.3	179.5	-179.3	0	0	0	0	109.2	A502 Q525 L527	V500-A502 PolarHBondContact O-N 3Å; V500-Q525 HydrophobicContact CB-CB 4.27Å; V500-Q525 PolarHBondContact N-O 2.77Å; V500-Q525 PolarHBondContact O-N 3.15Å; V500-L527 HydrophobicContact CG2-CD1 3.89Å; V500-L527 HydrophobicContact CG2-CG 4.42Å
501	L	97.1	Very high	95	Very high	34 Å²	34	41.7 Å²	41.7	18%	0.178	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	127	177.7	-169.9	66.9	0	0	0	109.6	Y349 K353 T505 L524	Y349-L501 HydrophobicContact CD2-CD1 3.72Å; Y349-L501 HydrophobicContact CE2-CD1 3.93Å; Y349-L501 HydrophobicContact CE2-CD2 3.96Å; K353-L501 HydrophobicContact CD-CD2 4.47Å; K353-L501 HydrophobicContact CG-CD2 4.36Å; L501-T505 HydrophobicContact CD1-CG2 3.73Å; L501-T505 HydrophobicContact CG-CG2 4.43Å; L501-L524 HydrophobicContact CD1-CD2 3.87Å
502	A	95.4	Very high	94.5	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.215	C	C	.	.			trans	-64.2	136.3	176	0	0	0	0	0	110	Q201 V500 E504 T505 G523 Q525	Q201-A502 HydrophobicContact CG-CB 4.27Å; V500-A502 PolarHBondContact O-N 3Å; A502-E504 WeakPolarHBondContact CB-OE1 3.4Å; A502-E504 WeakPolarHBondContact CB-OE2 3.38Å; A502-E504 PolarHBondContact O-N 3.06Å; A502-E504 VanDerWaalsContact O-N 3.15Å; A502-T505 VanDerWaalsContact O-CB 3.3Å; A502-T505 WeakPolarHBondContact O-CB 3.19Å; A502-T505 PolarHBondContact O-N 3.31Å; A502-T505 PolarHBondContact O-OG1 2.86Å; A502-G523 VanDerWaalsContact CB-C 3.43Å; A502-G523 VanDerWaalsContact CB-O 3.23Å; A502-G523 WeakPolarHBondContact CB-O 3.4Å; A502-G523 PolarHBondContact N-O 3.07Å; A502-Q525 HydrophobicContact CB-CG 4.47Å
503	P	91.4	Very high	93.8	Very high	105 Å²	105	42.6 Å²	42.6	68%	0.682	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-36.8	-172.7	-28.3	35.2	0	0	0	114.5	T505	P503-T505 VanDerWaalsContact C-N 3.29Å; P503-T505 PolarHBondContact O-N 3.13Å
504	E	90.7	Very high	93.3	Very high	116 Å²	116	45.8 Å²	45.8	54%	0.542	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-18	-179.4	74.2	-75.9	-178.8	0	0	113.8	Q201 A502	Q201-E504 PolarHBondContact NE2-OE1 3.21Å; A502-E504 WeakPolarHBondContact CB-OE1 3.4Å; A502-E504 WeakPolarHBondContact CB-OE2 3.38Å; A502-E504 PolarHBondContact O-N 3.06Å; A502-E504 VanDerWaalsContact O-N 3.15Å
505	T	92.4	Very high	93	Very high	5 Å²	5	46.1 Å²	46.1	3%	0.031	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-44.2	177.8	-58.5	0	0	0	0	110.6	L501 A502 P503 L508 K520 V522 G523	L501-T505 HydrophobicContact CD1-CG2 3.73Å; L501-T505 HydrophobicContact CG-CG2 4.43Å; A502-T505 VanDerWaalsContact O-CB 3.3Å; A502-T505 WeakPolarHBondContact O-CB 3.19Å; A502-T505 PolarHBondContact O-N 3.31Å; A502-T505 PolarHBondContact O-OG1 2.86Å; P503-T505 VanDerWaalsContact C-N 3.29Å; P503-T505 PolarHBondContact O-N 3.13Å; T505-L508 HydrophobicContact CG2-CD2 3.79Å; T505-L508 HydrophobicContact CG2-CG 4.2Å; T505-K520 WeakPolarHBondContact O-CE 3.43Å; T505-K520 PolarHBondContact O-NZ 3.29Å; T505-V522 HydrophobicContact CG2-CG1 4.36Å; T505-G523 VanDerWaalsContact OG1-CA 3.22Å; T505-G523 WeakPolarHBondContact OG1-CA 3.35Å; T505-G523 PolarHBondContact OG1-N 3.4Å; T505-G523 PolarHBondContact OG1-O 2.89Å
506	G	91.7	Very high	92.9	Very high	32 Å²	32	45.4 Å²	45.4	33%	0.33	23%	0.234	S	C	.	.			trans	54.3	-153.7	-176.8	0	0	0	0	0	113.8
507	E	92.8	Very high	92.8	Very high	140 Å²	140	42.3 Å²	42.3	65%	0.654	22%	0.221	S	C	*	.	S	Bend	trans	-70.5	135.1	178.9	-165.5	-177.3	-174.8	0	0	111.8	K520	E507-K520 WeakPolarHBondContact O-CE 3.16Å; E507-K520 PolarHBondContact O-NZ 2.7Å
508	L	94.2	Very high	92.7	Very high	10 Å²	10	43 Å²	43	5%	0.052	23%	0.225	C	C	.	.			trans	-100.7	141.8	175.6	-65.5	-176	0	0	0	110.7	W346 Y349 T505 P518 K520 V522	W346-L508 HydrophobicContact CH2-CB 3.89Å; W346-L508 HydrophobicContact CZ3-CB 3.75Å; W346-L508 HydrophobicContact CZ3-CD1 4.08Å; Y349-L508 HydrophobicContact CD1-CD1 4.43Å; Y349-L508 HydrophobicContact CD2-CB 4.48Å; Y349-L508 HydrophobicContact CD2-CD1 3.37Å; Y349-L508 HydrophobicContact CD2-CG 3.87Å; Y349-L508 HydrophobicContact CE1-CB 4.44Å; Y349-L508 HydrophobicContact CE2-CB 4.04Å; Y349-L508 HydrophobicContact CE2-CD1 3.7Å; Y349-L508 HydrophobicContact CE2-CG 3.63Å; Y349-L508 HydrophobicContact CG-CD1 3.78Å; Y349-L508 PolarHBondContact OH-N 3.34Å; T505-L508 HydrophobicContact CG2-CD2 3.79Å; T505-L508 HydrophobicContact CG2-CG 4.2Å; L508-P518 HydrophobicContact CD1-CB 4.5Å; L508-K520 HydrophobicContact CD2-CD 4.37Å; L508-K520 HydrophobicContact CD2-CG 3.79Å; L508-V522 HydrophobicContact CD1-CB 4.36Å; L508-V522 HydrophobicContact CD1-CG1 3.97Å; L508-V522 HydrophobicContact CD1-CG2 3.53Å; L508-V522 HydrophobicContact CD2-CG2 4.15Å
509	K	93.3	Very high	92.5	Very high	131 Å²	131	42.4 Å²	42.4	57%	0.57	23%	0.226	S	C	*	.			trans	-117.4	151.9	171	-63.5	-176.6	180	-178.1	0	109.6	N519	K509-N519 HydrophobicContact CB-CB 4.4Å; K509-N519 PolarHBondContact N-OD1 3.36Å; K509-N519 WeakPolarHBondContact O-CB 3.41Å; K509-N519 PolarHBondContact O-N 3.38Å; K509-N519 PolarHBondContact O-OD1 3.11Å
510	S	93.3	Very high	92.4	Very high	12 Å²	12	46.6 Å²	46.6	8%	0.084	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	140	173.5	56	0	0	0	0	111.5	H82 V517	H82-S510 PolarHBondContact CE1-O 2.75Å; H82-S510 VanDerWaalsContact CE1-O 3.26Å; H82-S510 PolarHBondContact NE2-O 3.23Å; H82-S510 PolarHBondContact NE2-OG 3.38Å; H82-S510 VanDerWaalsContact NE2-OG 3.14Å; S510-V517 WeakPolarHBondContact CA-O 3.43Å
511	V	92.4	Very high	92.3	Very high	33 Å²	33	51.1 Å²	51.1	20%	0.2	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	144.5	165.9	-64.7	0	0	0	0	109.1	L79 L516 V517 N519	L79-V511 CarbonylContact O-C 3.45Å; V511-L516 WeakPolarHBondContact O-CA 3.3Å; V511-V517 HydrophobicContact CG2-CG2 3.49Å; V511-V517 VanDerWaalsContact CG2-CG2 3.49Å; V511-V517 PolarHBondContact N-O 3.01Å; V511-V517 PolarHBondContact O-N 3.06Å; V511-N519 HydrophobicContact CG1-CB 3.83Å
512	A	87.9	Confident	92.3	Very high	2 Å²	2	49.5 Å²	49.5	2%	0.017	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	99.2	179	0	0	0	0	0	110.1	L79 H82 P401 V515 L516	L79-A512 CarbonylContact C-O 3.23Å; L79-A512 WeakPolarHBondContact CA-O 3.27Å; L79-A512 PolarHBondContact O-N 3.44Å; H82-A512 WeakPolarHBondContact ND1-CB 3.42Å; P401-A512 HydrophobicContact CG-CB 4.4Å; A512-V515 WeakPolarHBondContact CA-O 2.99Å; A512-L516 HydrophobicContact CB-CD2 3.91Å
513	R	82.5	Confident	92.4	Very high	53 Å²	53	49.5 Å²	49.5	20%	0.2	25%	0.252	C	S	.	.	S	Bend	trans	-104.1	63.9	168.7	53.3	167	-161.2	-175.8	8.8	109	L79 F248 D338 V515 V517	L79-R513 HydrophobicContact CD2-CB 4.17Å; F248-R513 WeakPolarHBondContact CB-O 3.34Å; D338-R513 IonicContact OD2-CZ 2.98Å; D338-R513 IonicContact OD2-NE 2.85Å; D338-R513 IonicContact OD2-NH2 3.94Å; D338-R513 PolarHBondContact OD2-NH2 3.25Å; R513-V515 PolarHBondContact N-O 3.33Å; R513-V515 PolarHBondContact O-N 3.41Å; R513-V517 HydrophobicContact CG-CG1 4.19Å; R513-V517 HydrophobicContact CG-CG2 3.9Å
514	I	86.4	Confident	92.7	Very high	66 Å²	66	44.5 Å²	44.5	34%	0.338	22%	0.22	S	C	.	.	S	Bend	trans	70.5	-55.2	-160	-51.7	-59.6	0	0	0	112.3	F248 L252	F248-I514 HydrophobicContact CB-CG1 4.28Å; F248-I514 HydrophobicContact CD1-CB 3.86Å; F248-I514 HydrophobicContact CD1-CG1 3.87Å; F248-I514 HydrophobicContact CD1-CG2 4.16Å; F248-I514 HydrophobicContact CE1-CB 4.35Å; F248-I514 HydrophobicContact CE1-CG2 4.18Å; F248-I514 HydrophobicContact CG-CB 4.31Å; F248-I514 HydrophobicContact CG-CG1 4.38Å; L252-I514 HydrophobicContact CD2-CD1 3.91Å; L252-I514 HydrophobicContact CG-CD1 4.19Å
515	V	91.6	Very high	93	Very high	7 Å²	7	40.8 Å²	40.8	4%	0.042	20%	0.202	C	C	.	.	S	Bend	trans	-97.3	154.6	170.8	-64.8	0	0	0	0	112.3	D338 V399 A512 R513 V517	D338-V515 HydrophobicContact CB-CG2 4.11Å; V399-V515 HydrophobicContact CG1-CB 4.02Å; V399-V515 HydrophobicContact CG1-CG1 3.86Å; V399-V515 CarbonylContact O-C 3.57Å; V399-V515 WeakPolarHBondContact O-CA 3.06Å; V399-V515 WeakPolarHBondContact O-CB 3.13Å; A512-V515 WeakPolarHBondContact CA-O 2.99Å; R513-V515 PolarHBondContact N-O 3.33Å; R513-V515 PolarHBondContact O-N 3.41Å; V515-V517 HydrophobicContact CG2-CG1 3.67Å
516	L	93.2	Very high	93.3	Very high	2 Å²	2	40.6 Å²	40.6	1%	0.01	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	117.8	171.7	-75	-175.7	0	0	0	111.2	H82 P398 V399 P401 Y429 V511 A512	H82-L516 HydrophobicContact CB-CD2 4.06Å; P398-L516 HydrophobicContact CG-CD1 4.21Å; P398-L516 VanDerWaalsContact O-CD1 3.25Å; P398-L516 WeakPolarHBondContact O-CD1 3.33Å; V399-L516 PolarHBondContact O-N 3.28Å; P401-L516 HydrophobicContact CB-CD1 4.1Å; P401-L516 HydrophobicContact CB-CD2 4.33Å; P401-L516 HydrophobicContact CB-CG 4.02Å; P401-L516 HydrophobicContact CG-CD2 4.22Å; P401-L516 HydrophobicContact CG-CG 4.01Å; Y429-L516 HydrophobicContact CD2-CD1 3.68Å; Y429-L516 HydrophobicContact CE2-CD1 4.04Å; V511-L516 WeakPolarHBondContact O-CA 3.3Å; A512-L516 HydrophobicContact CB-CD2 3.91Å
517	V	93.3	Very high	93.5	Very high	8 Å²	8	42.1 Å²	42.1	5%	0.048	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	159	179.9	-49.9	0	0	0	0	110.9	N342 S510 V511 R513 V515	N342-V517 WeakPolarHBondContact ND2-CG1 3.45Å; N342-V517 WeakPolarHBondContact OD1-CA 3.43Å; N342-V517 WeakPolarHBondContact OD1-CB 3.49Å; N342-V517 WeakPolarHBondContact OD1-CG1 3.03Å; S510-V517 WeakPolarHBondContact CA-O 3.43Å; V511-V517 HydrophobicContact CG2-CG2 3.49Å; V511-V517 VanDerWaalsContact CG2-CG2 3.49Å; V511-V517 PolarHBondContact N-O 3.01Å; V511-V517 PolarHBondContact O-N 3.06Å; R513-V517 HydrophobicContact CG-CG1 4.19Å; R513-V517 HydrophobicContact CG-CG2 3.9Å; V515-V517 HydrophobicContact CG2-CG1 3.67Å
518	P	94.9	Very high	93.5	Very high	15 Å²	15	42.3 Å²	42.3	10%	0.097	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	143.5	168	-22.8	33.7	0	0	0	111.9	N342 T345 W346 L508 K520 V522	N342-P518 VanDerWaalsContact OD1-CD 3.23Å; N342-P518 WeakPolarHBondContact OD1-CD 3.39Å; T345-P518 HydrophobicContact CG2-CG 3.87Å; W346-P518 HydrophobicContact CH2-CB 4.39Å; W346-P518 HydrophobicContact CH2-CG 4.41Å; W346-P518 HydrophobicContact CZ2-CB 4.16Å; W346-P518 HydrophobicContact CZ2-CG 3.88Å; L508-P518 HydrophobicContact CD1-CB 4.5Å; P518-K520 PolarHBondContact O-N 2.73Å; P518-V522 HydrophobicContact CB-CG2 3.85Å; P518-V522 HydrophobicContact CG-CG2 3.92Å
519	N	93.9	Very high	93.3	Very high	73 Å²	73	43.2 Å²	43.2	39%	0.39	21%	0.205	S	C	.	.	S	Bend	trans	-72.8	-11.7	179.8	71.7	-51.9	0	0	0	114.4	K509 V511	K509-N519 HydrophobicContact CB-CB 4.4Å; K509-N519 PolarHBondContact N-OD1 3.36Å; K509-N519 WeakPolarHBondContact O-CB 3.41Å; K509-N519 PolarHBondContact O-N 3.38Å; K509-N519 PolarHBondContact O-OD1 3.11Å; V511-N519 HydrophobicContact CG1-CB 3.83Å
520	K	94.3	Very high	92.3	Very high	90 Å²	90	46.3 Å²	46.3	39%	0.391	22%	0.221	S	C	.	.	S	Bend	trans	-154.7	171.6	-177.6	61	-177	170.5	179.2	0	110.2	T505 E507 L508 P518	T505-K520 WeakPolarHBondContact O-CE 3.43Å; T505-K520 PolarHBondContact O-NZ 3.29Å; E507-K520 WeakPolarHBondContact O-CE 3.16Å; E507-K520 PolarHBondContact O-NZ 2.7Å; L508-K520 HydrophobicContact CD2-CD 4.37Å; L508-K520 HydrophobicContact CD2-CG 3.79Å; P518-K520 PolarHBondContact O-N 2.73Å
521	K	95.9	Very high	90.4	Very high	139 Å²	139	54 Å²	54	60%	0.604	27%	0.273	S	S	*	.			trans	-56.1	145.5	174.7	-61.8	-171	170.1	-167.5	0	111.2	D204	D204-K521 HydrophobicContact CB-CD 4.22Å; D204-K521 VanDerWaalsContact OD2-CD 3.29Å; D204-K521 WeakPolarHBondContact OD2-CD 3.41Å; D204-K521 WeakPolarHBondContact OD2-CE 3.44Å; D204-K521 WeakPolarHBondContact OD2-CG 3.42Å; D204-K521 IonicContact OD2-NZ 3.58Å
522	V	97	Very high	90.3	Very high	0 Å²	0	55 Å²	55	0%	0	28%	0.276	C	S	.	.			trans	-114.1	101.6	-178	-174.6	0	0	0	0	108.8	M205 T345 T505 L508 P518 L524	M205-V522 WeakPolarHBondContact CB-O 3.37Å; M205-V522 PolarHBondContact N-O 3.21Å; T345-V522 HydrophobicContact CG2-CB 4.03Å; T345-V522 HydrophobicContact CG2-CG1 4.17Å; T345-V522 HydrophobicContact CG2-CG2 3.69Å; T505-V522 HydrophobicContact CG2-CG1 4.36Å; L508-V522 HydrophobicContact CD1-CB 4.36Å; L508-V522 HydrophobicContact CD1-CG1 3.97Å; L508-V522 HydrophobicContact CD1-CG2 3.53Å; L508-V522 HydrophobicContact CD2-CG2 4.15Å; P518-V522 HydrophobicContact CB-CG2 3.85Å; P518-V522 HydrophobicContact CG-CG2 3.92Å; V522-L524 HydrophobicContact CG1-CD2 4.38Å; V522-L524 HydrophobicContact CG1-CG 4.31Å
523	G	97.4	Very high	90.4	Very high	1 Å²	1	57.8 Å²	57.8	1%	0.01	29%	0.29	C	S	.	.			trans	-86.4	130.8	173.9	0	0	0	0	0	111.1	V202 A502 T505	V202-G523 CarbonylContact O-C 3.28Å; V202-G523 VanDerWaalsContact O-CA 3.23Å; V202-G523 WeakPolarHBondContact O-CA 3.41Å; A502-G523 VanDerWaalsContact CB-C 3.43Å; A502-G523 VanDerWaalsContact CB-O 3.23Å; A502-G523 WeakPolarHBondContact CB-O 3.4Å; A502-G523 PolarHBondContact N-O 3.07Å; T505-G523 VanDerWaalsContact OG1-CA 3.22Å; T505-G523 WeakPolarHBondContact OG1-CA 3.35Å; T505-G523 PolarHBondContact OG1-N 3.4Å; T505-G523 PolarHBondContact OG1-O 2.89Å
524	L	97.8	Very high	90.9	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	145.3	176	-61.8	179.3	0	0	0	110.8	Q201 V202 M205 L348 V499 L501 V522 F526	Q201-L524 WeakPolarHBondContact CA-O 3.38Å; V202-L524 PolarHBondContact N-O 2.59Å; V202-L524 PolarHBondContact O-N 2.87Å; M205-L524 HydrophobicContact CB-CD1 4.23Å; M205-L524 HydrophobicContact CB-CG 4.46Å; M205-L524 HydrophobicContact CG-CB 3.91Å; M205-L524 HydrophobicContact CG-CD1 3.88Å; M205-L524 HydrophobicContact CG-CG 3.94Å; L348-L524 HydrophobicContact CB-CD1 3.62Å; L348-L524 HydrophobicContact CD1-CD1 3.65Å; L348-L524 HydrophobicContact CG-CD1 4.34Å; V499-L524 HydrophobicContact CG1-CB 4.22Å; V499-L524 HydrophobicContact CG1-CD1 3.91Å; V499-L524 HydrophobicContact CG1-CD2 4.29Å; V499-L524 HydrophobicContact CG1-CG 4.38Å; L501-L524 HydrophobicContact CD1-CD2 3.87Å; V522-L524 HydrophobicContact CG1-CD2 4.38Å; V522-L524 HydrophobicContact CG1-CG 4.31Å; L524-F526 HydrophobicContact CB-CD2 4.5Å; L524-F526 HydrophobicContact CB-CE2 3.77Å; L524-F526 HydrophobicContact CB-CZ 4.13Å; L524-F526 HydrophobicContact CD1-CZ 4.34Å
525	Q	97.4	Very high	91.1	Very high	38 Å²	38	57.6 Å²	57.6	18%	0.178	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	139.6	169.9	-66.8	178.6	-12.1	0	0	109.6	N200 Q201 V499 V500 A502	N200-Q525 CarbonylContact O-C 3.48Å; N200-Q525 WeakPolarHBondContact O-CA 3.28Å; Q201-Q525 HydrophobicContact CB-CG 4.05Å; Q201-Q525 HydrophobicContact CG-CG 3.97Å; V499-Q525 CarbonylContact C-O 3.59Å; V499-Q525 WeakPolarHBondContact CA-O 3.26Å; V500-Q525 HydrophobicContact CB-CB 4.27Å; V500-Q525 PolarHBondContact N-O 2.77Å; V500-Q525 PolarHBondContact O-N 3.15Å; A502-Q525 HydrophobicContact CB-CG 4.47Å
526	F	97.6	Very high	91.1	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	103.4	-179.1	-66.7	-94.9	0	0	0	108.2	L189 R193 N200 V202 M205 L348 L493 Y497 V499 L524	L189-F526 HydrophobicContact CD1-CD2 4Å; L189-F526 HydrophobicContact CD1-CE1 4.47Å; L189-F526 HydrophobicContact CD1-CE2 3.82Å; L189-F526 HydrophobicContact CD1-CG 4.41Å; L189-F526 HydrophobicContact CD1-CZ 4.08Å; L189-F526 HydrophobicContact CD2-CD1 4.27Å; L189-F526 HydrophobicContact CD2-CE1 4.26Å; R193-F526 HydrophobicContact CG-CD2 4.48Å; R193-F526 PolarHBondContact NE-O 3.19Å; R193-F526 PolarHBondContact NH2-O 3.23Å; N200-F526 PolarHBondContact O-N 2.93Å; V202-F526 HydrophobicContact CB-CE2 4.41Å; V202-F526 HydrophobicContact CG2-CD2 4.44Å; V202-F526 HydrophobicContact CG2-CE2 4.26Å; M205-F526 HydrophobicContact CE-CE2 4.25Å; M205-F526 HydrophobicContact CE-CZ 3.67Å; M205-F526 HydrophobicContact CG-CE2 4.17Å; M205-F526 HydrophobicContact CG-CZ 4.31Å; M205-F526 HydrophobicContact SD-CE2 3.58Å; M205-F526 VanDerWaalsContact SD-CE2 3.58Å; M205-F526 HydrophobicContact SD-CZ 3.65Å; L348-F526 HydrophobicContact CD1-CE1 4.19Å; L348-F526 HydrophobicContact CD1-CZ 4.11Å; L493-F526 HydrophobicContact CD2-CD1 4.5Å; L493-F526 HydrophobicContact CD2-CE1 4.01Å; Y497-F526 HydrophobicContact CD1-CB 3.98Å; Y497-F526 HydrophobicContact CD2-CB 4.4Å; Y497-F526 AromaticContact CD2-CD1 3.92Å; Y497-F526 HydrophobicContact CD2-CD1 3.92Å; Y497-F526 HydrophobicContact CG-CB 3.95Å; Y497-F526 AromaticContact CG-CD1 3.98Å; Y497-F526 HydrophobicContact CG-CD1 3.98Å; Y497-F526 HydrophobicContact CG-CG 4.45Å; V499-F526 HydrophobicContact CG1-CE1 4.36Å; V499-F526 HydrophobicContact CG2-CD1 3.95Å; V499-F526 HydrophobicContact CG2-CE1 3.88Å; L524-F526 HydrophobicContact CB-CD2 4.5Å; L524-F526 HydrophobicContact CB-CE2 3.77Å; L524-F526 HydrophobicContact CB-CZ 4.13Å; L524-F526 HydrophobicContact CD1-CZ 4.34Å
527	L	95.9	Very high	91	Very high	64 Å²	64	64.7 Å²	64.7	34%	0.335	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	128.5	178	-52	178.9	0	0	0	108.2	N200 Y497 K498 V500 R529	N200-L527 HydrophobicContact CB-CD2 4.49Å; Y497-L527 CarbonylContact C-O 3.49Å; Y497-L527 VanDerWaalsContact CA-O 3.32Å; Y497-L527 WeakPolarHBondContact CA-O 3.45Å; K498-L527 HydrophobicContact CB-CB 4.31Å; K498-L527 PolarHBondContact N-O 3.19Å; K498-L527 PolarHBondContact O-N 3.15Å; V500-L527 HydrophobicContact CG2-CD1 3.89Å; V500-L527 HydrophobicContact CG2-CG 4.42Å; L527-R529 PolarHBondContact O-N 2.95Å
528	Q	93.4	Very high	90.8	Very high	144 Å²	144	68.7 Å²	68.7	67%	0.673	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.4	131.7	-179.1	-161.9	168.2	0.6	0	0	109.9
529	R	91	Very high	90.5	Very high	30 Å²	30	72.8 Å²	72.8	11%	0.113	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-76.8	141.5	172.3	-68.6	179.3	168.2	-87.9	-1.2	108.9	E359 H362 I494 K496 Y497 K498 L527 C531	E359-R529 VanDerWaalsContact CD-NH1 3.3Å; E359-R529 IonicContact OE1-NH1 3.03Å; E359-R529 PolarHBondContact OE1-NH1 3.14Å; E359-R529 IonicContact OE2-CZ 2.63Å; E359-R529 IonicContact OE2-NH1 2.75Å; E359-R529 PolarHBondContact OE2-NH1 3.42Å; E359-R529 IonicContact OE2-NH2 3.04Å; E359-R529 PolarHBondContact OE2-NH2 3.07Å; H362-R529 WeakPolarHBondContact CD2-CD 3.48Å; H362-R529 VanDerWaalsContact CG-CZ 3.47Å; H362-R529 VanDerWaalsContact CG-NH1 3.29Å; H362-R529 PolarHBondContact ND1-NH1 3.35Å; H362-R529 VanDerWaalsContact ND1-NH1 3.2Å; H362-R529 WeakPolarHBondContact NE2-CD 3.42Å; I494-R529 WeakPolarHBondContact O-CD 3.35Å; I494-R529 PolarHBondContact O-NE 3.02Å; K496-R529 PolarHBondContact O-N 3.47Å; Y497-R529 PolarHBondContact O-NE 3.19Å; Y497-R529 VanDerWaalsContact O-NE 3.12Å; K498-R529 HydrophobicContact CB-CG 4.29Å; L527-R529 PolarHBondContact O-N 2.95Å; R529-C531 PolarHBondContact O-N 3.07Å
530	Q	70.5	Confident	90.2	Very high	195 Å²	195	72.8 Å²	72.8	91%	0.911	37%	0.365	S	S	*	.	P	Polyproline II helix	trans	-75.8	121.5	170.4	-67.9	-177.2	-10.2	0	0	107.1
531	C	54.5	Low	89.8	Confident	173 Å²	173	71.3 Å²	71.3	100%	1.169	36%	0.363	S	S	*	.			trans	-74.5	0	177.8	-63	0	0	0	0	111.7	A371 R529	A371-C531 HydrophobicContact CB-CB 4.41Å; R529-C531 PolarHBondContact O-N 3.07Å

Retrieved 531 of 531 residues in 198.6 ms (Link to these results)

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