A0A087YH78_POEFO Loading...

Nuclear pore complex protein

Functions as a component of the nuclear pore complex (NPC). Plays a role in the nuclear pore complex (NPC) assembly and/or maintenance. Required for the assembly of peripheral proteins into the NPC. May anchor NUP62 to the NPC. Involved in nephrogenesis.

AlphaFold DB , UniProt , Accession A0A087YH78, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 902 aa.

						>A0A087YH78_POEFO|A0A087YH78
MDWGQAELPSPVVRDDEVTVAARRRKKVAFPSPSASPIGPSFTPARSLRNTPASLYRQAVTPRVPDVSSILVSGSRTPRYTHTPRHNVNLEDSDWTNSLYMSPVSGLDSSSFFRDDEANLSSALLKEDDPGEDVAASLFPEFLASFLKHSSSAVFELLEDYQNICQEKVNVLQSVVLRAGQNSKTAGVRWLLQQENCTWRLIASLYRDRVQLALEEDMMIDMVVPSESEKVVVEQLFQRDAIVRQSQLVVDWLESIAKDQIGDFSDNIEYYAKNVCWENTLHALKMRSSSASDFHVPLVTELDPDAPLRQQRPLADLDREDDARLLKNLFTLIRAGMTDEAQRLCKRCGQAWRAATLEGWKLYHDPNMISGNSELQPVEGNPQRGIWKACCWRMAEEEQLNRYERAIYASLSGNIKPILAVCESWEDCVWAYFRVMVDSLVEKDLMSSGMTHQELETLPREYLEANWTMEKVFEELQASESKRVLEETREHFHVIQKFVILGDLDGLMEEFSDWLTASKPLPLHLLRFMTHLVLFFRSLGLALKEEACVDVLKAYVSLLIRDQQTDLVASYVGQLPAALATNQYAAFLETVSQPEQRPRCLQLATAAGLDVSAITRLVVETVRRRDDAGFTHHSQTLETGTTQDDQKKIDVIDWLLFDPAHRAEALKQSNAIMRNFLALQKHDAAKAVFSKVPEDSMREIYSQWTAVGQTAPLPAEDENAIREHLCIRAYLEAHEAFTDWFSHSSSAPQRPALAPEAKFTERVANEMKEKEYQASRTEWSSRLDVLTEDVKERIYNVLLFVDGGWMVDNREESEPDEERSHQMAALRSLCLPRLTFLLLSVLQSSSRHQEVLRLADIISSDQHKLYQVFSKEELRRFLQKLRDSSLALLDQGLGPLGYDLQP
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.8	Very low	25.7	Very low	235 Å²	235	133.9 Å²	133.9	100%	1.158	73%	0.726	S	S	*	*				0	109.3	0	-52.9	179.5	-162.2	0	0	106.9
2	D	27.6	Very low	26.1	Very low	163 Å²	163	131.5 Å²	131.5	87%	0.872	72%	0.718	S	S	*	*			cis	-135.7	121	3.8	-160.3	22.8	0	0	0	108.4
3	W	24.3	Very low	26.8	Very low	232 Å²	232	122.8 Å²	122.8	88%	0.879	67%	0.672	S	S	*	*			trans	-120.3	112.6	-177.3	-75	110.9	0	0	0	107.6
4	G	22.6	Very low	28.1	Very low	72 Å²	72	118.3 Å²	118.3	74%	0.742	64%	0.64	S	S	*	*			trans	-64.4	140.7	177	0	0	0	0	0	110.9	A6	G4-A6 PolarHBondContact O-N 3.18Å; G4-A6 VanDerWaalsContact O-N 3.07Å
5	Q	25.3	Very low	28.1	Very low	190 Å²	190	115.8 Å²	115.8	89%	0.888	63%	0.626	S	S	*	*			trans	-57.6	112.9	176.4	-67.2	164.4	-81	0	0	109.7
6	A	22.8	Very low	28.4	Very low	87 Å²	87	114.4 Å²	114.4	72%	0.719	62%	0.618	S	S	*	*			trans	-99.9	99.1	162.8	0	0	0	0	0	106.4	G4 L8	G4-A6 PolarHBondContact O-N 3.18Å; G4-A6 VanDerWaalsContact O-N 3.07Å; A6-L8 PolarHBondContact O-N 2.61Å
7	E	24	Very low	28.3	Very low	182 Å²	182	117.5 Å²	117.5	85%	0.85	63%	0.628	S	S	*	*			trans	-61.9	107	171.6	-67.3	170.9	152.6	0	0	108
8	L	26.9	Very low	28.2	Very low	132 Å²	132	118.6 Å²	118.6	69%	0.691	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-83.2	137.5	168.6	-74.7	170.4	0	0	0	108	A6	A6-L8 PolarHBondContact O-N 2.61Å
9	P	25.4	Very low	27.9	Very low	112 Å²	112	118.8 Å²	118.8	73%	0.727	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-66.7	144.5	-177.8	27.9	-34.5	0	0	0	111.1
10	S	25.6	Very low	27.8	Very low	30 Å²	30	120.7 Å²	120.7	21%	0.21	66%	0.66	C	S	.	*	P	Polyproline II helix	trans	-49.8	160.8	163.5	-127.2	0	0	0	0	111.3	V12 Q238	S10-V12 PolarHBondContact O-N 3.48Å; S10-Q238 VanDerWaalsContact OG-CG 3.28Å; S10-Q238 WeakPolarHBondContact OG-CG 3.42Å; S10-Q238 PolarHBondContact OG-NE2 3.25Å
11	P	27.2	Very low	27.6	Very low	38 Å²	38	119.3 Å²	119.3	25%	0.247	67%	0.665	C	S	.	*	S	Bend	trans	-48.7	127.2	157.4	-16.8	27.4	0	0	0	108.3	V13 F237 R244	P11-V13 PolarHBondContact O-N 3.06Å; P11-F237 HydrophobicContact CB-CD1 4.45Å; P11-F237 HydrophobicContact CG-CB 4.43Å; P11-R244 HydrophobicContact CB-CG 4.28Å; P11-R244 HydrophobicContact CG-CG 3.5Å
12	V	30.5	Very low	27.3	Very low	105 Å²	105	113 Å²	113	64%	0.636	65%	0.65	S	S	*	*			trans	-71	98.6	-163.2	-175.8	0	0	0	0	110.2	S10 R14	S10-V12 PolarHBondContact O-N 3.48Å; V12-R14 PolarHBondContact O-N 3.33Å
13	V	36	Very low	27.3	Very low	19 Å²	19	117.3 Å²	117.3	12%	0.115	65%	0.654	C	S	.	*			trans	-56	109.9	156.5	177.6	0	0	0	0	105.6	P11 D15 K230 V233 E234 F237 L362	P11-V13 PolarHBondContact O-N 3.06Å; V13-D15 PolarHBondContact O-N 2.69Å; V13-K230 HydrophobicContact CG1-CG 4.15Å; V13-V233 HydrophobicContact CG1-CG1 4.38Å; V13-V233 HydrophobicContact CG2-CG1 4Å; V13-E234 HydrophobicContact CB-CG 3.93Å; V13-E234 HydrophobicContact CG1-CG 4.45Å; V13-E234 HydrophobicContact CG2-CB 4.41Å; V13-E234 HydrophobicContact CG2-CG 3.67Å; V13-F237 HydrophobicContact CG2-CD2 3.65Å; V13-F237 HydrophobicContact CG2-CE2 4.19Å; V13-L362 HydrophobicContact CG1-CD1 3.78Å
14	R	44.6	Very low	27.6	Very low	59 Å²	59	117.8 Å²	117.8	22%	0.223	66%	0.656	C	S	.	*	S	Bend	trans	-53.2	96.7	-153.5	-74.9	-176.2	178.8	167.6	3.1	114.5	V12 E254 W360	V12-R14 PolarHBondContact O-N 3.33Å; R14-E254 IonicContact CZ-OE1 3.01Å; R14-E254 IonicContact CZ-OE2 2.7Å; R14-E254 IonicContact NH2-OE1 3.25Å; R14-E254 PolarHBondContact NH2-OE1 3.37Å; R14-E254 IonicContact NH2-OE2 3.61Å; R14-E254 PolarHBondContact NH2-OE2 3.07Å; R14-W360 HydrophobicContact CB-CH2 3.92Å; R14-W360 HydrophobicContact CB-CZ3 4.44Å; R14-W360 HydrophobicContact CG-CH2 4.42Å
15	D	27.9	Very low	27.8	Very low	81 Å²	81	125.8 Å²	125.8	43%	0.433	66%	0.663	S	S	.	*			trans	-103.5	158.2	172	-94.5	6	0	0	0	112.6	V13 K230	V13-D15 PolarHBondContact O-N 2.69Å; D15-K230 VanDerWaalsContact CG-CE 3.48Å; D15-K230 WeakPolarHBondContact OD1-CE 3.41Å; D15-K230 IonicContact OD1-NZ 3.84Å; D15-K230 PolarHBondContact OD1-NZ 3.42Å; D15-K230 VanDerWaalsContact OD2-CE 3.27Å; D15-K230 WeakPolarHBondContact OD2-CE 3.27Å; D15-K230 IonicContact OD2-NZ 2.64Å; D15-K230 PolarHBondContact OD2-NZ 2.81Å
16	D	33	Very low	27.8	Very low	94 Å²	94	126 Å²	126	50%	0.503	66%	0.661	S	S	.	*			trans	-82.6	136.7	-164.1	-65.8	-39.1	0	0	0	113.9	K361	D16-K361 IonicContact OD1-NZ 2.71Å; D16-K361 PolarHBondContact OD1-NZ 3.05Å; D16-K361 IonicContact OD2-NZ 3.79Å; D16-K361 PolarHBondContact OD2-NZ 3.29Å
17	E	27.2	Very low	28.1	Very low	167 Å²	167	132.1 Å²	132.1	78%	0.78	67%	0.672	S	S	*	*			trans	63.2	124	170	-55.2	-162.8	160.5	0	0	119.6
18	V	25.1	Very low	28.2	Very low	136 Å²	136	130.2 Å²	130.2	82%	0.824	67%	0.672	S	S	*	*				-171.2	140.3	106.4	144.3	0	0	0	0	111.1
19	T	24.2	Very low	28.1	Very low	124 Å²	124	128.2 Å²	128.2	76%	0.761	68%	0.675	S	S	*	*			trans	-84.3	142.2	176.6	44.5	0	0	0	0	113.1	A21	T19-A21 PolarHBondContact O-N 3.4Å
20	V	24.8	Very low	28	Very low	156 Å²	156	132.4 Å²	132.4	95%	0.945	68%	0.682	S	S	*	*	S	Bend	trans	-74.5	93.6	-179.2	-178.9	0	0	0	0	110.9
21	A	24.8	Very low	28.4	Very low	92 Å²	92	136.2 Å²	136.2	76%	0.76	71%	0.706	S	S	*	*			trans	-142	13.2	-177.1	0	0	0	0	0	116.8	T19	T19-A21 PolarHBondContact O-N 3.4Å
22	A	23.6	Very low	28.2	Very low	101 Å²	101	140.2 Å²	140.2	84%	0.835	74%	0.735	S	S	*	*			trans	-151.8	59	-174	0	0	0	0	0	118.3
23	R	26.9	Very low	28.5	Very low	254 Å²	254	140.9 Å²	140.9	96%	0.958	74%	0.741	S	S	*	*			trans	-110	82.1	166.8	-80.3	-171.1	175.5	-178.3	0.4	113.7
24	R	31.9	Very low	28	Very low	243 Å²	243	145.5 Å²	145.5	92%	0.917	77%	0.774	S	S	*	*			trans	-146.6	86.1	163.9	-84.5	-164.4	174.5	-177.8	-0.1	114.1
25	R	25	Very low	27.1	Very low	239 Å²	239	147.5 Å²	147.5	90%	0.902	80%	0.804	S	S	*	*			trans	-164.7	106.6	153.9	-97.5	143.6	-163.8	-144.1	5.3	106.6
26	K	26.5	Very low	27.2	Very low	195 Å²	195	149.1 Å²	149.1	85%	0.848	82%	0.821	S	S	*	*				92.2	111.7	82.2	-96.3	-162.4	172.2	-169.9	0	111.8
27	K	29.3	Very low	27.8	Very low	216 Å²	216	150 Å²	150	94%	0.939	83%	0.832	S	S	*	*			trans	-55.6	142	171.4	-60.4	-177.9	176.6	-172.9	0	111.2
28	V	25.6	Very low	27.9	Very low	141 Å²	141	150.4 Å²	150.4	86%	0.855	84%	0.838	S	S	*	*			trans	-137.3	138.9	162.3	-176.8	0	0	0	0	107.3
29	A	25.1	Very low	28	Very low	91 Å²	91	146.9 Å²	146.9	75%	0.752	83%	0.829	S	S	*	*			trans	-106.6	156.3	178	0	0	0	0	0	111
30	F	23.8	Very low	28.7	Very low	199 Å²	199	146.8 Å²	146.8	87%	0.873	83%	0.831	S	S	*	*			trans	-76.3	157	178.6	-83.5	-88.2	0	0	0	113
31	P	32.7	Very low	28.7	Very low	111 Å²	111	143.8 Å²	143.8	72%	0.721	82%	0.817	S	S	*	*			trans	-106.6	172.7	-158.4	40.8	-36.1	0	0	0	115.4
32	S	23.8	Very low	28.8	Very low	121 Å²	121	148.7 Å²	148.7	85%	0.846	82%	0.821	S	S	*	*			trans	-152.7	159.3	160.2	-87.3	0	0	0	0	110.7
33	P	36.4	Very low	28.9	Very low	119 Å²	119	149.8 Å²	149.8	77%	0.773	82%	0.818	S	S	*	*			trans	-115.6	159.1	-131.3	39.9	-35.5	0	0	0	116.6
34	S	25.4	Very low	29.6	Very low	116 Å²	116	143.4 Å²	143.4	81%	0.811	81%	0.809	S	S	*	*			trans	-177.9	163.4	139.1	49.4	0	0	0	0	113.7
35	A	26.9	Very low	29.2	Very low	102 Å²	102	135.9 Å²	135.9	84%	0.843	80%	0.799	S	S	*	*			trans	69.6	158.3	161.8	0	0	0	0	0	119.1
36	S	28.7	Very low	29.4	Very low	115 Å²	115	135.7 Å²	135.7	80%	0.804	80%	0.798	S	S	*	*			trans	-143.8	-162.3	-164.9	64.4	0	0	0	0	111.4
37	P	45.8	Very low	29.3	Very low	111 Å²	111	131.4 Å²	131.4	72%	0.721	79%	0.793	S	S	*	*				-111.1	171.2	-116.6	40.6	-27.5	0	0	0	115.2
38	I	29.8	Very low	29.2	Very low	176 Å²	176	127.8 Å²	127.8	90%	0.903	78%	0.783	S	S	*	*			trans	-159.3	153.4	152.2	-102.1	145.2	0	0	0	109.1
39	G	27.1	Very low	29.3	Very low	62 Å²	62	132.6 Å²	132.6	64%	0.639	79%	0.786	S	S	*	*			trans	-98.2	-130.4	-173.7	0	0	0	0	0	115.9
40	P	38.3	Very low	29.4	Very low	123 Å²	123	135.1 Å²	135.1	80%	0.799	79%	0.786	S	S	*	*				-127.9	-172.2	-108.7	40.7	-28.9	0	0	0	115.1
41	S	25.6	Very low	29.6	Very low	93 Å²	93	132.1 Å²	132.1	65%	0.65	79%	0.785	S	S	*	*			trans	115.5	157	143.9	74.3	0	0	0	0	120.6
42	F	26	Very low	30	Very low	194 Å²	194	132.3 Å²	132.3	85%	0.851	79%	0.786	S	S	*	*			trans	85.1	104.9	165.9	-63.5	-69.1	0	0	0	123
43	T	27.3	Very low	30.1	Very low	125 Å²	125	130.9 Å²	130.9	77%	0.767	78%	0.781	S	S	*	*			trans	-67.4	178.6	144.4	52.6	0	0	0	0	111.6
44	P	39.6	Very low	29.6	Very low	119 Å²	119	130.2 Å²	130.2	77%	0.773	78%	0.78	S	S	*	*			cis	-156	-158.2	30.1	45.8	-21.9	0	0	0	118.8
45	A	25.2	Very low	29.8	Very low	85 Å²	85	131.9 Å²	131.9	70%	0.702	78%	0.778	S	S	*	*			trans	80.6	120.1	162.3	0	0	0	0	0	118.2
46	R	27.5	Very low	29.8	Very low	236 Å²	236	136 Å²	136	89%	0.891	77%	0.773	S	S	*	*				69.5	142.1	75.8	-81.1	-176	168.2	-177.8	-2.8	113.5
47	S	26.1	Very low	29.7	Very low	105 Å²	105	140.6 Å²	140.6	73%	0.734	77%	0.773	S	S	*	*			cis	-152	142.6	22.8	49.1	0	0	0	0	112.2
48	L	27.1	Very low	28.8	Very low	139 Å²	139	144.5 Å²	144.5	73%	0.728	78%	0.782	S	S	*	*				66.4	106.3	77	-100.3	176	0	0	0	118.3
49	R	26.8	Very low	28.6	Very low	243 Å²	243	140.6 Å²	140.6	92%	0.917	78%	0.776	S	S	*	*			trans	178.4	122.3	146	-99.2	174.8	-179.6	-161.4	-0.8	107.5
50	N	27	Very low	28.6	Very low	144 Å²	144	144.3 Å²	144.3	77%	0.77	79%	0.786	S	S	*	*				91.4	128.3	57.2	-77.3	27.1	0	0	0	114.7
51	T	28.6	Very low	28	Very low	136 Å²	136	144 Å²	144	83%	0.834	78%	0.782	S	S	*	*			trans	-89	-163.9	-172	53.3	0	0	0	0	112
52	P	41.1	Very low	28.1	Very low	114 Å²	114	145.5 Å²	145.5	74%	0.74	79%	0.79	S	S	*	*			cis	-142.6	175.9	-0.4	39.6	-18.2	0	0	0	119.2
53	A	25.2	Very low	28.2	Very low	91 Å²	91	148 Å²	148	75%	0.752	79%	0.793	S	S	*	*			trans	45.8	138.5	146.4	0	0	0	0	0	122.3
54	S	27.5	Very low	28.3	Very low	106 Å²	106	148.6 Å²	148.6	74%	0.741	80%	0.797	S	S	*	*				166	-177	70.6	50.3	0	0	0	0	109.8
55	L	28.9	Very low	27.9	Very low	150 Å²	150	148.7 Å²	148.7	79%	0.785	80%	0.797	S	S	*	*			cis	-150.4	151.4	11.7	-87.4	179.2	0	0	0	112.7
56	Y	27.3	Very low	27.9	Very low	188 Å²	188	152.4 Å²	152.4	74%	0.737	81%	0.805	S	S	*	*			trans	36.6	124.8	142.6	-84.8	-105.3	0	0	0	126.9
57	R	26.4	Very low	27.8	Very low	213 Å²	213	147 Å²	147	80%	0.804	80%	0.798	S	S	*	*			trans	42.1	129.1	134.6	-69.1	-172.1	-174.3	-179.4	-0.1	122.5
58	Q	27.3	Very low	27.8	Very low	192 Å²	192	147.4 Å²	147.4	90%	0.897	80%	0.801	S	S	*	*				-168.4	168.9	95.5	-108.4	-177.2	-10.9	0	0	112.5
59	A	25.8	Very low	27.7	Very low	95 Å²	95	145.4 Å²	145.4	79%	0.785	80%	0.798	S	S	*	*			trans	-142.7	141.9	178.9	0	0	0	0	0	111.6
60	V	26.2	Very low	27.8	Very low	139 Å²	139	141 Å²	141	84%	0.842	79%	0.792	S	S	*	*			trans	-145.5	154.2	174.2	179.4	0	0	0	0	110
61	T	26.2	Very low	27.6	Very low	118 Å²	118	141.1 Å²	141.1	72%	0.724	79%	0.791	S	S	*	*			trans	-70.5	157.8	-168.6	50.6	0	0	0	0	117.1
62	P	28.1	Very low	27.5	Very low	124 Å²	124	141 Å²	141	81%	0.805	79%	0.79	S	S	*	*			trans	-69.5	168.8	166	32.7	-36.7	0	0	0	112.6
63	R	27.5	Very low	26.7	Very low	246 Å²	246	140.8 Å²	140.8	93%	0.928	79%	0.791	S	S	*	*			trans	-113.9	144.5	177.3	-80.2	-179	169.4	158.7	-3.3	112.2
64	V	29.2	Very low	26.6	Very low	138 Å²	138	140.1 Å²	140.1	84%	0.836	79%	0.794	S	S	*	*			trans	-111.5	141.3	172.1	-179.6	0	0	0	0	108.9
65	P	30.3	Very low	26.4	Very low	120 Å²	120	140.2 Å²	140.2	78%	0.779	79%	0.794	S	S	*	*			trans	-89.7	141.4	163.4	-0.6	20.6	0	0	0	111.4
66	D	24.8	Very low	26.3	Very low	164 Å²	164	144.5 Å²	144.5	88%	0.877	80%	0.8	S	S	*	*			trans	-97	174	-169.7	-145.9	-23.7	0	0	0	114
67	V	27	Very low	26.1	Very low	122 Å²	122	142 Å²	142	74%	0.739	80%	0.804	S	S	*	*			trans	-114.2	154.5	-166.3	179.1	0	0	0	0	113.6
68	S	25.7	Very low	26.4	Very low	113 Å²	113	136.9 Å²	136.9	79%	0.79	80%	0.799	S	S	*	*			trans	82.9	156.6	168.9	88.5	0	0	0	0	116.1
69	S	25.6	Very low	26.2	Very low	97 Å²	97	138 Å²	138	68%	0.678	80%	0.795	S	S	*	*			cis	-155.9	-170.5	15.1	53.5	0	0	0	0	112.5
70	I	27.6	Very low	26	Very low	152 Å²	152	143 Å²	143	78%	0.779	80%	0.795	S	S	*	*			trans	84.4	131.7	169.1	-51.4	171.9	0	0	0	116.3
71	L	24	Very low	25.9	Very low	145 Å²	145	141.1 Å²	141.1	76%	0.759	78%	0.784	S	S	*	*			cis	-178	145.3	-38.4	-107.9	166.1	0	0	0	109.9
72	V	25	Very low	25.8	Very low	133 Å²	133	143.7 Å²	143.7	81%	0.806	79%	0.787	S	S	*	*			trans	70.6	145.5	156.6	176.7	0	0	0	0	116.5
73	S	24.3	Very low	25.7	Very low	110 Å²	110	143.5 Å²	143.5	77%	0.769	78%	0.784	S	S	*	*			cis	-148.1	148.9	3.6	36	0	0	0	0	114.2
74	G	23.5	Very low	25.6	Very low	78 Å²	78	137.2 Å²	137.2	80%	0.804	78%	0.775	S	S	*	*			trans	81.7	149.8	146.7	0	0	0	0	0	118.7
75	S	24.5	Very low	25.3	Very low	108 Å²	108	141 Å²	141	76%	0.755	77%	0.774	S	S	*	*			cis	-161	160	-8.9	74.4	0	0	0	0	113.1
76	R	25.7	Very low	25.1	Very low	240 Å²	240	143.5 Å²	143.5	91%	0.906	78%	0.775	S	S	*	*			trans	68.3	105	161.8	-68.5	-178	171.1	178.2	-2.5	120.4
77	T	23.1	Very low	25	Very low	134 Å²	134	142 Å²	142	82%	0.822	77%	0.767	S	S	*	*			trans	-68.6	176.6	145.3	47.4	0	0	0	0	110.8
78	P	32.4	Very low	24.9	Very low	106 Å²	106	140.8 Å²	140.8	69%	0.688	76%	0.76	S	S	*	*			cis	-147.8	178.9	24.9	44.9	-24.3	0	0	0	119.9
79	R	23	Very low	24.8	Very low	215 Å²	215	141.4 Å²	141.4	81%	0.811	75%	0.754	S	S	*	*			trans	20.2	137.5	144.4	-57.4	172.7	177.8	161.2	-3.8	118.4
80	Y	23	Very low	24.9	Very low	200 Å²	200	143.8 Å²	143.8	78%	0.784	76%	0.759	S	S	*	*				-155.6	174.5	53.6	-120.9	-84.8	0	0	0	113.7
81	T	24.1	Very low	24.7	Very low	100 Å²	100	144.3 Å²	144.3	61%	0.613	76%	0.758	S	S	*	*			trans	-34.9	143.6	174.7	50.5	0	0	0	0	118.2
82	H	24.1	Very low	25	Very low	173 Å²	173	144.7 Å²	144.7	80%	0.801	76%	0.761	S	S	*	*				-162.2	152	106.9	-110	-74	0	0	0	113.2
83	T	25	Very low	25.2	Very low	120 Å²	120	142.4 Å²	142.4	74%	0.736	75%	0.75	S	S	*	*			trans	-79.8	129.7	170	37.9	0	0	0	0	111.1	R85	T83-R85 PolarHBondContact O-N 3.29Å
84	P	24.8	Very low	25.7	Very low	113 Å²	113	141.5 Å²	141.5	73%	0.734	74%	0.737	S	S	*	*			trans	-80.9	105.6	166.6	31	-29.7	0	0	0	109.6	H86	P84-H86 PolarHBondContact O-N 3.16Å
85	R	23.4	Very low	26.2	Very low	218 Å²	218	145.2 Å²	145.2	82%	0.823	73%	0.727	S	S	*	*			trans	-61.2	126.5	158.7	-77.9	177.2	167.4	168.8	-7	107.9	T83 N87	T83-R85 PolarHBondContact O-N 3.29Å; R85-N87 PolarHBondContact O-N 2.91Å
86	H	25.5	Very low	26.9	Very low	173 Å²	173	143.4 Å²	143.4	80%	0.801	71%	0.711	S	S	*	*			trans	-76.1	73.6	162	-93	36.1	0	0	0	109.8	P84 V88	P84-H86 PolarHBondContact O-N 3.16Å; H86-V88 PolarHBondContact O-N 3.4Å
87	N	24.3	Very low	27.4	Very low	132 Å²	132	135 Å²	135	71%	0.706	68%	0.684	S	S	*	*			trans	-83.5	89.2	153.4	-103.4	74.1	0	0	0	106.4	R85	R85-N87 PolarHBondContact O-N 2.91Å
88	V	25.3	Very low	27.8	Very low	97 Å²	97	132.6 Å²	132.6	59%	0.588	67%	0.673	S	S	*	*			trans	-91	122	160.7	-176.7	0	0	0	0	105.8	H86 L90	H86-V88 PolarHBondContact O-N 3.4Å; V88-L90 HydrophobicContact CB-CD1 4.37Å; V88-L90 HydrophobicContact CG1-CD1 4.25Å; V88-L90 PolarHBondContact O-N 3.44Å
89	N	22.1	Very low	28.1	Very low	126 Å²	126	128.8 Å²	128.8	67%	0.674	65%	0.647	S	S	*	*			trans	-69	110.8	164.6	-77	12	0	0	0	106.8	E91	N89-E91 PolarHBondContact O-N 3.49Å
90	L	28.2	Very low	29.5	Very low	147 Å²	147	124.9 Å²	124.9	77%	0.77	63%	0.633	S	S	*	*			trans	-81	99.2	159.6	-81.5	79.2	0	0	0	106.8	V88	V88-L90 HydrophobicContact CB-CD1 4.37Å; V88-L90 HydrophobicContact CG1-CD1 4.25Å; V88-L90 PolarHBondContact O-N 3.44Å
91	E	23.4	Very low	29.6	Very low	162 Å²	162	123.4 Å²	123.4	76%	0.757	64%	0.635	S	S	*	*			trans	-105.5	120.4	156.5	-70.8	177.5	143.8	0	0	106.4	N89	N89-E91 PolarHBondContact O-N 3.49Å
92	D	30.9	Very low	29.6	Very low	154 Å²	154	124 Å²	124	82%	0.824	64%	0.643	S	S	*	*			trans	40.9	76.6	164.3	-53.8	-13.8	0	0	0	118.1	D94	D92-D94 PolarHBondContact O-N 2.95Å
93	S	28.7	Very low	29.9	Very low	85 Å²	85	120.1 Å²	120.1	59%	0.594	63%	0.633	S	S	*	*			trans	-80.2	59	165.9	60.8	0	0	0	0	112.2	W95	S93-W95 VanDerWaalsContact O-CD1 3.22Å; S93-W95 PolarHBondContact O-N 3.01Å
94	D	34.6	Very low	30	Very low	90 Å²	90	120.5 Å²	120.5	48%	0.481	64%	0.636	S	S	.	*			trans	-81.3	52.9	-169.1	-164.9	21.7	0	0	0	113	D92 T96 N97	D92-D94 PolarHBondContact O-N 2.95Å; D94-T96 VanDerWaalsContact C-N 3.3Å; D94-T96 PolarHBondContact O-N 2.68Å; D94-N97 PolarHBondContact O-N 3.09Å; D94-N97 VanDerWaalsContact O-N 3.11Å; D94-N97 PolarHBondContact OD1-ND2 2.98Å; D94-N97 PolarHBondContact OD2-ND2 3Å
95	W	34.8	Very low	30.2	Very low	156 Å²	156	120.9 Å²	120.9	59%	0.591	64%	0.641	S	S	*	*	G	3₁₀ helix	trans	-63	-27.6	-166.6	-71.5	103.5	0	0	0	115.1	S93 N97 S98	S93-W95 VanDerWaalsContact O-CD1 3.22Å; S93-W95 PolarHBondContact O-N 3.01Å; W95-N97 VanDerWaalsContact C-N 3.27Å; W95-N97 PolarHBondContact O-N 3.13Å; W95-S98 PolarHBondContact O-N 3.5Å
96	T	39.2	Very low	30.3	Very low	71 Å²	71	113.6 Å²	113.6	44%	0.436	63%	0.634	S	S	.	*	G	3₁₀ helix	trans	-63.3	-33.6	175.9	50.1	0	0	0	0	111.9	D94 Y100	D94-T96 VanDerWaalsContact C-N 3.3Å; D94-T96 PolarHBondContact O-N 2.68Å; T96-Y100 WeakPolarHBondContact O-CE2 3.37Å
97	N	35.8	Very low	30.4	Very low	63 Å²	63	113.6 Å²	113.6	34%	0.337	64%	0.639	S	S	.	*	G	3₁₀ helix	trans	-80	-13.8	-179.4	-71.4	-41	0	0	0	113.9	D94 W95 K519	D94-N97 PolarHBondContact O-N 3.09Å; D94-N97 VanDerWaalsContact O-N 3.11Å; D94-N97 PolarHBondContact OD1-ND2 2.98Å; D94-N97 PolarHBondContact OD2-ND2 3Å; W95-N97 VanDerWaalsContact C-N 3.27Å; W95-N97 PolarHBondContact O-N 3.13Å; N97-K519 VanDerWaalsContact CG-NZ 3.28Å; N97-K519 PolarHBondContact ND2-NZ 3.4Å; N97-K519 PolarHBondContact OD1-NZ 2.95Å
98	S	30.9	Very low	30.8	Very low	83 Å²	83	114 Å²	114	58%	0.58	64%	0.641	S	S	*	*	G	3₁₀ helix	trans	-93.8	7.7	-172.1	-164.3	0	0	0	0	115	W95	W95-S98 PolarHBondContact O-N 3.5Å
99	L	38.6	Very low	30.7	Very low	27 Å²	27	114.1 Å²	114.1	14%	0.141	65%	0.646	C	S	.	*	G	3₁₀ helix	trans	-82.8	-20.6	-177.9	-80.8	160.4	0	0	0	114.2	M101 K184	L99-M101 PolarHBondContact O-N 3.23Å; L99-K184 HydrophobicContact CD2-CB 3.83Å; L99-K184 HydrophobicContact CD2-CD 4Å; L99-K184 HydrophobicContact CD2-CG 3.66Å; L99-K184 PolarHBondContact O-NZ 2.99Å
100	Y	52.3	Low	31.1	Very low	132 Å²	132	113.7 Å²	113.7	52%	0.518	65%	0.653	S	S	.	*			trans	-102.6	87.3	-154.7	-51.7	-58.8	0	0	0	115.4	T96	T96-Y100 WeakPolarHBondContact O-CE2 3.37Å
101	M	24.6	Very low	31.4	Very low	169 Å²	169	111.8 Å²	111.8	83%	0.833	65%	0.652	S	S	*	*			trans	-153.9	120.8	163.9	-121.7	-177.1	68.4	0	0	110.6	L99	L99-M101 PolarHBondContact O-N 3.23Å
102	S	26.2	Very low	31.9	Very low	112 Å²	112	111.1 Å²	111.1	78%	0.783	65%	0.647	S	S	*	*			trans	-88.5	136.7	-176.7	-51.5	0	0	0	0	113.3
103	P	28.6	Very low	32.2	Very low	92 Å²	92	111.9 Å²	111.9	60%	0.597	64%	0.643	S	S	*	*			trans	-75.6	-177.9	150.9	-9.3	27.7	0	0	0	111.2
104	V	27.4	Very low	32.5	Very low	129 Å²	129	118.9 Å²	118.9	78%	0.782	66%	0.656	S	S	*	*			trans	-131.6	129	-172.4	173.6	0	0	0	0	112.7
105	S	28.9	Very low	32.6	Very low	120 Å²	120	121.9 Å²	121.9	84%	0.839	67%	0.672	S	S	*	*			trans	69.2	147.9	158.3	72.7	0	0	0	0	120.4
106	G	25.2	Very low	32.6	Very low	66 Å²	66	120.3 Å²	120.3	68%	0.68	68%	0.676	S	S	*	*			trans	158	52.6	149.9	0	0	0	0	0	123
107	L	27.7	Very low	32.6	Very low	172 Å²	172	125 Å²	125	90%	0.901	69%	0.693	S	S	*	*			trans	65.6	162.5	162.5	-86.1	86.7	0	0	0	119.9
108	D	32.5	Very low	32.8	Very low	142 Å²	142	125.2 Å²	125.2	76%	0.759	70%	0.703	S	S	*	*			trans	-60.7	143.2	-175.3	-55.2	-73.6	0	0	0	115.8
109	S	24.8	Very low	33.4	Very low	98 Å²	98	125.6 Å²	125.6	69%	0.685	70%	0.698	S	S	*	*			trans	-157.8	63.8	160.4	-80.7	0	0	0	0	112.2	S111	S109-S111 VanDerWaalsContact C-N 3.26Å; S109-S111 PolarHBondContact O-N 3.03Å
110	S	30.1	Very low	33.7	Very low	117 Å²	117	126.6 Å²	126.6	82%	0.818	70%	0.704	S	S	*	*			trans	-76.5	57.1	-176.3	49.1	0	0	0	0	115
111	S	35.2	Very low	33.1	Very low	107 Å²	107	124.1 Å²	124.1	75%	0.748	71%	0.706	S	S	*	*			trans	175.1	109.5	150	37.2	0	0	0	0	112.1	S109	S109-S111 VanDerWaalsContact C-N 3.26Å; S109-S111 PolarHBondContact O-N 3.03Å
112	F	33.9	Very low	33.8	Very low	149 Å²	149	119.3 Å²	119.3	65%	0.654	69%	0.689	S	S	*	*			trans	-142.8	11.8	176.6	-107.1	-72.8	0	0	0	117.2
113	F	36.1	Very low	34.6	Very low	170 Å²	170	115.9 Å²	115.9	75%	0.746	67%	0.667	S	S	*	*			trans	-128.1	72.2	173.2	-66.6	-69	0	0	0	112.7	L120	F113-L120 HydrophobicContact CE1-CD1 4.25Å
114	R	34.8	Very low	35.5	Very low	232 Å²	232	116.7 Å²	116.7	88%	0.875	67%	0.666	S	S	*	*	S	Bend	trans	-137	125.4	149.4	-73.9	-165.4	172.3	-173.9	-2.8	108.7
115	D	38.1	Very low	36.2	Very low	152 Å²	152	117.6 Å²	117.6	81%	0.813	67%	0.666	S	S	*	*	S	Bend	trans	50.6	81	165.7	-49.5	-27.6	0	0	0	117.1
116	D	34	Very low	37	Very low	124 Å²	124	118.5 Å²	118.5	66%	0.663	66%	0.655	S	S	*	*			trans	-178.5	125.8	134.1	-101.2	-22.8	0	0	0	112.7	A118 N119	D116-A118 PolarHBondContact O-N 2.81Å; D116-A118 VanDerWaalsContact O-N 3.17Å; D116-N119 PolarHBondContact O-N 3.3Å
117	E	39.8	Very low	38	Very low	170 Å²	170	124.8 Å²	124.8	79%	0.794	67%	0.666	S	S	*	*	G	3₁₀ helix	trans	-61.3	-24	175.9	-72.2	-168.4	99	0	0	113.4	N119	E117-N119 VanDerWaalsContact C-N 3.3Å; E117-N119 PolarHBondContact O-N 3.24Å
118	A	39.5	Very low	39.3	Very low	67 Å²	67	120.4 Å²	120.4	55%	0.554	64%	0.644	S	S	*	*	G	3₁₀ helix	trans	-62.5	-33.6	-176.3	0	0	0	0	0	113.2	D116 L120 S121	D116-A118 PolarHBondContact O-N 2.81Å; D116-A118 VanDerWaalsContact O-N 3.17Å; A118-L120 PolarHBondContact O-N 2.98Å; A118-S121 WeakPolarHBondContact O-CB 3.33Å; A118-S121 PolarHBondContact O-N 3.3Å; A118-S121 PolarHBondContact O-OG 3.24Å
119	N	43.8	Very low	41.1	Very low	90 Å²	90	115 Å²	115	48%	0.481	62%	0.615	S	S	.	*	G	3₁₀ helix	trans	-73.4	-22.4	-173.5	-81.7	-29.8	0	0	0	114.1	D116 E117 S121 S122	D116-N119 PolarHBondContact O-N 3.3Å; E117-N119 VanDerWaalsContact C-N 3.3Å; E117-N119 PolarHBondContact O-N 3.24Å; N119-S121 PolarHBondContact O-N 2.98Å; N119-S121 VanDerWaalsContact O-N 3.14Å; N119-S122 WeakPolarHBondContact O-CB 3.39Å; N119-S122 PolarHBondContact O-N 3.22Å
120	L	44.5	Very low	43.5	Very low	48 Å²	48	111.8 Å²	111.8	25%	0.251	59%	0.591	S	S	.	*	H	α-helix	trans	-59.9	-26.5	175.2	-109	74.8	0	0	0	112.6	F113 A118 S122 A123	F113-L120 HydrophobicContact CE1-CD1 4.25Å; A118-L120 PolarHBondContact O-N 2.98Å; L120-S122 PolarHBondContact O-N 2.83Å; L120-A123 PolarHBondContact O-N 3.01Å
121	S	40.1	Very low	45.6	Very low	80 Å²	80	106.2 Å²	106.2	56%	0.559	55%	0.552	S	S	*	*	H	α-helix	trans	-60.3	-26.4	173.7	-36.3	0	0	0	0	113	A118 N119	A118-S121 WeakPolarHBondContact O-CB 3.33Å; A118-S121 PolarHBondContact O-N 3.3Å; A118-S121 PolarHBondContact O-OG 3.24Å; N119-S121 PolarHBondContact O-N 2.98Å; N119-S121 VanDerWaalsContact O-N 3.14Å
122	S	39.2	Very low	47.6	Very low	68 Å²	68	104.5 Å²	104.5	48%	0.476	53%	0.533	S	S	.	.	H	α-helix	trans	-86.8	-28.6	-179	-166.7	0	0	0	0	112.5	N119 L120 L124 L125	N119-S122 WeakPolarHBondContact O-CB 3.39Å; N119-S122 PolarHBondContact O-N 3.22Å; L120-S122 PolarHBondContact O-N 2.83Å; S122-L124 VanDerWaalsContact C-N 3.33Å; S122-L124 PolarHBondContact O-N 2.82Å; S122-L125 PolarHBondContact O-N 3.46Å; S122-L125 VanDerWaalsContact O-N 3.09Å
123	A	42.8	Very low	49.8	Very low	41 Å²	41	102 Å²	102	34%	0.339	53%	0.526	S	S	.	.	H	α-helix	trans	-63.5	-38.8	176.9	0	0	0	0	0	111.9	L120 L125 K126	L120-A123 PolarHBondContact O-N 3.01Å; A123-L125 PolarHBondContact O-N 2.88Å; A123-L125 VanDerWaalsContact O-N 3.07Å; A123-K126 PolarHBondContact O-N 3.2Å
124	L	46.6	Very low	51.9	Low	108 Å²	108	94.8 Å²	94.8	57%	0.565	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	6.2	174	-67	171.1	0	0	0	114.3	S122	S122-L124 VanDerWaalsContact C-N 3.33Å; S122-L124 PolarHBondContact O-N 2.82Å
125	L	43.1	Very low	54	Low	149 Å²	149	83.7 Å²	83.7	78%	0.78	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.4	8.3	178.9	-64.5	173.1	0	0	0	112.9	S122 A123	S122-L125 PolarHBondContact O-N 3.46Å; S122-L125 VanDerWaalsContact O-N 3.09Å; A123-L125 PolarHBondContact O-N 2.88Å; A123-L125 VanDerWaalsContact O-N 3.07Å
126	K	45	Very low	56.2	Low	139 Å²	139	79 Å²	79	60%	0.604	44%	0.436	S	S	*	.	S	Bend	trans	-95.4	168.8	167.4	-74.3	-171.5	169.6	-168.1	0	110.8	A123	A123-K126 PolarHBondContact O-N 3.2Å
127	E	47	Very low	58.7	Low	198 Å²	198	74.9 Å²	74.9	93%	0.925	42%	0.417	S	S	*	.	S	Bend	trans	-85.8	-10.7	-179.6	-60	-171.5	136.7	0	0	113.1
128	D	54.8	Low	61	Low	79 Å²	79	66.8 Å²	66.8	42%	0.422	38%	0.38	S	S	.	.	S	Bend	trans	-91	148.2	-176.2	-44	-71.9	0	0	0	112.7
129	D	69.2	Low	63.5	Low	30 Å²	30	64.2 Å²	64.2	16%	0.16	36%	0.356	C	S	.	.			trans	-79.7	122.5	177.7	-169.7	-37.1	0	0	0	110.9	G131 E132 D133 K184 T185	D129-G131 PolarHBondContact O-N 2.93Å; D129-G131 WeakPolarHBondContact OD1-CA 3.32Å; D129-G131 PolarHBondContact OD1-N 2.71Å; D129-E132 HydrophobicContact CB-CB 4.26Å; D129-E132 HydrophobicContact CB-CG 4.03Å; D129-E132 PolarHBondContact O-N 3.2Å; D129-D133 PolarHBondContact O-N 3.15Å; D129-K184 WeakPolarHBondContact OD2-CB 3.19Å; D129-K184 VanDerWaalsContact OD2-CD 3.23Å; D129-K184 WeakPolarHBondContact OD2-CD 3.33Å; D129-T185 PolarHBondContact OD1-OG1 3.46Å
130	P	75.3	Confident	65.8	Low	29 Å²	29	62.7 Å²	62.7	19%	0.188	35%	0.351	C	S	.	.	H	α-helix	trans	-62.1	-15.9	178.7	26.3	-35.8	0	0	0	113.9	V134 V175 T185	P130-V134 WeakPolarHBondContact O-CB 3.4Å; P130-V134 WeakPolarHBondContact O-CG2 3.45Å; P130-V134 PolarHBondContact O-N 3.3Å; P130-V175 HydrophobicContact CG-CG1 4.03Å; P130-T185 HydrophobicContact CG-CG2 4.46Å
131	G	75.6	Confident	68.2	Low	0 Å²	0	63.6 Å²	63.6	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-71.9	-43.1	168.8	0	0	0	0	0	112.8	D129 A135	D129-G131 PolarHBondContact O-N 2.93Å; D129-G131 WeakPolarHBondContact OD1-CA 3.32Å; D129-G131 PolarHBondContact OD1-N 2.71Å; G131-A135 VanDerWaalsContact O-CB 3.31Å; G131-A135 WeakPolarHBondContact O-CB 3.46Å; G131-A135 PolarHBondContact O-N 2.92Å
132	E	76.1	Confident	70.7	Confident	71 Å²	71	59.8 Å²	59.8	33%	0.332	33%	0.327	S	S	.	.	H	α-helix	trans	-69.8	-43.3	-178.4	-65.9	177.7	-156.4	0	0	110.4	D129 V134 A135 A136 K184	D129-E132 HydrophobicContact CB-CB 4.26Å; D129-E132 HydrophobicContact CB-CG 4.03Å; D129-E132 PolarHBondContact O-N 3.2Å; E132-V134 PolarHBondContact O-N 2.88Å; E132-A135 PolarHBondContact O-N 2.97Å; E132-A136 WeakPolarHBondContact O-CB 3.46Å; E132-A136 PolarHBondContact O-N 3.17Å; E132-K184 IonicContact OE1-NZ 2.62Å; E132-K184 PolarHBondContact OE1-NZ 2.88Å
133	D	79.8	Confident	73.2	Confident	96 Å²	96	57 Å²	57	51%	0.513	31%	0.307	S	S	.	.	H	α-helix	trans	-54.4	-51.8	171.3	-91.2	-6.2	0	0	0	112.6	D129 A135 A136 S137	D129-D133 PolarHBondContact O-N 3.15Å; D133-A135 VanDerWaalsContact C-N 3.31Å; D133-A135 PolarHBondContact O-N 3.14Å; D133-A136 PolarHBondContact O-N 3.14Å; D133-S137 PolarHBondContact O-N 2.96Å; D133-S137 VanDerWaalsContact O-N 3.07Å
134	V	81.8	Confident	75.6	Confident	19 Å²	19	58.1 Å²	58.1	12%	0.115	32%	0.316	C	S	.	.	H	α-helix	trans	-61.6	-42	-179.7	163	0	0	0	0	110.7	P130 E132 S137 K168 L172	P130-V134 WeakPolarHBondContact O-CB 3.4Å; P130-V134 WeakPolarHBondContact O-CG2 3.45Å; P130-V134 PolarHBondContact O-N 3.3Å; E132-V134 PolarHBondContact O-N 2.88Å; V134-S137 PolarHBondContact O-N 3.1Å; V134-S137 PolarHBondContact O-OG 2.89Å; V134-K168 HydrophobicContact CG1-CB 3.7Å; V134-K168 HydrophobicContact CG1-CD 4.09Å; V134-K168 HydrophobicContact CG1-CG 4.03Å; V134-L172 HydrophobicContact CB-CD2 4.05Å; V134-L172 HydrophobicContact CG1-CD1 4.04Å; V134-L172 HydrophobicContact CG1-CD2 4.06Å; V134-L172 HydrophobicContact CG1-CG 3.98Å; V134-L172 HydrophobicContact CG2-CD2 4.07Å
135	A	79.1	Confident	77.8	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-79	-19.9	-177.6	0	0	0	0	0	113.6	G131 E132 D133 F139 V188 L192 H524	G131-A135 VanDerWaalsContact O-CB 3.31Å; G131-A135 WeakPolarHBondContact O-CB 3.46Å; G131-A135 PolarHBondContact O-N 2.92Å; E132-A135 PolarHBondContact O-N 2.97Å; D133-A135 VanDerWaalsContact C-N 3.31Å; D133-A135 PolarHBondContact O-N 3.14Å; A135-F139 WeakPolarHBondContact O-CD2 3.46Å; A135-F139 WeakPolarHBondContact O-CE2 3.48Å; A135-V188 HydrophobicContact CB-CG1 3.77Å; A135-L192 HydrophobicContact CB-CD1 4.5Å; A135-H524 WeakPolarHBondContact CB-CE1 3.4Å; A135-H524 WeakPolarHBondContact CB-NE2 3.3Å
136	A	82.6	Confident	80	Confident	53 Å²	53	47.7 Å²	47.7	44%	0.438	26%	0.261	S	S	.	.	H	α-helix	trans	-71.4	-38.6	165.6	0	0	0	0	0	112	E132 D133 L138 F139	E132-A136 WeakPolarHBondContact O-CB 3.46Å; E132-A136 PolarHBondContact O-N 3.17Å; D133-A136 PolarHBondContact O-N 3.14Å; A136-L138 PolarHBondContact O-N 3.27Å; A136-F139 WeakPolarHBondContact O-CD2 3.47Å; A136-F139 PolarHBondContact O-N 3.32Å; A136-F139 VanDerWaalsContact O-N 3.14Å
137	S	87.4	Confident	82.2	Confident	38 Å²	38	46.2 Å²	46.2	27%	0.266	26%	0.259	S	S	.	.	H	α-helix	trans	-58.7	-23.6	178.2	77.2	0	0	0	0	114.1	D133 V134 F139 P140 E141 K168	D133-S137 PolarHBondContact O-N 2.96Å; D133-S137 VanDerWaalsContact O-N 3.07Å; V134-S137 PolarHBondContact O-N 3.1Å; V134-S137 PolarHBondContact O-OG 2.89Å; S137-F139 VanDerWaalsContact C-N 3.34Å; S137-F139 PolarHBondContact O-N 2.92Å; S137-P140 WeakPolarHBondContact O-CD 3.4Å; S137-P140 WeakPolarHBondContact O-CG 3.44Å; S137-E141 WeakPolarHBondContact O-CG 3.46Å; S137-K168 PolarHBondContact OG-NZ 3.4Å
138	L	89.1	Confident	84.1	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-66.7	-26.9	178.2	-70.4	170.7	0	0	0	114.4	A136 E141 F142 I164 K168 L192	A136-L138 PolarHBondContact O-N 3.27Å; L138-E141 PolarHBondContact O-N 3.07Å; L138-F142 HydrophobicContact CB-CD2 4.39Å; L138-F142 HydrophobicContact CD2-CD2 4.39Å; L138-F142 HydrophobicContact CD2-CE2 4.1Å; L138-F142 WeakPolarHBondContact O-CB 3.42Å; L138-F142 WeakPolarHBondContact O-CD2 3.47Å; L138-F142 PolarHBondContact O-N 3.38Å; L138-I164 HydrophobicContact CD2-CG2 3.4Å; L138-K168 HydrophobicContact CD1-CG 4.46Å; L138-K168 HydrophobicContact CD2-CD 4.37Å; L138-K168 HydrophobicContact CD2-CG 3.54Å; L138-K168 HydrophobicContact CG-CG 4.07Å; L138-L192 HydrophobicContact CD1-CD1 3.9Å; L138-L192 HydrophobicContact CD1-CD2 3.42Å; L138-L192 VanDerWaalsContact CD1-CD2 3.42Å; L138-L192 HydrophobicContact CD1-CG 4.33Å
139	F	91.3	Very high	85.6	Confident	12 Å²	12	40.2 Å²	40.2	5%	0.053	23%	0.226	C	C	.	.	H	α-helix	trans	-64.9	-50.1	-174.5	-73	-111.1	0	0	0	113.3	A135 A136 S137 L143 L523 H524 R527 Y555 L558 L559 L567	A135-F139 WeakPolarHBondContact O-CD2 3.46Å; A135-F139 WeakPolarHBondContact O-CE2 3.48Å; A136-F139 WeakPolarHBondContact O-CD2 3.47Å; A136-F139 PolarHBondContact O-N 3.32Å; A136-F139 VanDerWaalsContact O-N 3.14Å; S137-F139 VanDerWaalsContact C-N 3.34Å; S137-F139 PolarHBondContact O-N 2.92Å; F139-L143 PolarHBondContact O-N 2.77Å; F139-L523 HydrophobicContact CZ-CB 3.95Å; F139-H524 AromaticContact CE2-CE1 3.98Å; F139-H524 AromaticContact CE2-ND1 3.59Å; F139-H524 AromaticContact CZ-ND1 3.99Å; F139-R527 HydrophobicContact CD1-CG 4.46Å; F139-R527 HydrophobicContact CE1-CB 4.14Å; F139-R527 HydrophobicContact CE1-CG 4.48Å; F139-R527 HydrophobicContact CZ-CB 4.34Å; F139-Y555 HydrophobicContact CD1-CE2 4.07Å; F139-Y555 WeakPolarHBondContact CD1-OH 3.36Å; F139-Y555 AromaticContact CE1-CE2 3.79Å; F139-Y555 HydrophobicContact CE1-CE2 3.79Å; F139-L558 HydrophobicContact CE1-CD2 4.05Å; F139-L559 HydrophobicContact CD1-CD2 4.06Å; F139-L567 HydrophobicContact CB-CD1 3.82Å
140	P	92.5	Very high	85.7	Confident	59 Å²	59	42.3 Å²	42.3	38%	0.383	24%	0.243	S	C	.	.	H	α-helix	trans	-68.9	-32.4	172.2	26	-34.8	0	0	0	113.1	S137 L143 A144 L567	S137-P140 WeakPolarHBondContact O-CD 3.4Å; S137-P140 WeakPolarHBondContact O-CG 3.44Å; P140-L143 PolarHBondContact O-N 2.99Å; P140-A144 VanDerWaalsContact O-CB 3.3Å; P140-A144 WeakPolarHBondContact O-CB 3.44Å; P140-A144 PolarHBondContact O-N 3.13Å; P140-L567 HydrophobicContact CB-CD2 4.11Å
141	E	93.1	Very high	85.3	Confident	67 Å²	67	45.6 Å²	45.6	31%	0.313	27%	0.267	S	S	.	.	H	α-helix	trans	-68.2	-42.5	-179.1	-70.9	172.8	-176.9	0	0	112.5	S137 L138 A144 S145 I164 K168	S137-E141 WeakPolarHBondContact O-CG 3.46Å; L138-E141 PolarHBondContact O-N 3.07Å; E141-A144 PolarHBondContact O-N 3.47Å; E141-S145 PolarHBondContact O-N 2.91Å; E141-I164 HydrophobicContact CB-CG2 4.35Å; E141-K168 IonicContact OE1-NZ 2.78Å; E141-K168 PolarHBondContact OE1-NZ 2.96Å; E141-K168 WeakPolarHBondContact OE2-CE 3.38Å; E141-K168 IonicContact OE2-NZ 3.3Å; E141-K168 PolarHBondContact OE2-NZ 2.72Å
142	F	93.8	Very high	84.7	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-61.5	-44.8	172.8	-93.6	-114.5	0	0	0	111.5	L138 A144 S145 F146 Y161 I164 E195 W199 H531	L138-F142 HydrophobicContact CB-CD2 4.39Å; L138-F142 HydrophobicContact CD2-CD2 4.39Å; L138-F142 HydrophobicContact CD2-CE2 4.1Å; L138-F142 WeakPolarHBondContact O-CB 3.42Å; L138-F142 WeakPolarHBondContact O-CD2 3.47Å; L138-F142 PolarHBondContact O-N 3.38Å; F142-A144 PolarHBondContact O-N 3.41Å; F142-S145 PolarHBondContact O-N 3.07Å; F142-F146 WeakPolarHBondContact O-CB 3.3Å; F142-F146 PolarHBondContact O-N 3.39Å; F142-Y161 HydrophobicContact CB-CE1 4.26Å; F142-Y161 AromaticContact CD1-CD1 3.65Å; F142-Y161 HydrophobicContact CD1-CD1 3.65Å; F142-Y161 HydrophobicContact CD1-CD2 4.36Å; F142-Y161 AromaticContact CD1-CE1 3.52Å; F142-Y161 HydrophobicContact CD1-CE1 3.52Å; F142-Y161 HydrophobicContact CD1-CE2 4.26Å; F142-Y161 HydrophobicContact CD1-CG 4.08Å; F142-Y161 AromaticContact CD1-CZ 3.86Å; F142-Y161 HydrophobicContact CD2-CD1 4.48Å; F142-Y161 AromaticContact CE1-CD1 3.66Å; F142-Y161 HydrophobicContact CE1-CD1 3.66Å; F142-Y161 AromaticContact CE1-CD2 3.94Å; F142-Y161 HydrophobicContact CE1-CD2 3.94Å; F142-Y161 AromaticContact CE1-CE1 3.98Å; F142-Y161 HydrophobicContact CE1-CE1 3.98Å; F142-Y161 HydrophobicContact CE1-CE2 4.25Å; F142-Y161 AromaticContact CE1-CG 3.65Å; F142-Y161 HydrophobicContact CE1-CG 3.65Å; F142-Y161 HydrophobicContact CE2-CD1 4.48Å; F142-Y161 HydrophobicContact CG-CD1 4.09Å; F142-Y161 AromaticContact CG-CE1 3.97Å; F142-Y161 HydrophobicContact CG-CE1 3.97Å; F142-Y161 HydrophobicContact CZ-CD1 4.1Å; F142-Y161 HydrophobicContact CZ-CG 4.07Å; F142-I164 HydrophobicContact CD2-CG2 4.15Å; F142-I164 HydrophobicContact CE2-CG2 3.88Å; F142-E195 WeakPolarHBondContact CZ-OE1 3.37Å; F142-W199 AromaticContact CE1-CZ2 3.99Å; F142-W199 HydrophobicContact CE1-CZ2 3.99Å; F142-W199 AromaticContact CE1-NE1 3.79Å; F142-W199 AromaticContact CZ-NE1 3.82Å; F142-H531 HydrophobicContact CD1-CB 4.43Å; F142-H531 AromaticContact CD1-CG 3.89Å; F142-H531 AromaticContact CD1-ND1 3.86Å
143	L	92.3	Very high	85.1	Confident	10 Å²	10	48.3 Å²	48.3	5%	0.052	30%	0.295	C	S	.	.	H	α-helix	trans	-63.9	-41.2	176.6	-176.4	59.9	0	0	0	111.9	F139 P140 S145 F146 L147 L567 Y571	F139-L143 PolarHBondContact O-N 2.77Å; P140-L143 PolarHBondContact O-N 2.99Å; L143-S145 VanDerWaalsContact C-N 3.31Å; L143-S145 PolarHBondContact O-N 3.08Å; L143-F146 HydrophobicContact CD1-CD1 4.31Å; L143-F146 PolarHBondContact O-N 3.35Å; L143-L147 HydrophobicContact CD1-CD1 3.92Å; L143-L147 HydrophobicContact CD1-CD2 4.41Å; L143-L147 HydrophobicContact CD1-CG 3.87Å; L143-L147 HydrophobicContact CD2-CD1 4.34Å; L143-L147 HydrophobicContact CG-CD1 3.83Å; L143-L147 HydrophobicContact CG-CG 4.2Å; L143-L147 WeakPolarHBondContact O-CB 3.31Å; L143-L147 WeakPolarHBondContact O-CG 3.48Å; L143-L147 PolarHBondContact O-N 3.24Å; L143-L567 HydrophobicContact CB-CD2 4.47Å; L143-L567 HydrophobicContact CD2-CB 4.3Å; L143-L567 HydrophobicContact CD2-CD2 3.65Å; L143-Y571 HydrophobicContact CB-CE2 4.45Å; L143-Y571 HydrophobicContact CD1-CE1 4.35Å; L143-Y571 HydrophobicContact CD1-CE2 4.04Å; L143-Y571 HydrophobicContact CD2-CE2 4.07Å; L143-Y571 HydrophobicContact CG-CE2 4.41Å
144	A	91.9	Very high	85.4	Confident	64 Å²	64	44.1 Å²	44.1	53%	0.529	27%	0.273	S	S	.	.	H	α-helix	trans	-63.7	-36	178.6	0	0	0	0	0	112.3	P140 E141 F142 K148	P140-A144 VanDerWaalsContact O-CB 3.3Å; P140-A144 WeakPolarHBondContact O-CB 3.44Å; P140-A144 PolarHBondContact O-N 3.13Å; E141-A144 PolarHBondContact O-N 3.47Å; F142-A144 PolarHBondContact O-N 3.41Å; A144-K148 WeakPolarHBondContact O-CB 3.09Å; A144-K148 PolarHBondContact O-N 3.19Å; A144-K148 VanDerWaalsContact O-N 3.14Å
145	S	92.3	Very high	85.7	Confident	6 Å²	6	45.4 Å²	45.4	4%	0.042	28%	0.277	C	S	.	.	H	α-helix	trans	-71.8	-42.6	172.1	-175.3	0	0	0	0	111.9	E141 F142 L143 L147 K148 H149 L157 D160	E141-S145 PolarHBondContact O-N 2.91Å; F142-S145 PolarHBondContact O-N 3.07Å; L143-S145 VanDerWaalsContact C-N 3.31Å; L143-S145 PolarHBondContact O-N 3.08Å; S145-L147 PolarHBondContact O-N 2.98Å; S145-K148 WeakPolarHBondContact O-CB 3.45Å; S145-K148 PolarHBondContact O-N 2.92Å; S145-H149 PolarHBondContact O-CD2 2.93Å; S145-H149 VanDerWaalsContact O-CD2 3.28Å; S145-H149 PolarHBondContact O-N 3.21Å; S145-L157 WeakPolarHBondContact O-CD1 3.25Å; S145-L157 WeakPolarHBondContact OG-CD1 3.48Å; S145-D160 WeakPolarHBondContact OG-CB 3.22Å; S145-D160 PolarHBondContact OG-OD2 2.76Å
146	F	91.3	Very high	86.3	Confident	32 Å²	32	51.1 Å²	51.1	14%	0.14	30%	0.303	C	S	.	.	H	α-helix	trans	-56.4	-46.9	175	-176.9	-108.2	0	0	0	112.4	F142 L143 K148 H149 L157 L534	F142-F146 WeakPolarHBondContact O-CB 3.3Å; F142-F146 PolarHBondContact O-N 3.39Å; L143-F146 HydrophobicContact CD1-CD1 4.31Å; L143-F146 PolarHBondContact O-N 3.35Å; F146-K148 VanDerWaalsContact C-N 3.35Å; F146-K148 PolarHBondContact O-N 2.99Å; F146-H149 PolarHBondContact O-N 3.32Å; F146-L157 HydrophobicContact CB-CD1 4.5Å; F146-L157 HydrophobicContact CD2-CD2 4.04Å; F146-L534 HydrophobicContact CE1-CD1 4.28Å; F146-L534 HydrophobicContact CE2-CB 3.87Å; F146-L534 HydrophobicContact CE2-CD1 4.19Å; F146-L534 HydrophobicContact CZ-CB 4.17Å; F146-L534 HydrophobicContact CZ-CD1 3.98Å; F146-L534 HydrophobicContact CZ-CD2 4.43Å; F146-L534 HydrophobicContact CZ-CG 4.42Å
147	L	89.1	Confident	86.8	Confident	107 Å²	107	48.9 Å²	48.9	56%	0.56	28%	0.284	S	S	*	.	H	α-helix	trans	-75.5	-19.8	179.5	-64	176.4	0	0	0	113.9	L143 S145	L143-L147 HydrophobicContact CD1-CD1 3.92Å; L143-L147 HydrophobicContact CD1-CD2 4.41Å; L143-L147 HydrophobicContact CD1-CG 3.87Å; L143-L147 HydrophobicContact CD2-CD1 4.34Å; L143-L147 HydrophobicContact CG-CD1 3.83Å; L143-L147 HydrophobicContact CG-CG 4.2Å; L143-L147 WeakPolarHBondContact O-CB 3.31Å; L143-L147 WeakPolarHBondContact O-CG 3.48Å; L143-L147 PolarHBondContact O-N 3.24Å; S145-L147 PolarHBondContact O-N 2.98Å
148	K	88.5	Confident	87	Confident	128 Å²	128	47.1 Å²	47.1	56%	0.557	27%	0.272	S	S	*	.	H	α-helix	trans	-71.5	-33.6	174.1	162.8	-167.2	165.4	-165	0	111.7	A144 S145 F146 D160	A144-K148 WeakPolarHBondContact O-CB 3.09Å; A144-K148 PolarHBondContact O-N 3.19Å; A144-K148 VanDerWaalsContact O-N 3.14Å; S145-K148 WeakPolarHBondContact O-CB 3.45Å; S145-K148 PolarHBondContact O-N 2.92Å; F146-K148 VanDerWaalsContact C-N 3.35Å; F146-K148 PolarHBondContact O-N 2.99Å; K148-D160 VanDerWaalsContact NZ-CG 3.27Å; K148-D160 IonicContact NZ-OD1 3.16Å; K148-D160 PolarHBondContact NZ-OD1 2.71Å; K148-D160 IonicContact NZ-OD2 2.76Å; K148-D160 PolarHBondContact NZ-OD2 3.49Å
149	H	86.1	Confident	87.2	Confident	24 Å²	24	51.3 Å²	51.3	11%	0.111	29%	0.291	C	S	.	.	S	Bend	trans	-102.6	125.5	-171.5	-72.3	-64.9	0	0	0	112.3	S145 F146 A153 E156 L157 D160	S145-H149 PolarHBondContact O-CD2 2.93Å; S145-H149 VanDerWaalsContact O-CD2 3.28Å; S145-H149 PolarHBondContact O-N 3.21Å; F146-H149 PolarHBondContact O-N 3.32Å; H149-A153 HydrophobicContact CB-CB 4.37Å; H149-E156 WeakPolarHBondContact CE1-CB 3.46Å; H149-E156 IonicContact CE1-OE2 3.82Å; H149-L157 HydrophobicContact CB-CB 4.09Å; H149-L157 HydrophobicContact CB-CD1 4.44Å; H149-L157 VanDerWaalsContact CD2-CA 3.49Å; H149-L157 WeakPolarHBondContact CD2-CA 3.28Å; H149-D160 IonicContact CD2-OD2 3.82Å; H149-D160 IonicContact CE1-OD2 2.62Å; H149-D160 IonicContact NE2-OD2 3.67Å; H149-D160 PolarHBondContact NE2-OD2 3.37Å
150	S	70.8	Confident	87.3	Confident	73 Å²	73	52.5 Å²	52.5	51%	0.51	30%	0.298	S	S	.	.			trans	-75.8	162.9	170.4	58.9	0	0	0	0	111.6	S152 A153	S150-S152 PolarHBondContact O-N 3.1Å; S150-S152 PolarHBondContact OG-OG 2.93Å; S150-A153 PolarHBondContact O-N 3.13Å
151	S	67.6	Low	87.4	Confident	98 Å²	98	49.7 Å²	49.7	69%	0.685	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-4.5	-179.6	52.4	0	0	0	0	116	V154	S151-V154 WeakPolarHBondContact O-CG2 3.48Å
152	S	63.4	Low	87.4	Confident	109 Å²	109	48.1 Å²	48.1	76%	0.762	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	-6.7	169.8	56.1	0	0	0	0	114.3	S150	S150-S152 PolarHBondContact O-N 3.1Å; S150-S152 PolarHBondContact OG-OG 2.93Å
153	A	82.6	Confident	87.4	Confident	19 Å²	19	53.1 Å²	53.1	16%	0.157	30%	0.299	C	S	.	.			trans	-114.2	22.4	-175.6	0	0	0	0	0	112.9	H149 S150 F155 E156 L157	H149-A153 HydrophobicContact CB-CB 4.37Å; S150-A153 PolarHBondContact O-N 3.13Å; A153-F155 PolarHBondContact O-N 3.33Å; A153-F155 VanDerWaalsContact O-N 3.07Å; A153-E156 WeakPolarHBondContact O-CA 3.39Å; A153-E156 WeakPolarHBondContact O-CB 3.25Å; A153-E156 PolarHBondContact O-N 3.09Å; A153-L157 PolarHBondContact O-N 3.28Å
154	V	86.1	Confident	87.4	Confident	9 Å²	9	54 Å²	54	6%	0.055	30%	0.304	C	S	.	.	H	α-helix	trans	-56.4	-31.4	-169.6	-166.5	0	0	0	0	113.6	S151 L157 L158 F535 S538 L539	S151-V154 WeakPolarHBondContact O-CG2 3.48Å; V154-L157 WeakPolarHBondContact O-CB 3.3Å; V154-L157 PolarHBondContact O-N 3.08Å; V154-L158 PolarHBondContact O-N 3.34Å; V154-F535 HydrophobicContact CG1-CD2 3.36Å; V154-F535 HydrophobicContact CG1-CE2 3.49Å; V154-F535 VanDerWaalsContact CG1-CE2 3.49Å; V154-S538 WeakPolarHBondContact CG1-OG 3.33Å; V154-L539 HydrophobicContact CB-CD2 4.17Å; V154-L539 HydrophobicContact CG1-CD2 4.08Å; V154-L539 HydrophobicContact CG1-CG 4.39Å; V154-L539 HydrophobicContact CG2-CD2 4.26Å
155	F	89.4	Confident	87.5	Confident	45 Å²	45	50.9 Å²	50.9	20%	0.197	28%	0.278	C	S	.	.	H	α-helix	trans	-78	-25.6	176.1	-64.9	-66.3	0	0	0	113.8	A153 L157 L158 E159 Y206 R207 V210	A153-F155 PolarHBondContact O-N 3.33Å; A153-F155 VanDerWaalsContact O-N 3.07Å; F155-L157 VanDerWaalsContact C-N 3.33Å; F155-L158 PolarHBondContact O-N 3.3Å; F155-E159 WeakPolarHBondContact O-CG 3.43Å; F155-E159 PolarHBondContact O-N 3.41Å; F155-E159 VanDerWaalsContact O-N 3.14Å; F155-Y206 WeakPolarHBondContact CZ-O 3.47Å; F155-R207 HydrophobicContact CD1-CB 4.32Å; F155-R207 HydrophobicContact CE1-CB 3.95Å; F155-R207 HydrophobicContact CZ-CB 4.21Å; F155-V210 HydrophobicContact CE2-CB 4.45Å; F155-V210 HydrophobicContact CE2-CG1 4.43Å; F155-V210 HydrophobicContact CZ-CB 4.27Å; F155-V210 HydrophobicContact CZ-CG2 4.19Å
156	E	91.1	Very high	87.4	Confident	120 Å²	120	52.9 Å²	52.9	56%	0.561	29%	0.287	S	S	*	.	H	α-helix	trans	-71.6	-31.2	170	-60.3	-168.7	-174	0	0	111.2	H149 A153 E159 D160	H149-E156 WeakPolarHBondContact CE1-CB 3.46Å; H149-E156 IonicContact CE1-OE2 3.82Å; A153-E156 WeakPolarHBondContact O-CA 3.39Å; A153-E156 WeakPolarHBondContact O-CB 3.25Å; A153-E156 PolarHBondContact O-N 3.09Å; E156-E159 PolarHBondContact O-N 3.32Å; E156-D160 PolarHBondContact O-N 3.32Å
157	L	92.4	Very high	87.4	Confident	7 Å²	7	57.4 Å²	57.4	4%	0.037	31%	0.309	C	S	.	.	H	α-helix	trans	-62.6	-44.3	171.1	176.6	66.5	0	0	0	111.8	S145 F146 H149 A153 V154 F155 E159 D160 Y161	S145-L157 WeakPolarHBondContact O-CD1 3.25Å; S145-L157 WeakPolarHBondContact OG-CD1 3.48Å; F146-L157 HydrophobicContact CB-CD1 4.5Å; F146-L157 HydrophobicContact CD2-CD2 4.04Å; H149-L157 HydrophobicContact CB-CB 4.09Å; H149-L157 HydrophobicContact CB-CD1 4.44Å; H149-L157 VanDerWaalsContact CD2-CA 3.49Å; H149-L157 WeakPolarHBondContact CD2-CA 3.28Å; A153-L157 PolarHBondContact O-N 3.28Å; V154-L157 WeakPolarHBondContact O-CB 3.3Å; V154-L157 PolarHBondContact O-N 3.08Å; F155-L157 VanDerWaalsContact C-N 3.33Å; L157-E159 VanDerWaalsContact C-N 3.35Å; L157-D160 PolarHBondContact O-N 3.12Å; L157-Y161 HydrophobicContact CD1-CD1 4.28Å; L157-Y161 HydrophobicContact CD1-CE1 3.6Å; L157-Y161 HydrophobicContact CD1-CE2 4.14Å; L157-Y161 HydrophobicContact CD2-CE2 4.28Å; L157-Y161 HydrophobicContact CG-CD2 4.46Å; L157-Y161 HydrophobicContact CG-CE1 4.27Å; L157-Y161 HydrophobicContact CG-CE2 3.91Å; L157-Y161 PolarHBondContact O-N 3.17Å
158	L	93.1	Very high	87.5	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-67.7	-33.2	175.7	-67.1	-165.2	0	0	0	113.3	V154 F155 Y161 Q162 W199 I202 A203 F535	V154-L158 PolarHBondContact O-N 3.34Å; F155-L158 PolarHBondContact O-N 3.3Å; L158-Y161 HydrophobicContact CD2-CD2 4.09Å; L158-Q162 WeakPolarHBondContact O-CG 3.38Å; L158-Q162 PolarHBondContact O-N 3.03Å; L158-Q162 VanDerWaalsContact O-N 3.07Å; L158-Q162 PolarHBondContact O-NE2 3.08Å; L158-Q162 VanDerWaalsContact O-NE2 3.08Å; L158-W199 HydrophobicContact CD2-CD2 4.46Å; L158-W199 HydrophobicContact CD2-CE3 3.53Å; L158-W199 HydrophobicContact CD2-CZ3 3.65Å; L158-I202 HydrophobicContact CD1-CB 4.47Å; L158-I202 HydrophobicContact CD1-CG2 3.84Å; L158-A203 HydrophobicContact CB-CB 4.17Å; L158-A203 HydrophobicContact CD1-CB 3.83Å; L158-F535 HydrophobicContact CD1-CD2 3.99Å; L158-F535 HydrophobicContact CD1-CE2 3.4Å; L158-F535 HydrophobicContact CD1-CZ 3.74Å; L158-F535 HydrophobicContact CD2-CD2 3.73Å; L158-F535 HydrophobicContact CD2-CE2 4.04Å; L158-F535 HydrophobicContact CD2-CG 4.29Å; L158-F535 HydrophobicContact CG-CD2 3.91Å; L158-F535 HydrophobicContact CG-CE2 3.74Å
159	E	92	Very high	87.6	Confident	89 Å²	89	47.3 Å²	47.3	42%	0.416	26%	0.26	S	S	.	.	H	α-helix	trans	-68.6	-41.1	173.6	-73.6	178.3	-159.9	0	0	110.8	F155 E156 L157 Q162 N163 R207	F155-E159 WeakPolarHBondContact O-CG 3.43Å; F155-E159 PolarHBondContact O-N 3.41Å; F155-E159 VanDerWaalsContact O-N 3.14Å; E156-E159 PolarHBondContact O-N 3.32Å; L157-E159 VanDerWaalsContact C-N 3.35Å; E159-Q162 PolarHBondContact O-N 3.18Å; E159-N163 VanDerWaalsContact O-CG 3.3Å; E159-N163 PolarHBondContact O-N 3.31Å; E159-N163 PolarHBondContact O-ND2 3.18Å; E159-R207 IonicContact OE1-CZ 2.72Å; E159-R207 IonicContact OE1-NH1 2.7Å; E159-R207 PolarHBondContact OE1-NH1 3.41Å; E159-R207 IonicContact OE1-NH2 3.65Å; E159-R207 PolarHBondContact OE1-NH2 2.85Å
160	D	93.3	Very high	87.7	Confident	36 Å²	36	50.1 Å²	50.1	19%	0.193	28%	0.276	C	S	.	.	H	α-helix	trans	-58.9	-48.9	170.3	-88.7	-2.7	0	0	0	112.1	S145 K148 H149 E156 L157 Q162 N163 I164	S145-D160 WeakPolarHBondContact OG-CB 3.22Å; S145-D160 PolarHBondContact OG-OD2 2.76Å; K148-D160 VanDerWaalsContact NZ-CG 3.27Å; K148-D160 IonicContact NZ-OD1 3.16Å; K148-D160 PolarHBondContact NZ-OD1 2.71Å; K148-D160 IonicContact NZ-OD2 2.76Å; K148-D160 PolarHBondContact NZ-OD2 3.49Å; H149-D160 IonicContact CD2-OD2 3.82Å; H149-D160 IonicContact CE1-OD2 2.62Å; H149-D160 IonicContact NE2-OD2 3.67Å; H149-D160 PolarHBondContact NE2-OD2 3.37Å; E156-D160 PolarHBondContact O-N 3.32Å; L157-D160 PolarHBondContact O-N 3.12Å; D160-Q162 VanDerWaalsContact C-N 3.34Å; D160-Q162 PolarHBondContact O-N 3.01Å; D160-N163 PolarHBondContact O-N 3.12Å; D160-N163 VanDerWaalsContact O-N 3.16Å; D160-I164 VanDerWaalsContact O-CG1 3.29Å; D160-I164 WeakPolarHBondContact O-CG1 3.47Å; D160-I164 PolarHBondContact O-N 2.94Å
161	Y	94.8	Very high	88.5	Confident	1 Å²	1	49.5 Å²	49.5	0%	0.004	27%	0.269	C	S	.	.	H	α-helix	trans	-59.3	-42.6	179	-70.3	-16.2	0	0	0	112.3	F142 L157 L158 I164 C165 W199 H531	F142-Y161 HydrophobicContact CB-CE1 4.26Å; F142-Y161 AromaticContact CD1-CD1 3.65Å; F142-Y161 HydrophobicContact CD1-CD1 3.65Å; F142-Y161 HydrophobicContact CD1-CD2 4.36Å; F142-Y161 AromaticContact CD1-CE1 3.52Å; F142-Y161 HydrophobicContact CD1-CE1 3.52Å; F142-Y161 HydrophobicContact CD1-CE2 4.26Å; F142-Y161 HydrophobicContact CD1-CG 4.08Å; F142-Y161 AromaticContact CD1-CZ 3.86Å; F142-Y161 HydrophobicContact CD2-CD1 4.48Å; F142-Y161 AromaticContact CE1-CD1 3.66Å; F142-Y161 HydrophobicContact CE1-CD1 3.66Å; F142-Y161 AromaticContact CE1-CD2 3.94Å; F142-Y161 HydrophobicContact CE1-CD2 3.94Å; F142-Y161 AromaticContact CE1-CE1 3.98Å; F142-Y161 HydrophobicContact CE1-CE1 3.98Å; F142-Y161 HydrophobicContact CE1-CE2 4.25Å; F142-Y161 AromaticContact CE1-CG 3.65Å; F142-Y161 HydrophobicContact CE1-CG 3.65Å; F142-Y161 HydrophobicContact CE2-CD1 4.48Å; F142-Y161 HydrophobicContact CG-CD1 4.09Å; F142-Y161 AromaticContact CG-CE1 3.97Å; F142-Y161 HydrophobicContact CG-CE1 3.97Å; F142-Y161 HydrophobicContact CZ-CD1 4.1Å; F142-Y161 HydrophobicContact CZ-CG 4.07Å; L157-Y161 HydrophobicContact CD1-CD1 4.28Å; L157-Y161 HydrophobicContact CD1-CE1 3.6Å; L157-Y161 HydrophobicContact CD1-CE2 4.14Å; L157-Y161 HydrophobicContact CD2-CE2 4.28Å; L157-Y161 HydrophobicContact CG-CD2 4.46Å; L157-Y161 HydrophobicContact CG-CE1 4.27Å; L157-Y161 HydrophobicContact CG-CE2 3.91Å; L157-Y161 PolarHBondContact O-N 3.17Å; L158-Y161 HydrophobicContact CD2-CD2 4.09Å; Y161-I164 PolarHBondContact O-N 3.45Å; Y161-C165 WeakPolarHBondContact O-CB 3.49Å; Y161-C165 PolarHBondContact O-N 3.33Å; Y161-C165 PolarHBondContact O-SG 2.81Å; Y161-W199 HydrophobicContact CD2-CD2 4.14Å; Y161-W199 AromaticContact CD2-CE2 3.87Å; Y161-W199 HydrophobicContact CD2-CE3 4.3Å; Y161-W199 AromaticContact CD2-CH2 3.98Å; Y161-W199 HydrophobicContact CD2-CH2 3.98Å; Y161-W199 AromaticContact CD2-CZ2 3.8Å; Y161-W199 HydrophobicContact CD2-CZ2 3.8Å; Y161-W199 HydrophobicContact CD2-CZ3 4.22Å; Y161-W199 HydrophobicContact CE2-CH2 4.08Å; Y161-W199 HydrophobicContact CE2-CZ2 4.14Å; Y161-H531 HydrophobicContact CE2-CB 4.13Å; Y161-H531 AromaticContact CZ-CD2 3.92Å; Y161-H531 PolarHBondContact OH-CD2 3.42Å
162	Q	93.4	Very high	89.4	Confident	33 Å²	33	44.9 Å²	44.9	15%	0.154	24%	0.237	C	C	.	.	H	α-helix	trans	-59.7	-47.1	174.2	-76.1	169.5	69.8	0	0	111.5	L158 E159 D160 C165 Q166 N196 W199	L158-Q162 WeakPolarHBondContact O-CG 3.38Å; L158-Q162 PolarHBondContact O-N 3.03Å; L158-Q162 VanDerWaalsContact O-N 3.07Å; L158-Q162 PolarHBondContact O-NE2 3.08Å; L158-Q162 VanDerWaalsContact O-NE2 3.08Å; E159-Q162 PolarHBondContact O-N 3.18Å; D160-Q162 VanDerWaalsContact C-N 3.34Å; D160-Q162 PolarHBondContact O-N 3.01Å; Q162-C165 PolarHBondContact O-N 2.92Å; Q162-Q166 WeakPolarHBondContact O-CB 3.29Å; Q162-Q166 PolarHBondContact O-N 3.45Å; Q162-N196 PolarHBondContact O-ND2 3.32Å; Q162-W199 HydrophobicContact CG-CB 3.65Å
163	N	93.3	Very high	90.4	Very high	106 Å²	106	43.7 Å²	43.7	57%	0.567	22%	0.219	S	C	*	.	H	α-helix	trans	-61.2	-45.9	178.5	-73.9	-51.9	0	0	0	112	E159 D160 Q166 E167	E159-N163 VanDerWaalsContact O-CG 3.3Å; E159-N163 PolarHBondContact O-N 3.31Å; E159-N163 PolarHBondContact O-ND2 3.18Å; D160-N163 PolarHBondContact O-N 3.12Å; D160-N163 VanDerWaalsContact O-N 3.16Å; N163-Q166 PolarHBondContact O-N 2.83Å; N163-E167 PolarHBondContact O-N 3.5Å
164	I	93.6	Very high	90.5	Very high	27 Å²	27	44.8 Å²	44.8	14%	0.138	23%	0.226	C	C	.	.	H	α-helix	trans	-58.9	-51.3	177.3	-70.1	164	0	0	0	110.4	L138 E141 F142 D160 Y161 Q166 E167 K168	L138-I164 HydrophobicContact CD2-CG2 3.4Å; E141-I164 HydrophobicContact CB-CG2 4.35Å; F142-I164 HydrophobicContact CD2-CG2 4.15Å; F142-I164 HydrophobicContact CE2-CG2 3.88Å; D160-I164 VanDerWaalsContact O-CG1 3.29Å; D160-I164 WeakPolarHBondContact O-CG1 3.47Å; D160-I164 PolarHBondContact O-N 2.94Å; Y161-I164 PolarHBondContact O-N 3.45Å; I164-Q166 VanDerWaalsContact C-N 3.35Å; I164-Q166 PolarHBondContact O-N 3.45Å; I164-E167 PolarHBondContact O-N 2.75Å; I164-K168 WeakPolarHBondContact O-CG 3.17Å; I164-K168 PolarHBondContact O-N 2.79Å
165	C	92.8	Very high	90.4	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-60.2	-43	176.6	-71.5	0	0	0	0	111.9	Y161 Q162 E167 K168 V169 N196	Y161-C165 WeakPolarHBondContact O-CB 3.49Å; Y161-C165 PolarHBondContact O-N 3.33Å; Y161-C165 PolarHBondContact O-SG 2.81Å; Q162-C165 PolarHBondContact O-N 2.92Å; C165-E167 PolarHBondContact O-N 3.02Å; C165-K168 PolarHBondContact O-N 2.72Å; C165-V169 WeakPolarHBondContact O-CB 3.28Å; C165-V169 VanDerWaalsContact O-CG2 3.24Å; C165-V169 WeakPolarHBondContact O-CG2 3.45Å; C165-V169 PolarHBondContact O-N 3.18Å; C165-N196 HydrophobicContact CB-CB 3.96Å
166	Q	91.6	Very high	90.2	Very high	48 Å²	48	43.1 Å²	43.1	22%	0.224	22%	0.219	C	C	.	.	H	α-helix	trans	-65	-39.6	-179.2	-167	63.3	56.4	0	0	112.2	Q162 N163 I164 V169 N170 N196	Q162-Q166 WeakPolarHBondContact O-CB 3.29Å; Q162-Q166 PolarHBondContact O-N 3.45Å; N163-Q166 PolarHBondContact O-N 2.83Å; I164-Q166 VanDerWaalsContact C-N 3.35Å; I164-Q166 PolarHBondContact O-N 3.45Å; Q166-V169 PolarHBondContact O-N 2.82Å; Q166-N170 PolarHBondContact NE2-OD1 2.79Å; Q166-N170 WeakPolarHBondContact O-CB 3.1Å; Q166-N170 PolarHBondContact O-N 3.47Å; Q166-N170 PolarHBondContact O-ND2 3.25Å; Q166-N170 PolarHBondContact O-OD1 3.2Å; Q166-N196 PolarHBondContact OE1-ND2 2.82Å
167	E	91.6	Very high	89.8	Confident	127 Å²	127	43.7 Å²	43.7	59%	0.593	23%	0.225	S	C	*	.	H	α-helix	trans	-59.3	-48.6	175.7	-172.1	176.2	162.6	0	0	110.9	N163 I164 C165 N170 V171	N163-E167 PolarHBondContact O-N 3.5Å; I164-E167 PolarHBondContact O-N 2.75Å; C165-E167 PolarHBondContact O-N 3.02Å; E167-N170 PolarHBondContact O-N 3.19Å; E167-V171 WeakPolarHBondContact O-CG2 3.32Å; E167-V171 PolarHBondContact O-N 3.1Å
168	K	90	Very high	89.2	Confident	22 Å²	22	50.8 Å²	50.8	10%	0.096	25%	0.252	C	S	.	.	H	α-helix	trans	-64.5	-42.3	176.8	-54.3	-43.5	177.1	163.2	0	112.2	V134 S137 L138 E141 I164 C165 N170 V171 L172 L192	V134-K168 HydrophobicContact CG1-CB 3.7Å; V134-K168 HydrophobicContact CG1-CD 4.09Å; V134-K168 HydrophobicContact CG1-CG 4.03Å; S137-K168 PolarHBondContact OG-NZ 3.4Å; L138-K168 HydrophobicContact CD1-CG 4.46Å; L138-K168 HydrophobicContact CD2-CD 4.37Å; L138-K168 HydrophobicContact CD2-CG 3.54Å; L138-K168 HydrophobicContact CG-CG 4.07Å; E141-K168 IonicContact OE1-NZ 2.78Å; E141-K168 PolarHBondContact OE1-NZ 2.96Å; E141-K168 WeakPolarHBondContact OE2-CE 3.38Å; E141-K168 IonicContact OE2-NZ 3.3Å; E141-K168 PolarHBondContact OE2-NZ 2.72Å; I164-K168 WeakPolarHBondContact O-CG 3.17Å; I164-K168 PolarHBondContact O-N 2.79Å; C165-K168 PolarHBondContact O-N 2.72Å; K168-N170 VanDerWaalsContact C-N 3.3Å; K168-N170 PolarHBondContact O-N 2.76Å; K168-V171 PolarHBondContact O-N 2.88Å; K168-L172 WeakPolarHBondContact O-CB 3.46Å; K168-L172 WeakPolarHBondContact O-CG 3.23Å; K168-L172 PolarHBondContact O-N 3.04Å; K168-L192 HydrophobicContact CB-CD1 4.14Å
169	V	89.9	Confident	88.4	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-58.9	-41.7	176.9	165.6	0	0	0	0	111.3	C165 Q166 L172 Q173 R189 L192 Q193	C165-V169 WeakPolarHBondContact O-CB 3.28Å; C165-V169 VanDerWaalsContact O-CG2 3.24Å; C165-V169 WeakPolarHBondContact O-CG2 3.45Å; C165-V169 PolarHBondContact O-N 3.18Å; Q166-V169 PolarHBondContact O-N 2.82Å; V169-L172 PolarHBondContact O-N 3.08Å; V169-Q173 PolarHBondContact O-N 3.01Å; V169-R189 VanDerWaalsContact CG1-NH1 3.34Å; V169-R189 PolarHBondContact O-NH1 2.96Å; V169-L192 HydrophobicContact CG2-CB 3.64Å; V169-Q193 HydrophobicContact CG2-CB 4.42Å
170	N	88.7	Confident	87.7	Confident	84 Å²	84	50.6 Å²	50.6	45%	0.449	27%	0.269	S	S	.	.	H	α-helix	trans	-65.6	-44.6	176.9	-67.9	-9.1	0	0	0	111.7	Q166 E167 K168 Q173 S174	Q166-N170 PolarHBondContact NE2-OD1 2.79Å; Q166-N170 WeakPolarHBondContact O-CB 3.1Å; Q166-N170 PolarHBondContact O-N 3.47Å; Q166-N170 PolarHBondContact O-ND2 3.25Å; Q166-N170 PolarHBondContact O-OD1 3.2Å; E167-N170 PolarHBondContact O-N 3.19Å; K168-N170 VanDerWaalsContact C-N 3.3Å; K168-N170 PolarHBondContact O-N 2.76Å; N170-Q173 VanDerWaalsContact O-CB 3.25Å; N170-Q173 WeakPolarHBondContact O-CB 3.45Å; N170-Q173 PolarHBondContact O-N 3.05Å; N170-S174 PolarHBondContact O-N 2.58Å
171	V	87.1	Confident	86.9	Confident	60 Å²	60	55.1 Å²	55.1	36%	0.364	29%	0.289	S	S	.	.	H	α-helix	trans	-58.2	-50.9	174	170.5	0	0	0	0	110.4	E167 K168 Q173 S174 V175	E167-V171 WeakPolarHBondContact O-CG2 3.32Å; E167-V171 PolarHBondContact O-N 3.1Å; K168-V171 PolarHBondContact O-N 2.88Å; V171-Q173 PolarHBondContact O-N 2.86Å; V171-S174 PolarHBondContact O-N 2.69Å; V171-S174 VanDerWaalsContact O-N 3.11Å; V171-S174 PolarHBondContact O-OG 3.4Å; V171-V175 PolarHBondContact O-N 3.37Å
172	L	86.4	Confident	85.9	Confident	1 Å²	1	61.4 Å²	61.4	1%	0.005	32%	0.322	C	S	.	.	H	α-helix	trans	-63.7	-26.6	178.7	-65.5	177	0	0	0	112.9	V134 K168 V169 S174 V175 V176 T185 V188 R189 L192	V134-L172 HydrophobicContact CB-CD2 4.05Å; V134-L172 HydrophobicContact CG1-CD1 4.04Å; V134-L172 HydrophobicContact CG1-CD2 4.06Å; V134-L172 HydrophobicContact CG1-CG 3.98Å; V134-L172 HydrophobicContact CG2-CD2 4.07Å; K168-L172 WeakPolarHBondContact O-CB 3.46Å; K168-L172 WeakPolarHBondContact O-CG 3.23Å; K168-L172 PolarHBondContact O-N 3.04Å; V169-L172 PolarHBondContact O-N 3.08Å; L172-S174 VanDerWaalsContact C-N 3.31Å; L172-S174 PolarHBondContact O-N 3.01Å; L172-V175 PolarHBondContact O-N 3.32Å; L172-V176 WeakPolarHBondContact O-CB 3.49Å; L172-V176 VanDerWaalsContact O-CG2 3.27Å; L172-V176 WeakPolarHBondContact O-CG2 3.32Å; L172-V176 PolarHBondContact O-N 3.23Å; L172-T185 HydrophobicContact CD2-CG2 3.79Å; L172-V188 HydrophobicContact CD1-CG1 4.17Å; L172-R189 HydrophobicContact CB-CB 3.97Å; L172-R189 HydrophobicContact CB-CG 4.18Å; L172-R189 HydrophobicContact CD1-CB 4.16Å; L172-L192 HydrophobicContact CD1-CD1 3.9Å
173	Q	86.1	Confident	85.2	Confident	83 Å²	83	61 Å²	61	39%	0.388	32%	0.324	S	S	.	.	H	α-helix	trans	-57.7	-46.1	172.5	-158.2	151.6	-31.7	0	0	111.3	V169 N170 V171 V175 V176 L177 R189	V169-Q173 PolarHBondContact O-N 3.01Å; N170-Q173 VanDerWaalsContact O-CB 3.25Å; N170-Q173 WeakPolarHBondContact O-CB 3.45Å; N170-Q173 PolarHBondContact O-N 3.05Å; V171-Q173 PolarHBondContact O-N 2.86Å; Q173-V175 VanDerWaalsContact C-N 3.27Å; Q173-V175 PolarHBondContact O-N 3.18Å; Q173-V176 PolarHBondContact O-N 2.94Å; Q173-L177 HydrophobicContact CG-CD1 4.26Å; Q173-L177 WeakPolarHBondContact O-CB 3.41Å; Q173-L177 WeakPolarHBondContact O-CD1 3.41Å; Q173-L177 VanDerWaalsContact O-CG 3.24Å; Q173-L177 WeakPolarHBondContact O-CG 3.48Å; Q173-L177 PolarHBondContact O-N 3.38Å; Q173-R189 VanDerWaalsContact CB-NH1 3.27Å; Q173-R189 VanDerWaalsContact CD-NH2 3.34Å; Q173-R189 VanDerWaalsContact OE1-CZ 3.23Å
174	S	83.9	Confident	84.6	Confident	43 Å²	43	59.6 Å²	59.6	30%	0.301	31%	0.312	S	S	.	.	H	α-helix	trans	-65.8	-30.1	-179.8	77.9	0	0	0	0	113.1	N170 V171 L172 R178	N170-S174 PolarHBondContact O-N 2.58Å; V171-S174 PolarHBondContact O-N 2.69Å; V171-S174 VanDerWaalsContact O-N 3.11Å; V171-S174 PolarHBondContact O-OG 3.4Å; L172-S174 VanDerWaalsContact C-N 3.31Å; L172-S174 PolarHBondContact O-N 3.01Å; S174-R178 WeakPolarHBondContact O-CD 3.48Å; S174-R178 WeakPolarHBondContact O-CG 3.41Å
175	V	83.3	Confident	84.1	Confident	17 Å²	17	58.6 Å²	58.6	10%	0.103	31%	0.308	C	S	.	.	H	α-helix	trans	-78.3	-48.2	177.1	-176.7	0	0	0	0	110.7	P130 V171 L172 Q173 L177 R178 A179 T185	P130-V175 HydrophobicContact CG-CG1 4.03Å; V171-V175 PolarHBondContact O-N 3.37Å; L172-V175 PolarHBondContact O-N 3.32Å; Q173-V175 VanDerWaalsContact C-N 3.27Å; Q173-V175 PolarHBondContact O-N 3.18Å; V175-L177 VanDerWaalsContact C-N 3.31Å; V175-L177 PolarHBondContact O-N 3.3Å; V175-R178 CarbonylContact O-C 3.57Å; V175-R178 WeakPolarHBondContact O-CA 3.41Å; V175-R178 WeakPolarHBondContact O-CB 3.49Å; V175-R178 PolarHBondContact O-N 2.93Å; V175-A179 WeakPolarHBondContact O-CB 3.33Å; V175-A179 PolarHBondContact O-N 3.28Å; V175-T185 HydrophobicContact CB-CG2 4.46Å; V175-T185 HydrophobicContact CG1-CG2 3.99Å
176	V	85.8	Confident	83.6	Confident	2 Å²	2	59.2 Å²	59.2	1%	0.012	31%	0.313	C	S	.	.	H	α-helix	trans	-64.2	-34.3	-179.5	172.3	0	0	0	0	112	L172 Q173 R178 A179 G180 Q181 T185 A186 R189	L172-V176 WeakPolarHBondContact O-CB 3.49Å; L172-V176 VanDerWaalsContact O-CG2 3.27Å; L172-V176 WeakPolarHBondContact O-CG2 3.32Å; L172-V176 PolarHBondContact O-N 3.23Å; Q173-V176 PolarHBondContact O-N 2.94Å; V176-R178 PolarHBondContact O-N 2.88Å; V176-A179 PolarHBondContact O-N 3.22Å; V176-G180 CarbonylContact O-C 3.58Å; V176-G180 WeakPolarHBondContact O-CA 3.14Å; V176-G180 PolarHBondContact O-N 3.26Å; V176-Q181 VanDerWaalsContact CG1-OE1 3.3Å; V176-T185 HydrophobicContact CG2-CG2 4.2Å; V176-A186 HydrophobicContact CG1-CB 3.76Å; V176-A186 HydrophobicContact CG2-CB 3.93Å; V176-R189 HydrophobicContact CG2-CB 4.41Å
177	L	83.1	Confident	83.2	Confident	131 Å²	131	58.4 Å²	58.4	69%	0.686	32%	0.317	S	S	*	.	H	α-helix	trans	-62.5	-20	171.3	-75.4	169.3	0	0	0	113.7	Q173 V175	Q173-L177 HydrophobicContact CG-CD1 4.26Å; Q173-L177 WeakPolarHBondContact O-CB 3.41Å; Q173-L177 WeakPolarHBondContact O-CD1 3.41Å; Q173-L177 VanDerWaalsContact O-CG 3.24Å; Q173-L177 WeakPolarHBondContact O-CG 3.48Å; Q173-L177 PolarHBondContact O-N 3.38Å; V175-L177 VanDerWaalsContact C-N 3.31Å; V175-L177 PolarHBondContact O-N 3.3Å
178	R	79.4	Confident	82.9	Confident	156 Å²	156	52.7 Å²	52.7	59%	0.589	29%	0.29	S	S	*	.	H	α-helix	trans	-100.4	-37.2	177.4	-62	171.4	-174.1	-172.9	2.2	112.5	S174 V175 V176	S174-R178 WeakPolarHBondContact O-CD 3.48Å; S174-R178 WeakPolarHBondContact O-CG 3.41Å; V175-R178 CarbonylContact O-C 3.57Å; V175-R178 WeakPolarHBondContact O-CA 3.41Å; V175-R178 WeakPolarHBondContact O-CB 3.49Å; V175-R178 PolarHBondContact O-N 2.93Å; V176-R178 PolarHBondContact O-N 2.88Å
179	A	76.8	Confident	82.9	Confident	53 Å²	53	54 Å²	54	44%	0.438	30%	0.295	S	S	.	.	H	α-helix	trans	-85.8	-20.5	-178.1	0	0	0	0	0	114.1	V175 V176	V175-A179 WeakPolarHBondContact O-CB 3.33Å; V175-A179 PolarHBondContact O-N 3.28Å; V176-A179 PolarHBondContact O-N 3.22Å
180	G	77.3	Confident	82.8	Confident	33 Å²	33	58.9 Å²	58.9	34%	0.34	31%	0.313	S	S	.	.			trans	92.9	155.5	-176.8	0	0	0	0	0	113.7	V176 N182 S183	V176-G180 CarbonylContact O-C 3.58Å; V176-G180 WeakPolarHBondContact O-CA 3.14Å; V176-G180 PolarHBondContact O-N 3.26Å; G180-N182 PolarHBondContact O-N 3.4Å; G180-S183 WeakPolarHBondContact O-CB 3.45Å; G180-S183 PolarHBondContact O-N 2.89Å; G180-S183 PolarHBondContact O-OG 3.09Å
181	Q	75.2	Confident	82.7	Confident	130 Å²	130	56.8 Å²	56.8	61%	0.607	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-16.5	-173.2	-60.6	-65.5	-5.1	0	0	114.3	V176 S183 A186	V176-Q181 VanDerWaalsContact CG1-OE1 3.3Å; Q181-S183 VanDerWaalsContact C-N 3.3Å; Q181-A186 VanDerWaalsContact O-CB 3.27Å; Q181-A186 WeakPolarHBondContact O-CB 3.48Å
182	N	73.9	Confident	82.9	Confident	133 Å²	133	53.9 Å²	53.9	71%	0.711	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	16.8	178.8	-59.2	18.4	0	0	0	112.3	G180	G180-N182 PolarHBondContact O-N 3.4Å
183	S	80.1	Confident	83.1	Confident	26 Å²	26	55.9 Å²	55.9	18%	0.182	29%	0.294	C	S	.	.	S	Bend	trans	-83.4	148.7	177	55.2	0	0	0	0	111.3	G180 Q181 T185 A186	G180-S183 WeakPolarHBondContact O-CB 3.45Å; G180-S183 PolarHBondContact O-N 2.89Å; G180-S183 PolarHBondContact O-OG 3.09Å; Q181-S183 VanDerWaalsContact C-N 3.3Å; S183-T185 PolarHBondContact O-N 2.89Å; S183-A186 VanDerWaalsContact O-CB 3.29Å; S183-A186 WeakPolarHBondContact O-CB 3.28Å; S183-A186 PolarHBondContact O-N 3.4Å; S183-A186 PolarHBondContact OG-N 3.14Å
184	K	79.1	Confident	83.4	Confident	75 Å²	75	52.2 Å²	52.2	33%	0.326	28%	0.277	S	S	.	.	H	α-helix	trans	-47.1	-46.7	168	-84.6	-171.2	151.5	-150.6	0	111.5	L99 D129 E132 A186 G187 V188	L99-K184 HydrophobicContact CD2-CB 3.83Å; L99-K184 HydrophobicContact CD2-CD 4Å; L99-K184 HydrophobicContact CD2-CG 3.66Å; L99-K184 PolarHBondContact O-NZ 2.99Å; D129-K184 WeakPolarHBondContact OD2-CB 3.19Å; D129-K184 VanDerWaalsContact OD2-CD 3.23Å; D129-K184 WeakPolarHBondContact OD2-CD 3.33Å; E132-K184 IonicContact OE1-NZ 2.62Å; E132-K184 PolarHBondContact OE1-NZ 2.88Å; K184-A186 PolarHBondContact O-N 2.94Å; K184-G187 WeakPolarHBondContact O-CA 3.16Å; K184-G187 PolarHBondContact O-N 3.16Å; K184-V188 PolarHBondContact O-N 3.43Å; K184-V188 VanDerWaalsContact O-N 3.13Å
185	T	83.6	Confident	83.9	Confident	7 Å²	7	50.2 Å²	50.2	4%	0.043	26%	0.263	C	S	.	.	H	α-helix	trans	-52.6	-32.3	175.6	-37.8	0	0	0	0	113.5	D129 P130 L172 V175 V176 S183 R189	D129-T185 PolarHBondContact OD1-OG1 3.46Å; P130-T185 HydrophobicContact CG-CG2 4.46Å; L172-T185 HydrophobicContact CD2-CG2 3.79Å; V175-T185 HydrophobicContact CB-CG2 4.46Å; V175-T185 HydrophobicContact CG1-CG2 3.99Å; V176-T185 HydrophobicContact CG2-CG2 4.2Å; S183-T185 PolarHBondContact O-N 2.89Å; T185-R189 WeakPolarHBondContact O-CB 3.32Å; T185-R189 PolarHBondContact O-N 3.46Å
186	A	83.1	Confident	84.4	Confident	13 Å²	13	49.6 Å²	49.6	11%	0.107	26%	0.258	C	S	.	.	H	α-helix	trans	-72.1	-36.2	175.1	0	0	0	0	0	112.8	V176 Q181 S183 K184 R189 W190	V176-A186 HydrophobicContact CG1-CB 3.76Å; V176-A186 HydrophobicContact CG2-CB 3.93Å; Q181-A186 VanDerWaalsContact O-CB 3.27Å; Q181-A186 WeakPolarHBondContact O-CB 3.48Å; S183-A186 VanDerWaalsContact O-CB 3.29Å; S183-A186 WeakPolarHBondContact O-CB 3.28Å; S183-A186 PolarHBondContact O-N 3.4Å; S183-A186 PolarHBondContact OG-N 3.14Å; K184-A186 PolarHBondContact O-N 2.94Å; A186-R189 PolarHBondContact O-N 2.84Å; A186-W190 PolarHBondContact O-N 3.33Å
187	G	83.6	Confident	84.9	Confident	30 Å²	30	49.6 Å²	49.6	31%	0.309	26%	0.258	S	S	.	.	H	α-helix	trans	-63.2	-44.5	171.2	0	0	0	0	0	112	K184 R189 W190 L191	K184-G187 WeakPolarHBondContact O-CA 3.16Å; K184-G187 PolarHBondContact O-N 3.16Å; G187-R189 PolarHBondContact O-N 3.12Å; G187-W190 PolarHBondContact O-N 3.48Å; G187-L191 WeakPolarHBondContact O-CG 3.35Å; G187-L191 PolarHBondContact O-N 3.44Å
188	V	84.8	Confident	85.5	Confident	7 Å²	7	43.3 Å²	43.3	4%	0.042	23%	0.226	C	C	.	.	H	α-helix	trans	-61.2	-44.1	174.5	-178.6	0	0	0	0	111.2	A135 L172 K184 W190 L191 L192	A135-V188 HydrophobicContact CB-CG1 3.77Å; L172-V188 HydrophobicContact CD1-CG1 4.17Å; K184-V188 PolarHBondContact O-N 3.43Å; K184-V188 VanDerWaalsContact O-N 3.13Å; V188-W190 VanDerWaalsContact C-N 3.33Å; V188-W190 PolarHBondContact O-N 3.07Å; V188-L191 PolarHBondContact O-N 2.89Å; V188-L192 HydrophobicContact CG1-CD1 4.22Å; V188-L192 HydrophobicContact CG1-CG 4.47Å; V188-L192 WeakPolarHBondContact O-CG 3.32Å; V188-L192 PolarHBondContact O-N 3.41Å
189	R	89.1	Confident	86.4	Confident	50 Å²	50	35.9 Å²	35.9	19%	0.189	20%	0.198	C	C	.	.	H	α-helix	trans	-57.1	-44.2	174	176.9	-175	150.4	75.5	1.2	112	V169 L172 Q173 V176 T185 A186 G187 L192 Q193	V169-R189 VanDerWaalsContact CG1-NH1 3.34Å; V169-R189 PolarHBondContact O-NH1 2.96Å; L172-R189 HydrophobicContact CB-CB 3.97Å; L172-R189 HydrophobicContact CB-CG 4.18Å; L172-R189 HydrophobicContact CD1-CB 4.16Å; Q173-R189 VanDerWaalsContact CB-NH1 3.27Å; Q173-R189 VanDerWaalsContact CD-NH2 3.34Å; Q173-R189 VanDerWaalsContact OE1-CZ 3.23Å; V176-R189 HydrophobicContact CG2-CB 4.41Å; T185-R189 WeakPolarHBondContact O-CB 3.32Å; T185-R189 PolarHBondContact O-N 3.46Å; A186-R189 PolarHBondContact O-N 2.84Å; G187-R189 PolarHBondContact O-N 3.12Å; R189-L192 PolarHBondContact O-N 3.44Å; R189-Q193 WeakPolarHBondContact O-CB 3.32Å; R189-Q193 PolarHBondContact O-N 3.44Å
190	W	87.8	Confident	87.3	Confident	103 Å²	103	35.3 Å²	35.3	39%	0.39	18%	0.184	S	C	.	.	H	α-helix	trans	-64.5	-43.8	179.4	-179.2	85.8	0	0	0	111.9	A186 G187 V188 L192 Q193 Q194 E490	A186-W190 PolarHBondContact O-N 3.33Å; G187-W190 PolarHBondContact O-N 3.48Å; V188-W190 VanDerWaalsContact C-N 3.33Å; V188-W190 PolarHBondContact O-N 3.07Å; W190-L192 PolarHBondContact O-N 3.07Å; W190-Q193 WeakPolarHBondContact O-CB 3.36Å; W190-Q193 PolarHBondContact O-N 3.48Å; W190-Q194 HydrophobicContact CD2-CG 4.19Å; W190-Q194 HydrophobicContact CE3-CG 4.45Å; W190-Q194 HydrophobicContact CH2-CG 4.07Å; W190-Q194 HydrophobicContact CZ2-CG 3.77Å; W190-Q194 HydrophobicContact CZ3-CG 4.4Å; W190-Q194 PolarHBondContact O-N 2.8Å; W190-E490 HydrophobicContact CH2-CG 4.24Å
191	L	88.1	Confident	88.2	Confident	39 Å²	39	33.7 Å²	33.7	20%	0.204	17%	0.168	C	C	.	.	H	α-helix	trans	-60.1	-44.5	175.5	-70	169.4	0	0	0	112.1	G187 V188 Q193 Q194 E195 F492	G187-L191 WeakPolarHBondContact O-CG 3.35Å; G187-L191 PolarHBondContact O-N 3.44Å; V188-L191 PolarHBondContact O-N 2.89Å; L191-Q193 VanDerWaalsContact C-N 3.32Å; L191-Q193 PolarHBondContact O-N 3.37Å; L191-Q194 PolarHBondContact O-N 2.9Å; L191-E195 WeakPolarHBondContact O-CB 3.35Å; L191-E195 PolarHBondContact O-N 2.89Å; L191-F492 HydrophobicContact CD2-CD2 4.37Å; L191-F492 HydrophobicContact CD2-CE2 4.06Å
192	L	90	Very high	89.2	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-70.5	-27	177.6	-63.8	-179.1	0	0	0	113.1	A135 L138 K168 V169 L172 V188 R189 W190 E195 N196	A135-L192 HydrophobicContact CB-CD1 4.5Å; L138-L192 HydrophobicContact CD1-CD1 3.9Å; L138-L192 HydrophobicContact CD1-CD2 3.42Å; L138-L192 VanDerWaalsContact CD1-CD2 3.42Å; L138-L192 HydrophobicContact CD1-CG 4.33Å; K168-L192 HydrophobicContact CB-CD1 4.14Å; V169-L192 HydrophobicContact CG2-CB 3.64Å; L172-L192 HydrophobicContact CD1-CD1 3.9Å; V188-L192 HydrophobicContact CG1-CD1 4.22Å; V188-L192 HydrophobicContact CG1-CG 4.47Å; V188-L192 WeakPolarHBondContact O-CG 3.32Å; V188-L192 PolarHBondContact O-N 3.41Å; R189-L192 PolarHBondContact O-N 3.44Å; W190-L192 PolarHBondContact O-N 3.07Å; L192-E195 WeakPolarHBondContact CD2-OE2 3.12Å; L192-N196 PolarHBondContact O-N 2.92Å
193	Q	91.8	Very high	90.2	Very high	42 Å²	42	21.5 Å²	21.5	20%	0.196	11%	0.108	C	C	.	.	H	α-helix	trans	-68.9	-45.8	170.3	-178.5	64.1	76.9	0	0	110.9	V169 R189 W190 L191 E195 N196 C197	V169-Q193 HydrophobicContact CG2-CB 4.42Å; R189-Q193 WeakPolarHBondContact O-CB 3.32Å; R189-Q193 PolarHBondContact O-N 3.44Å; W190-Q193 WeakPolarHBondContact O-CB 3.36Å; W190-Q193 PolarHBondContact O-N 3.48Å; L191-Q193 VanDerWaalsContact C-N 3.32Å; L191-Q193 PolarHBondContact O-N 3.37Å; Q193-E195 VanDerWaalsContact C-N 3.28Å; Q193-E195 PolarHBondContact O-N 3.4Å; Q193-N196 PolarHBondContact O-N 3.19Å; Q193-C197 PolarHBondContact NE2-SG 2.72Å; Q193-C197 WeakPolarHBondContact O-CB 3.33Å; Q193-C197 PolarHBondContact O-N 3.2Å; Q193-C197 PolarHBondContact O-SG 3.31Å
194	Q	92.1	Very high	90.9	Very high	7 Å²	7	22.5 Å²	22.5	3%	0.033	12%	0.115	C	C	.	.	H	α-helix	trans	-63.4	-35.5	175.2	-71.9	-63.6	-3.3	0	0	111.9	W190 L191 C197 T198 E426 F492 H493	W190-Q194 HydrophobicContact CD2-CG 4.19Å; W190-Q194 HydrophobicContact CE3-CG 4.45Å; W190-Q194 HydrophobicContact CH2-CG 4.07Å; W190-Q194 HydrophobicContact CZ2-CG 3.77Å; W190-Q194 HydrophobicContact CZ3-CG 4.4Å; W190-Q194 PolarHBondContact O-N 2.8Å; L191-Q194 PolarHBondContact O-N 2.9Å; Q194-C197 PolarHBondContact O-N 3.47Å; Q194-T198 WeakPolarHBondContact O-CB 3.39Å; Q194-T198 PolarHBondContact O-N 3.34Å; Q194-T198 PolarHBondContact O-OG1 3.46Å; Q194-E426 PolarHBondContact NE2-OE1 2.99Å; Q194-F492 HydrophobicContact CB-CB 4.06Å; Q194-F492 HydrophobicContact CB-CD2 3.76Å; Q194-F492 HydrophobicContact CB-CE2 4.35Å; Q194-F492 HydrophobicContact CB-CG 3.9Å; Q194-H493 PolarHBondContact NE2-NE2 3.38Å
195	E	94.6	Very high	91.6	Very high	1 Å²	1	19 Å²	19	1%	0.005	10%	0.099	C	C	.	.	H	α-helix	trans	-61.7	-48.8	171.8	-174.1	172.6	-179.7	0	0	112.3	F142 L191 L192 Q193 C197 T198 W199 F492 R527 F528	F142-E195 WeakPolarHBondContact CZ-OE1 3.37Å; L191-E195 WeakPolarHBondContact O-CB 3.35Å; L191-E195 PolarHBondContact O-N 2.89Å; L192-E195 WeakPolarHBondContact CD2-OE2 3.12Å; Q193-E195 VanDerWaalsContact C-N 3.28Å; Q193-E195 PolarHBondContact O-N 3.4Å; E195-C197 PolarHBondContact O-N 3.22Å; E195-T198 PolarHBondContact O-N 2.87Å; E195-W199 VanDerWaalsContact O-CD1 3.23Å; E195-W199 PolarHBondContact O-N 3.21Å; E195-W199 PolarHBondContact OE1-NE1 2.77Å; E195-F492 HydrophobicContact CB-CE1 4.02Å; E195-F492 HydrophobicContact CB-CZ 3.87Å; E195-F492 HydrophobicContact CG-CE1 4.41Å; E195-F492 HydrophobicContact CG-CZ 4.46Å; E195-R527 IonicContact OE1-CZ 2.64Å; E195-R527 IonicContact OE1-NE 3.56Å; E195-R527 IonicContact OE1-NH2 2.62Å; E195-R527 PolarHBondContact OE1-NH2 2.95Å; E195-R527 IonicContact OE2-CZ 3.01Å; E195-R527 IonicContact OE2-NH2 3.73Å; E195-R527 PolarHBondContact OE2-NH2 3.27Å; E195-F528 HydrophobicContact CG-CD2 3.67Å; E195-F528 HydrophobicContact CG-CE2 4.2Å
196	N	94.1	Very high	92.1	Very high	3 Å²	3	19.1 Å²	19.1	2%	0.016	10%	0.099	C	C	.	.	H	α-helix	trans	-57.7	-47.3	174.4	176.1	-83.2	0	0	0	111.8	Q162 C165 Q166 L192 Q193 T198 W199 R200	Q162-N196 PolarHBondContact O-ND2 3.32Å; C165-N196 HydrophobicContact CB-CB 3.96Å; Q166-N196 PolarHBondContact OE1-ND2 2.82Å; L192-N196 PolarHBondContact O-N 2.92Å; Q193-N196 PolarHBondContact O-N 3.19Å; N196-T198 VanDerWaalsContact C-N 3.3Å; N196-T198 PolarHBondContact O-N 2.81Å; N196-W199 PolarHBondContact O-N 3.13Å; N196-R200 WeakPolarHBondContact O-CB 3.46Å; N196-R200 PolarHBondContact O-N 2.95Å; N196-R200 PolarHBondContact OD1-NH2 3.34Å
197	C	94.9	Very high	92.6	Very high	2 Å²	2	23.3 Å²	23.3	1%	0.014	11%	0.112	C	C	.	.	H	α-helix	trans	-58	-42.9	176.7	-67.5	0	0	0	0	111.5	Q193 Q194 E195 R200 L201 W252 I256	Q193-C197 PolarHBondContact NE2-SG 2.72Å; Q193-C197 WeakPolarHBondContact O-CB 3.33Å; Q193-C197 PolarHBondContact O-N 3.2Å; Q193-C197 PolarHBondContact O-SG 3.31Å; Q194-C197 PolarHBondContact O-N 3.47Å; E195-C197 PolarHBondContact O-N 3.22Å; C197-R200 WeakPolarHBondContact O-CB 3.46Å; C197-R200 PolarHBondContact O-N 3.16Å; C197-L201 PolarHBondContact O-N 3.32Å; C197-W252 HydrophobicContact CB-CZ2 4.46Å; C197-W252 PolarHBondContact O-NE1 3.23Å; C197-I256 HydrophobicContact CB-CD1 3.81Å; C197-I256 HydrophobicContact CB-CG1 4.32Å
198	T	96.8	Very high	93	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-69.2	-43.1	-179.4	-49.8	0	0	0	0	111.5	Q194 E195 N196 R200 L201 I202 I495 Q496 F528	Q194-T198 WeakPolarHBondContact O-CB 3.39Å; Q194-T198 PolarHBondContact O-N 3.34Å; Q194-T198 PolarHBondContact O-OG1 3.46Å; E195-T198 PolarHBondContact O-N 2.87Å; N196-T198 VanDerWaalsContact C-N 3.3Å; N196-T198 PolarHBondContact O-N 2.81Å; T198-R200 VanDerWaalsContact C-N 3.27Å; T198-R200 PolarHBondContact O-N 3.35Å; T198-L201 WeakPolarHBondContact O-CB 3.48Å; T198-L201 PolarHBondContact O-N 2.89Å; T198-I202 HydrophobicContact CG2-CD1 3.92Å; T198-I202 WeakPolarHBondContact O-CD1 3.5Å; T198-I202 VanDerWaalsContact O-CG1 3.25Å; T198-I202 WeakPolarHBondContact O-CG1 3.46Å; T198-I202 PolarHBondContact O-N 3.01Å; T198-I495 HydrophobicContact CG2-CG2 4.03Å; T198-Q496 HydrophobicContact CG2-CG 3.91Å; T198-Q496 PolarHBondContact OG1-NE2 3.33Å; T198-F528 HydrophobicContact CG2-CE1 4.4Å; T198-F528 HydrophobicContact CG2-CE2 4.28Å; T198-F528 HydrophobicContact CG2-CZ 3.6Å
199	W	96.7	Very high	93.3	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-61.2	-35.6	174	-72.5	127.1	0	0	0	112.6	F142 L158 Y161 Q162 E195 N196 I202 A203 F528 H531 L532	F142-W199 AromaticContact CE1-CZ2 3.99Å; F142-W199 HydrophobicContact CE1-CZ2 3.99Å; F142-W199 AromaticContact CE1-NE1 3.79Å; F142-W199 AromaticContact CZ-NE1 3.82Å; L158-W199 HydrophobicContact CD2-CD2 4.46Å; L158-W199 HydrophobicContact CD2-CE3 3.53Å; L158-W199 HydrophobicContact CD2-CZ3 3.65Å; Y161-W199 HydrophobicContact CD2-CD2 4.14Å; Y161-W199 AromaticContact CD2-CE2 3.87Å; Y161-W199 HydrophobicContact CD2-CE3 4.3Å; Y161-W199 AromaticContact CD2-CH2 3.98Å; Y161-W199 HydrophobicContact CD2-CH2 3.98Å; Y161-W199 AromaticContact CD2-CZ2 3.8Å; Y161-W199 HydrophobicContact CD2-CZ2 3.8Å; Y161-W199 HydrophobicContact CD2-CZ3 4.22Å; Y161-W199 HydrophobicContact CE2-CH2 4.08Å; Y161-W199 HydrophobicContact CE2-CZ2 4.14Å; Q162-W199 HydrophobicContact CG-CB 3.65Å; E195-W199 VanDerWaalsContact O-CD1 3.23Å; E195-W199 PolarHBondContact O-N 3.21Å; E195-W199 PolarHBondContact OE1-NE1 2.77Å; N196-W199 PolarHBondContact O-N 3.13Å; W199-I202 HydrophobicContact CE3-CD1 3.85Å; W199-I202 HydrophobicContact CZ3-CD1 4.12Å; W199-A203 VanDerWaalsContact O-CB 3.3Å; W199-A203 WeakPolarHBondContact O-CB 3.45Å; W199-A203 PolarHBondContact O-N 2.94Å; W199-F528 HydrophobicContact CD2-CD2 4.32Å; W199-F528 AromaticContact CD2-CE2 3.7Å; W199-F528 HydrophobicContact CD2-CE2 3.7Å; W199-F528 AromaticContact CE2-CD2 3.49Å; W199-F528 VanDerWaalsContact CE2-CD2 3.49Å; W199-F528 AromaticContact CE2-CE2 3.34Å; W199-F528 HydrophobicContact CE3-CE2 4.15Å; W199-F528 HydrophobicContact CG-CE2 4.22Å; W199-F528 HydrophobicContact CH2-CD2 4.21Å; W199-F528 AromaticContact CH2-CE2 3.99Å; W199-F528 HydrophobicContact CH2-CE2 3.99Å; W199-F528 AromaticContact CZ2-CD2 3.43Å; W199-F528 HydrophobicContact CZ2-CD2 3.43Å; W199-F528 VanDerWaalsContact CZ2-CD2 3.43Å; W199-F528 AromaticContact CZ2-CE2 3.51Å; W199-F528 HydrophobicContact CZ2-CE2 3.51Å; W199-F528 HydrophobicContact CZ2-CG 4.38Å; W199-F528 HydrophobicContact CZ2-CZ 4.46Å; W199-F528 HydrophobicContact CZ3-CE2 4.29Å; W199-F528 AromaticContact NE1-CD2 3.57Å; W199-F528 AromaticContact NE1-CE2 3.63Å; W199-H531 HydrophobicContact CH2-CB 3.96Å; W199-H531 HydrophobicContact CZ2-CB 4.06Å; W199-L532 HydrophobicContact CH2-CB 4.32Å; W199-L532 HydrophobicContact CZ3-CD1 4.21Å
200	R	95.6	Very high	93.3	Very high	40 Å²	40	24.9 Å²	24.9	15%	0.151	12%	0.115	C	C	.	.	H	α-helix	trans	-64.1	-45.3	174.8	-163.9	-171.6	-53.7	-176.1	-0.8	112.1	N196 C197 T198 A203 S204 S255 D259	N196-R200 WeakPolarHBondContact O-CB 3.46Å; N196-R200 PolarHBondContact O-N 2.95Å; N196-R200 PolarHBondContact OD1-NH2 3.34Å; C197-R200 WeakPolarHBondContact O-CB 3.46Å; C197-R200 PolarHBondContact O-N 3.16Å; T198-R200 VanDerWaalsContact C-N 3.27Å; T198-R200 PolarHBondContact O-N 3.35Å; R200-A203 PolarHBondContact O-N 2.61Å; R200-S204 PolarHBondContact O-N 2.71Å; R200-S204 VanDerWaalsContact O-N 3.09Å; R200-S204 PolarHBondContact O-OG 2.84Å; R200-S255 PolarHBondContact NH1-OG 3.05Å; R200-D259 IonicContact CZ-OD2 2.8Å; R200-D259 IonicContact NH1-OD2 3.13Å; R200-D259 PolarHBondContact NH1-OD2 3.48Å; R200-D259 IonicContact NH2-OD2 3.66Å; R200-D259 PolarHBondContact NH2-OD2 3.04Å
201	L	96.9	Very high	93.2	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-59.3	-49.9	174.8	176	62	0	0	0	112	C197 T198 A203 S204 L205 V249 W252 Q496 V499 I500	C197-L201 PolarHBondContact O-N 3.32Å; T198-L201 WeakPolarHBondContact O-CB 3.48Å; T198-L201 PolarHBondContact O-N 2.89Å; L201-A203 VanDerWaalsContact C-N 3.32Å; L201-A203 PolarHBondContact O-N 3Å; L201-S204 PolarHBondContact O-N 3.18Å; L201-L205 HydrophobicContact CD1-CD1 3.54Å; L201-L205 HydrophobicContact CD1-CG 4.02Å; L201-L205 HydrophobicContact CG-CD1 4.09Å; L201-L205 PolarHBondContact O-N 2.92Å; L201-V249 HydrophobicContact CD1-CG2 4.34Å; L201-W252 HydrophobicContact CB-CD2 3.98Å; L201-W252 HydrophobicContact CB-CG 4.2Å; L201-W252 HydrophobicContact CB-CZ2 4.11Å; L201-W252 HydrophobicContact CD1-CD2 3.78Å; L201-W252 HydrophobicContact CD1-CE3 3.73Å; L201-W252 HydrophobicContact CD1-CG 4.11Å; L201-W252 HydrophobicContact CD1-CZ3 4.27Å; L201-W252 HydrophobicContact CD2-CD2 4.44Å; L201-W252 HydrophobicContact CD2-CE3 4.31Å; L201-W252 HydrophobicContact CD2-CH2 3.93Å; L201-W252 HydrophobicContact CD2-CZ2 4.01Å; L201-W252 HydrophobicContact CD2-CZ3 4.06Å; L201-W252 HydrophobicContact CG-CD2 4.28Å; L201-W252 HydrophobicContact CG-CE3 4.43Å; L201-Q496 HydrophobicContact CD2-CB 3.81Å; L201-Q496 HydrophobicContact CD2-CG 3.82Å; L201-V499 HydrophobicContact CD2-CG1 4.07Å; L201-V499 HydrophobicContact CG-CG1 4.04Å; L201-I500 HydrophobicContact CD1-CD1 4.45Å; L201-I500 HydrophobicContact CD1-CG1 4.09Å; L201-I500 HydrophobicContact CD2-CD1 4.12Å; L201-I500 HydrophobicContact CD2-CG1 4.01Å
202	I	96.6	Very high	93	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-59.5	-45.7	179.1	-65.4	159.6	0	0	0	109.8	L158 T198 W199 S204 Y206 V499 F528 L532 F535	L158-I202 HydrophobicContact CD1-CB 4.47Å; L158-I202 HydrophobicContact CD1-CG2 3.84Å; T198-I202 HydrophobicContact CG2-CD1 3.92Å; T198-I202 WeakPolarHBondContact O-CD1 3.5Å; T198-I202 VanDerWaalsContact O-CG1 3.25Å; T198-I202 WeakPolarHBondContact O-CG1 3.46Å; T198-I202 PolarHBondContact O-N 3.01Å; W199-I202 HydrophobicContact CE3-CD1 3.85Å; W199-I202 HydrophobicContact CZ3-CD1 4.12Å; I202-S204 PolarHBondContact O-N 3.39Å; I202-Y206 HydrophobicContact CG2-CD2 3.86Å; I202-Y206 HydrophobicContact CG2-CE2 4.48Å; I202-Y206 WeakPolarHBondContact O-CB 3.24Å; I202-Y206 PolarHBondContact O-N 3.38Å; I202-V499 HydrophobicContact CG1-CG1 3.92Å; I202-V499 HydrophobicContact CG1-CG2 4.11Å; I202-F528 HydrophobicContact CD1-CZ 4.03Å; I202-L532 HydrophobicContact CD1-CD1 3.61Å; I202-L532 HydrophobicContact CG1-CD1 4.46Å; I202-F535 HydrophobicContact CG2-CD1 4Å; I202-F535 HydrophobicContact CG2-CE1 3.37Å; I202-F535 HydrophobicContact CG2-CZ 3.69Å
203	A	94.8	Very high	92.5	Very high	7 Å²	7	27.2 Å²	27.2	6%	0.058	14%	0.143	C	C	.	.	H	α-helix	trans	-60.9	-40.9	179.4	0	0	0	0	0	112.9	L158 W199 R200 L201 R207	L158-A203 HydrophobicContact CB-CB 4.17Å; L158-A203 HydrophobicContact CD1-CB 3.83Å; W199-A203 VanDerWaalsContact O-CB 3.3Å; W199-A203 WeakPolarHBondContact O-CB 3.45Å; W199-A203 PolarHBondContact O-N 2.94Å; R200-A203 PolarHBondContact O-N 2.61Å; L201-A203 VanDerWaalsContact C-N 3.32Å; L201-A203 PolarHBondContact O-N 3Å; A203-R207 WeakPolarHBondContact O-CB 3.4Å; A203-R207 PolarHBondContact O-N 3.29Å
204	S	94	Very high	91.9	Very high	46 Å²	46	31.5 Å²	31.5	32%	0.322	17%	0.167	S	C	.	.	H	α-helix	trans	-68.8	-53.7	176.4	-64.8	0	0	0	0	112.3	R200 L201 I202 R207 D208	R200-S204 PolarHBondContact O-N 2.71Å; R200-S204 VanDerWaalsContact O-N 3.09Å; R200-S204 PolarHBondContact O-OG 2.84Å; L201-S204 PolarHBondContact O-N 3.18Å; I202-S204 PolarHBondContact O-N 3.39Å; S204-R207 PolarHBondContact O-N 3.38Å; S204-D208 PolarHBondContact O-N 3.12Å
205	L	95.4	Very high	91	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-68.9	-39.5	-174	-72.5	178.1	0	0	0	113.2	L201 D208 R209 Q245 L248 V249 V499 I500	L201-L205 HydrophobicContact CD1-CD1 3.54Å; L201-L205 HydrophobicContact CD1-CG 4.02Å; L201-L205 HydrophobicContact CG-CD1 4.09Å; L201-L205 PolarHBondContact O-N 2.92Å; L205-D208 PolarHBondContact O-N 2.94Å; L205-R209 VanDerWaalsContact O-CG 3.27Å; L205-R209 WeakPolarHBondContact O-CG 3.22Å; L205-R209 PolarHBondContact O-N 3.05Å; L205-Q245 HydrophobicContact CD2-CB 3.85Å; L205-Q245 HydrophobicContact CD2-CG 3.98Å; L205-L248 HydrophobicContact CD2-CB 4.1Å; L205-L248 HydrophobicContact CD2-CD1 4.35Å; L205-V249 HydrophobicContact CD1-CG2 4.41Å; L205-V249 HydrophobicContact CD2-CG2 4.46Å; L205-V499 HydrophobicContact CD1-CG1 4.16Å; L205-I500 HydrophobicContact CD1-CG1 4.04Å
206	Y	93.8	Very high	89.3	Confident	10 Å²	10	42.2 Å²	42.2	4%	0.039	22%	0.217	C	C	.	.	H	α-helix	trans	-77.6	-23.4	178.7	-78.3	-86	0	0	0	112.9	F155 I202 V210 V499 F535 F536 L539 L541	F155-Y206 WeakPolarHBondContact CZ-O 3.47Å; I202-Y206 HydrophobicContact CG2-CD2 3.86Å; I202-Y206 HydrophobicContact CG2-CE2 4.48Å; I202-Y206 WeakPolarHBondContact O-CB 3.24Å; I202-Y206 PolarHBondContact O-N 3.38Å; Y206-V210 VanDerWaalsContact O-CB 3.28Å; Y206-V210 WeakPolarHBondContact O-CB 3.21Å; Y206-V210 WeakPolarHBondContact O-CG2 3.43Å; Y206-V210 PolarHBondContact O-N 2.73Å; Y206-V499 HydrophobicContact CE2-CG1 4.32Å; Y206-F535 HydrophobicContact CD2-CE1 4.17Å; Y206-F535 HydrophobicContact CD2-CZ 4.49Å; Y206-F535 HydrophobicContact CG-CE1 4.07Å; Y206-F535 HydrophobicContact CG-CZ 4.11Å; Y206-F536 HydrophobicContact CD2-CE1 4.41Å; Y206-F536 HydrophobicContact CE1-CD1 4.47Å; Y206-F536 HydrophobicContact CE1-CE1 4.2Å; Y206-F536 AromaticContact CE2-CE1 3.74Å; Y206-F536 HydrophobicContact CE2-CE1 3.74Å; Y206-F536 HydrophobicContact CE2-CZ 4.45Å; Y206-F536 AromaticContact CZ-CE1 3.63Å; Y206-L539 HydrophobicContact CD1-CD1 3.88Å; Y206-L539 HydrophobicContact CG-CD1 4.3Å; Y206-L541 HydrophobicContact CD1-CD1 4.17Å; Y206-L541 HydrophobicContact CE1-CD1 3.68Å
207	R	92.5	Very high	87.1	Confident	102 Å²	102	49.8 Å²	49.8	39%	0.385	26%	0.257	S	S	.	.	H	α-helix	trans	-66	-42.8	169.9	-172.6	175.3	-61.4	-170.2	0	110.9	F155 E159 A203 S204 Q211	F155-R207 HydrophobicContact CD1-CB 4.32Å; F155-R207 HydrophobicContact CE1-CB 3.95Å; F155-R207 HydrophobicContact CZ-CB 4.21Å; E159-R207 IonicContact OE1-CZ 2.72Å; E159-R207 IonicContact OE1-NH1 2.7Å; E159-R207 PolarHBondContact OE1-NH1 3.41Å; E159-R207 IonicContact OE1-NH2 3.65Å; E159-R207 PolarHBondContact OE1-NH2 2.85Å; A203-R207 WeakPolarHBondContact O-CB 3.4Å; A203-R207 PolarHBondContact O-N 3.29Å; S204-R207 PolarHBondContact O-N 3.38Å; R207-Q211 VanDerWaalsContact O-CB 3.3Å; R207-Q211 WeakPolarHBondContact O-CB 3.45Å; R207-Q211 PolarHBondContact O-N 3.35Å
208	D	91.9	Very high	85.1	Confident	21 Å²	21	57.6 Å²	57.6	11%	0.112	30%	0.295	C	S	.	.	H	α-helix	trans	-60	-56.3	171.6	-172.9	76.7	0	0	0	112	S204 L205 V210 Q211 L212 R244 Q245 L248	S204-D208 PolarHBondContact O-N 3.12Å; L205-D208 PolarHBondContact O-N 2.94Å; D208-V210 VanDerWaalsContact C-N 3.31Å; D208-V210 PolarHBondContact O-N 3.12Å; D208-Q211 PolarHBondContact O-N 3.29Å; D208-Q211 VanDerWaalsContact O-N 3.08Å; D208-L212 WeakPolarHBondContact O-CG 3.47Å; D208-L212 PolarHBondContact O-N 3.48Å; D208-R244 WeakPolarHBondContact OD1-CD 3.26Å; D208-R244 IonicContact OD1-CZ 2.71Å; D208-R244 IonicContact OD1-NE 3.74Å; D208-R244 PolarHBondContact OD1-NE 2.93Å; D208-R244 IonicContact OD1-NH2 3.18Å; D208-R244 IonicContact OD2-NE 2.73Å; D208-R244 PolarHBondContact OD2-NE 2.87Å; D208-R244 IonicContact OD2-NH2 2.75Å; D208-Q245 VanDerWaalsContact OD2-CG 3.28Å; D208-Q245 WeakPolarHBondContact OD2-CG 3.3Å; D208-Q245 PolarHBondContact OD2-NE2 3.19Å; D208-L248 HydrophobicContact CB-CD1 3.73Å
209	R	91.8	Very high	82.8	Confident	48 Å²	48	64 Å²	64	18%	0.181	33%	0.327	C	S	.	.	H	α-helix	trans	-58.3	-39.8	-177.1	-70.6	169.3	-178.9	169.2	3.2	113	L205 A213 Q245 V499 I500	L205-R209 VanDerWaalsContact O-CG 3.27Å; L205-R209 WeakPolarHBondContact O-CG 3.22Å; L205-R209 PolarHBondContact O-N 3.05Å; R209-A213 PolarHBondContact O-N 3.18Å; R209-Q245 VanDerWaalsContact CG-NE2 3.35Å; R209-Q245 VanDerWaalsContact CZ-OE1 3.31Å; R209-V499 PolarHBondContact NH1-O 2.82Å; R209-I500 PolarHBondContact NH2-O 3.2Å
210	V	88.6	Confident	80.4	Confident	50 Å²	50	71.5 Å²	71.5	30%	0.303	37%	0.365	S	S	.	.	H	α-helix	trans	-73.9	-34.6	177.1	172.2	0	0	0	0	111.9	F155 Y206 D208 L214 L539	F155-V210 HydrophobicContact CE2-CB 4.45Å; F155-V210 HydrophobicContact CE2-CG1 4.43Å; F155-V210 HydrophobicContact CZ-CB 4.27Å; F155-V210 HydrophobicContact CZ-CG2 4.19Å; Y206-V210 VanDerWaalsContact O-CB 3.28Å; Y206-V210 WeakPolarHBondContact O-CB 3.21Å; Y206-V210 WeakPolarHBondContact O-CG2 3.43Å; Y206-V210 PolarHBondContact O-N 2.73Å; D208-V210 VanDerWaalsContact C-N 3.31Å; D208-V210 PolarHBondContact O-N 3.12Å; V210-L214 WeakPolarHBondContact O-CG 3.09Å; V210-L539 HydrophobicContact CG2-CD1 4.36Å; V210-L539 HydrophobicContact CG2-CD2 4.3Å
211	Q	85.7	Confident	77.9	Confident	78 Å²	78	76 Å²	76	36%	0.364	39%	0.393	S	S	.	.	H	α-helix	trans	-65.9	-43.5	176.2	-177.7	171.2	-17.3	0	0	111.5	R207 D208 A213 L214 E215	R207-Q211 VanDerWaalsContact O-CB 3.3Å; R207-Q211 WeakPolarHBondContact O-CB 3.45Å; R207-Q211 PolarHBondContact O-N 3.35Å; D208-Q211 PolarHBondContact O-N 3.29Å; D208-Q211 VanDerWaalsContact O-N 3.08Å; Q211-A213 PolarHBondContact O-N 3.02Å; Q211-L214 WeakPolarHBondContact O-CB 3.34Å; Q211-L214 PolarHBondContact O-N 3.4Å; Q211-E215 HydrophobicContact CG-CG 4.46Å; Q211-E215 VanDerWaalsContact CG-OE1 3.26Å; Q211-E215 WeakPolarHBondContact CG-OE1 3.44Å; Q211-E215 PolarHBondContact NE2-OE1 2.72Å; Q211-E215 PolarHBondContact O-N 2.87Å
212	L	83.9	Confident	75.5	Confident	38 Å²	38	83.4 Å²	83.4	20%	0.199	43%	0.429	C	S	.	.	H	α-helix	trans	-58.2	-45.9	177.1	-65.3	166.5	0	0	0	113	D208 L214 E215 E216 A241	D208-L212 WeakPolarHBondContact O-CG 3.47Å; D208-L212 PolarHBondContact O-N 3.48Å; L212-L214 PolarHBondContact O-N 3.11Å; L212-E215 PolarHBondContact O-N 2.71Å; L212-E216 PolarHBondContact O-N 2.94Å; L212-A241 HydrophobicContact CD1-CB 3.99Å
213	A	80.8	Confident	73.2	Confident	75 Å²	75	88.5 Å²	88.5	62%	0.62	46%	0.46	S	S	*	.	H	α-helix	trans	-63.4	-7.4	179.1	0	0	0	0	0	113.7	R209 Q211	R209-A213 PolarHBondContact O-N 3.18Å; Q211-A213 PolarHBondContact O-N 3.02Å
214	L	77.5	Confident	71.3	Confident	132 Å²	132	92.4 Å²	92.4	69%	0.691	48%	0.483	S	S	*	.	H	α-helix	trans	-104.6	-16.7	172	-60.9	169.7	0	0	0	113.1	V210 Q211 L212	V210-L214 WeakPolarHBondContact O-CG 3.09Å; Q211-L214 WeakPolarHBondContact O-CB 3.34Å; Q211-L214 PolarHBondContact O-N 3.4Å; L212-L214 PolarHBondContact O-N 3.11Å
215	E	73.7	Confident	69.5	Low	75 Å²	75	95.9 Å²	95.9	35%	0.35	51%	0.505	S	S	.	.	H	α-helix	trans	-103.2	-23	-175.3	-71.3	178.3	-176.4	0	0	113.5	Q211 L212 D217 M218	Q211-E215 HydrophobicContact CG-CG 4.46Å; Q211-E215 VanDerWaalsContact CG-OE1 3.26Å; Q211-E215 WeakPolarHBondContact CG-OE1 3.44Å; Q211-E215 PolarHBondContact NE2-OE1 2.72Å; Q211-E215 PolarHBondContact O-N 2.87Å; L212-E215 PolarHBondContact O-N 2.71Å; E215-D217 PolarHBondContact O-N 3.29Å; E215-D217 VanDerWaalsContact O-N 3.11Å; E215-M218 PolarHBondContact O-N 3.04Å
216	E	58.6	Low	67.8	Low	158 Å²	158	97.2 Å²	97.2	74%	0.738	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-27.3	177.2	-77.9	-176	163.8	0	0	113.6	L212 M218	L212-E216 PolarHBondContact O-N 2.94Å; E216-M218 PolarHBondContact O-N 2.93Å
217	D	49.6	Very low	66.5	Low	163 Å²	163	103.3 Å²	103.3	87%	0.872	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-5.6	178.2	-114.1	-2.1	0	0	0	114.1	E215	E215-D217 PolarHBondContact O-N 3.29Å; E215-D217 VanDerWaalsContact O-N 3.11Å
218	M	51.8	Low	66	Low	165 Å²	165	98.7 Å²	98.7	81%	0.813	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.6	-8.3	-170.4	-65.5	-163.8	66.2	0	0	116.4	E215 E216 I220	E215-M218 PolarHBondContact O-N 3.04Å; E216-M218 PolarHBondContact O-N 2.93Å; M218-I220 PolarHBondContact O-N 3.02Å
219	M	49	Very low	65.5	Low	134 Å²	134	98.6 Å²	98.6	66%	0.66	53%	0.525	S	S	*	.			trans	-77.3	119.6	-174.7	-69.5	-70.8	-171.3	0	0	112.9
220	I	45.3	Very low	65.2	Low	158 Å²	158	97 Å²	97	81%	0.81	52%	0.519	S	S	*	.			trans	-106.1	110.8	162.6	-63.3	178.7	0	0	0	107.8	M218 M222	M218-I220 PolarHBondContact O-N 3.02Å; I220-M222 PolarHBondContact O-N 3.47Å
221	D	44.6	Very low	65	Low	136 Å²	136	95.7 Å²	95.7	73%	0.727	51%	0.511	S	S	*	.			trans	-67.3	103.9	-179.5	-172.7	14.8	0	0	0	111.1	V223	D221-V223 WeakPolarHBondContact OD1-CG2 3.22Å
222	M	45.9	Very low	65	Low	155 Å²	155	92.5 Å²	92.5	76%	0.764	50%	0.497	S	S	*	.			trans	-124.5	81.8	176.6	-174.5	159.3	61.6	0	0	109.6	I220 V224	I220-M222 PolarHBondContact O-N 3.47Å; M222-V224 HydrophobicContact CG-CG2 4.43Å; M222-V224 PolarHBondContact O-N 2.97Å
223	V	48.9	Very low	65.2	Low	107 Å²	107	90.9 Å²	90.9	65%	0.648	49%	0.489	S	S	*	.			trans	-60.8	93.9	173.5	-175.8	0	0	0	0	110.3	D221	D221-V223 WeakPolarHBondContact OD1-CG2 3.22Å
224	V	54.4	Low	65.5	Low	88 Å²	88	89.8 Å²	89.8	53%	0.533	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-80.4	127.1	166.2	-178.8	0	0	0	0	107.7	M222 S226	M222-V224 HydrophobicContact CG-CG2 4.43Å; M222-V224 PolarHBondContact O-N 2.97Å; V224-S226 PolarHBondContact O-N 3.16Å; V224-S226 VanDerWaalsContact O-N 3.12Å
225	P	55.9	Low	65.9	Low	120 Å²	120	87 Å²	87	78%	0.779	45%	0.454	S	S	*	.	P	Polyproline II helix	trans	-57.5	117.9	173.3	-24.3	34.6	0	0	0	110.8
226	S	60.1	Low	66.5	Low	29 Å²	29	83.7 Å²	83.7	20%	0.203	44%	0.439	C	S	.	.	P	Polyproline II helix	trans	-90.9	144.4	176.1	178.7	0	0	0	0	110.9	V224 S228 V231	V224-S226 PolarHBondContact O-N 3.16Å; V224-S226 VanDerWaalsContact O-N 3.12Å; S226-S228 PolarHBondContact OG-N 3Å; S226-S228 PolarHBondContact OG-O 3.2Å; S226-V231 WeakPolarHBondContact OG-CB 3.16Å; S226-V231 WeakPolarHBondContact OG-CG1 3.32Å
227	E	66.7	Low	68	Low	138 Å²	138	76.8 Å²	76.8	65%	0.645	41%	0.407	S	S	*	.	S	Bend	trans	-102.2	7.3	176.5	-58.8	-169.3	157.8	0	0	112.9	M450	E227-M450 VanDerWaalsContact C-CE 3.45Å; E227-M450 WeakPolarHBondContact O-CE 3.5Å
228	S	80.9	Confident	69.7	Low	4 Å²	4	74.2 Å²	74.2	3%	0.028	39%	0.389	C	S	.	.			trans	-132.2	133.3	178.9	166.3	0	0	0	0	112.4	S226 K230 V231 V232 Y363 H364 M450	S226-S228 PolarHBondContact OG-N 3Å; S226-S228 PolarHBondContact OG-O 3.2Å; S228-K230 VanDerWaalsContact C-N 3.32Å; S228-K230 PolarHBondContact O-N 2.97Å; S228-K230 PolarHBondContact OG-N 3.4Å; S228-V231 PolarHBondContact O-N 2.91Å; S228-V232 PolarHBondContact O-N 3.49Å; S228-V232 VanDerWaalsContact O-N 3.11Å; S228-Y363 PolarHBondContact OG-O 3.35Å; S228-H364 WeakPolarHBondContact OG-CA 3.47Å; S228-H364 PolarHBondContact OG-ND1 2.73Å; S228-M450 VanDerWaalsContact C-SD 3.53Å
229	E	82.9	Confident	71.3	Confident	20 Å²	20	73.6 Å²	73.6	9%	0.093	38%	0.378	C	S	.	.	H	α-helix	trans	-60.8	-41.1	179.2	-57.1	-175.6	110.1	0	0	112.1	V231 V232 V233 L362 Y363 R384 L445 M450	E229-V231 VanDerWaalsContact C-N 3.29Å; E229-V231 PolarHBondContact O-N 2.91Å; E229-V232 PolarHBondContact O-N 2.9Å; E229-V233 WeakPolarHBondContact O-CG2 3.1Å; E229-V233 PolarHBondContact O-N 3.19Å; E229-L362 HydrophobicContact CB-CB 4.43Å; E229-Y363 PolarHBondContact N-O 3.04Å; E229-Y363 VanDerWaalsContact OE2-CB 3.29Å; E229-Y363 WeakPolarHBondContact OE2-CB 3.33Å; E229-Y363 PolarHBondContact OE2-N 2.9Å; E229-R384 IonicContact OE1-CZ 2.69Å; E229-R384 IonicContact OE1-NH1 3.94Å; E229-R384 PolarHBondContact OE1-NH1 2.95Å; E229-R384 IonicContact OE1-NH2 3.9Å; E229-R384 PolarHBondContact OE1-NH2 3.34Å; E229-R384 IonicContact OE2-NH1 3.73Å; E229-R384 PolarHBondContact OE2-NH1 3.43Å; E229-L445 HydrophobicContact CB-CD2 3.9Å; E229-L445 HydrophobicContact CG-CD2 4.3Å; E229-M450 HydrophobicContact CG-CE 4.11Å; E229-M450 HydrophobicContact CG-SD 4.14Å
230	K	85	Confident	73.2	Confident	13 Å²	13	69.6 Å²	69.6	6%	0.057	36%	0.359	C	S	.	.	H	α-helix	trans	-53.2	-48.3	176.4	-174.4	-173.8	-179.8	179.9	0	111	V13 D15 S228 V233 E234 L362 Y363 H364 E379	V13-K230 HydrophobicContact CG1-CG 4.15Å; D15-K230 VanDerWaalsContact CG-CE 3.48Å; D15-K230 WeakPolarHBondContact OD1-CE 3.41Å; D15-K230 IonicContact OD1-NZ 3.84Å; D15-K230 PolarHBondContact OD1-NZ 3.42Å; D15-K230 VanDerWaalsContact OD2-CE 3.27Å; D15-K230 WeakPolarHBondContact OD2-CE 3.27Å; D15-K230 IonicContact OD2-NZ 2.64Å; D15-K230 PolarHBondContact OD2-NZ 2.81Å; S228-K230 VanDerWaalsContact C-N 3.32Å; S228-K230 PolarHBondContact O-N 2.97Å; S228-K230 PolarHBondContact OG-N 3.4Å; K230-V233 PolarHBondContact O-N 3.1Å; K230-E234 VanDerWaalsContact O-CG 3.32Å; K230-E234 WeakPolarHBondContact O-CG 3.39Å; K230-E234 PolarHBondContact O-N 3.26Å; K230-L362 HydrophobicContact CB-CB 4.17Å; K230-Y363 PolarHBondContact N-O 3.25Å; K230-H364 HydrophobicContact CB-CB 3.84Å; K230-H364 HydrophobicContact CD-CB 3.5Å; K230-H364 VanDerWaalsContact CD-CB 3.5Å; K230-H364 HydrophobicContact CG-CB 4.33Å; K230-E379 IonicContact NZ-OE2 3.46Å; K230-E379 PolarHBondContact NZ-OE2 3.36Å
231	V	84.1	Confident	75.4	Confident	24 Å²	24	63.9 Å²	63.9	15%	0.145	34%	0.335	C	S	.	.	H	α-helix	trans	-69.9	-34.8	180	177.8	0	0	0	0	112.1	S226 S228 E229 V233 E234 Q235	S226-V231 WeakPolarHBondContact OG-CB 3.16Å; S226-V231 WeakPolarHBondContact OG-CG1 3.32Å; S228-V231 PolarHBondContact O-N 2.91Å; E229-V231 VanDerWaalsContact C-N 3.29Å; E229-V231 PolarHBondContact O-N 2.91Å; V231-V233 VanDerWaalsContact C-N 3.34Å; V231-E234 PolarHBondContact O-N 2.94Å; V231-Q235 WeakPolarHBondContact O-CB 3.43Å; V231-Q235 VanDerWaalsContact O-CG 3.26Å; V231-Q235 WeakPolarHBondContact O-CG 3.34Å; V231-Q235 PolarHBondContact O-N 3.37Å
232	V	85.1	Confident	77.6	Confident	10 Å²	10	61.9 Å²	61.9	6%	0.061	32%	0.324	C	S	.	.	H	α-helix	trans	-63.6	-41.9	172	174.8	0	0	0	0	110.7	S228 E229 Q235 L236 D444 L445 M450	S228-V232 PolarHBondContact O-N 3.49Å; S228-V232 VanDerWaalsContact O-N 3.11Å; E229-V232 PolarHBondContact O-N 2.9Å; V232-Q235 PolarHBondContact O-N 3.37Å; V232-L236 PolarHBondContact O-N 3.41Å; V232-D444 WeakPolarHBondContact CG1-OD2 3.5Å; V232-L445 HydrophobicContact CB-CD2 3.95Å; V232-L445 HydrophobicContact CG1-CD2 3.86Å; V232-M450 HydrophobicContact CG2-SD 3.72Å
233	V	87.8	Confident	79.8	Confident	4 Å²	4	54.6 Å²	54.6	2%	0.024	29%	0.288	C	S	.	.	H	α-helix	trans	-70	-37.3	177.3	175.5	0	0	0	0	111.9	V13 E229 K230 V231 Q235 L236 F237 L362 V441 L445	V13-V233 HydrophobicContact CG1-CG1 4.38Å; V13-V233 HydrophobicContact CG2-CG1 4Å; E229-V233 WeakPolarHBondContact O-CG2 3.1Å; E229-V233 PolarHBondContact O-N 3.19Å; K230-V233 PolarHBondContact O-N 3.1Å; V231-V233 VanDerWaalsContact C-N 3.34Å; V233-Q235 VanDerWaalsContact C-N 3.33Å; V233-Q235 PolarHBondContact O-N 3.4Å; V233-L236 WeakPolarHBondContact O-CB 2.94Å; V233-L236 PolarHBondContact O-N 3.43Å; V233-F237 HydrophobicContact CG1-CD2 3.63Å; V233-F237 HydrophobicContact CG1-CE2 3.59Å; V233-F237 VanDerWaalsContact O-CD2 3.25Å; V233-F237 WeakPolarHBondContact O-CD2 3.42Å; V233-F237 PolarHBondContact O-N 3.22Å; V233-L362 HydrophobicContact CB-CD1 3.67Å; V233-L362 HydrophobicContact CG1-CD1 3.86Å; V233-L362 HydrophobicContact CG2-CD1 3.69Å; V233-L362 HydrophobicContact CG2-CD2 4.43Å; V233-V441 HydrophobicContact CG1-CG1 4.41Å; V233-V441 HydrophobicContact CG1-CG2 4.18Å; V233-V441 HydrophobicContact CG2-CG1 3.71Å; V233-L445 HydrophobicContact CG2-CD1 3.87Å; V233-L445 HydrophobicContact CG2-CD2 4.09Å; V233-L445 HydrophobicContact CG2-CG 4.05Å
234	E	87.7	Confident	81.9	Confident	53 Å²	53	49.9 Å²	49.9	25%	0.248	26%	0.259	C	S	.	.	H	α-helix	trans	-59.2	-43.3	170.9	-73.2	164.6	-175	0	0	111.7	V13 K230 V231 F237 Q238	V13-E234 HydrophobicContact CB-CG 3.93Å; V13-E234 HydrophobicContact CG1-CG 4.45Å; V13-E234 HydrophobicContact CG2-CB 4.41Å; V13-E234 HydrophobicContact CG2-CG 3.67Å; K230-E234 VanDerWaalsContact O-CG 3.32Å; K230-E234 WeakPolarHBondContact O-CG 3.39Å; K230-E234 PolarHBondContact O-N 3.26Å; V231-E234 PolarHBondContact O-N 2.94Å; E234-F237 PolarHBondContact O-N 3.15Å; E234-Q238 WeakPolarHBondContact O-CG 3.22Å; E234-Q238 PolarHBondContact O-N 3.46Å; E234-Q238 VanDerWaalsContact O-N 3.1Å
235	Q	85.4	Confident	83.9	Confident	73 Å²	73	46.6 Å²	46.6	34%	0.341	24%	0.237	S	C	.	.	H	α-helix	trans	-65.4	-40.1	174.8	-72.2	171.8	3.6	0	0	112.2	V231 V232 V233 Q238 R239	V231-Q235 WeakPolarHBondContact O-CB 3.43Å; V231-Q235 VanDerWaalsContact O-CG 3.26Å; V231-Q235 WeakPolarHBondContact O-CG 3.34Å; V231-Q235 PolarHBondContact O-N 3.37Å; V232-Q235 PolarHBondContact O-N 3.37Å; V233-Q235 VanDerWaalsContact C-N 3.33Å; V233-Q235 PolarHBondContact O-N 3.4Å; Q235-Q238 PolarHBondContact O-N 3.08Å; Q235-R239 VanDerWaalsContact O-CB 3.31Å; Q235-R239 WeakPolarHBondContact O-CB 3.34Å; Q235-R239 PolarHBondContact O-N 3.03Å
236	L	87.6	Confident	85.8	Confident	5 Å²	5	40.9 Å²	40.9	3%	0.026	20%	0.2	C	C	.	.	H	α-helix	trans	-59.6	-46	172.2	177.5	66.7	0	0	0	111.1	V232 V233 Q238 R239 D240 V243 V441 D444	V232-L236 PolarHBondContact O-N 3.41Å; V233-L236 WeakPolarHBondContact O-CB 2.94Å; V233-L236 PolarHBondContact O-N 3.43Å; L236-Q238 PolarHBondContact O-N 3.01Å; L236-R239 PolarHBondContact O-N 3.25Å; L236-D240 HydrophobicContact CD1-CB 3.83Å; L236-D240 WeakPolarHBondContact O-CB 3.29Å; L236-D240 PolarHBondContact O-N 3.37Å; L236-V243 HydrophobicContact CD1-CG2 4.4Å; L236-V243 HydrophobicContact CD2-CG1 4.13Å; L236-V243 HydrophobicContact CD2-CG2 4.42Å; L236-V243 HydrophobicContact CG-CG1 4.27Å; L236-V243 HydrophobicContact CG-CG2 4.42Å; L236-V441 HydrophobicContact CD2-CG2 4.14Å; L236-D444 HydrophobicContact CD1-CB 4.13Å; L236-D444 HydrophobicContact CD2-CB 3.81Å; L236-D444 HydrophobicContact CG-CB 4.46Å
237	F	89.1	Confident	87.5	Confident	14 Å²	14	40.4 Å²	40.4	6%	0.061	20%	0.195	C	C	.	.	H	α-helix	trans	-65.9	-22	178.1	-88.1	-67.5	0	0	0	114	P11 V13 V233 E234 V243 R244 Q247 V437 V441	P11-F237 HydrophobicContact CB-CD1 4.45Å; P11-F237 HydrophobicContact CG-CB 4.43Å; V13-F237 HydrophobicContact CG2-CD2 3.65Å; V13-F237 HydrophobicContact CG2-CE2 4.19Å; V233-F237 HydrophobicContact CG1-CD2 3.63Å; V233-F237 HydrophobicContact CG1-CE2 3.59Å; V233-F237 VanDerWaalsContact O-CD2 3.25Å; V233-F237 WeakPolarHBondContact O-CD2 3.42Å; V233-F237 PolarHBondContact O-N 3.22Å; E234-F237 PolarHBondContact O-N 3.15Å; F237-V243 HydrophobicContact CD1-CG1 4.11Å; F237-V243 HydrophobicContact CE1-CG1 3.68Å; F237-V243 HydrophobicContact CZ-CG1 3.92Å; F237-R244 HydrophobicContact CD1-CB 4.07Å; F237-R244 WeakPolarHBondContact O-CD 3.2Å; F237-R244 PolarHBondContact O-NH1 2.74Å; F237-Q247 HydrophobicContact CE1-CB 3.53Å; F237-Q247 HydrophobicContact CE1-CG 4.04Å; F237-Q247 HydrophobicContact CZ-CB 3.95Å; F237-Q247 HydrophobicContact CZ-CG 4.13Å; F237-V437 HydrophobicContact CZ-CG1 4.02Å; F237-V441 HydrophobicContact CE2-CG2 4.46Å
238	Q	85.7	Confident	88.9	Confident	109 Å²	109	35.5 Å²	35.5	51%	0.509	17%	0.173	S	C	.	.	H	α-helix	trans	-81	-51.2	170.8	-69.4	166.6	9.3	0	0	110.8	S10 E234 Q235 L236 R244	S10-Q238 VanDerWaalsContact OG-CG 3.28Å; S10-Q238 WeakPolarHBondContact OG-CG 3.42Å; S10-Q238 PolarHBondContact OG-NE2 3.25Å; E234-Q238 WeakPolarHBondContact O-CG 3.22Å; E234-Q238 PolarHBondContact O-N 3.46Å; E234-Q238 VanDerWaalsContact O-N 3.1Å; Q235-Q238 PolarHBondContact O-N 3.08Å; L236-Q238 PolarHBondContact O-N 3.01Å; Q238-R244 PolarHBondContact O-NH1 2.86Å
239	R	85.6	Confident	89.7	Confident	151 Å²	151	35.4 Å²	35.4	57%	0.57	17%	0.172	S	C	*	.	H	α-helix	trans	-70.3	-37.6	-174	-171	-172.9	67.6	-157.7	-5.5	113.9	Q235 L236 D444	Q235-R239 VanDerWaalsContact O-CB 3.31Å; Q235-R239 WeakPolarHBondContact O-CB 3.34Å; Q235-R239 PolarHBondContact O-N 3.03Å; L236-R239 PolarHBondContact O-N 3.25Å; R239-D444 IonicContact CZ-OD1 3.19Å; R239-D444 IonicContact NH2-OD1 2.84Å; R239-D444 PolarHBondContact NH2-OD1 3.5Å
240	D	89.2	Confident	90.4	Very high	51 Å²	51	34.4 Å²	34.4	27%	0.273	17%	0.167	S	C	.	.			trans	-107.1	108.8	-171.5	-166.9	-49.8	0	0	0	112.2	L236 I242 V243 R244	L236-D240 HydrophobicContact CD1-CB 3.83Å; L236-D240 WeakPolarHBondContact O-CB 3.29Å; L236-D240 PolarHBondContact O-N 3.37Å; D240-I242 WeakPolarHBondContact OD1-CA 3.4Å; D240-I242 WeakPolarHBondContact OD1-CB 3.31Å; D240-I242 PolarHBondContact OD1-N 2.83Å; D240-V243 HydrophobicContact CB-CB 4.12Å; D240-V243 HydrophobicContact CB-CG2 4.05Å; D240-V243 PolarHBondContact OD1-N 3.08Å; D240-R244 WeakPolarHBondContact O-CB 3.5Å; D240-R244 PolarHBondContact O-N 3.11Å
241	A	90.2	Very high	90.9	Very high	37 Å²	37	36.8 Å²	36.8	31%	0.306	18%	0.181	S	C	.	.	H	α-helix	trans	-71.7	-25.3	179.3	0	0	0	0	0	114.2	L212 R244 Q245	L212-A241 HydrophobicContact CD1-CB 3.99Å; A241-R244 VanDerWaalsContact CA-NH2 3.3Å; A241-R244 VanDerWaalsContact CB-NH2 3.33Å; A241-Q245 VanDerWaalsContact O-CB 3.3Å; A241-Q245 WeakPolarHBondContact O-CB 3.36Å; A241-Q245 WeakPolarHBondContact O-CG 3.48Å; A241-Q245 PolarHBondContact O-N 2.9Å
242	I	91.6	Very high	91.5	Very high	94 Å²	94	35.9 Å²	35.9	48%	0.482	17%	0.174	S	C	.	.	H	α-helix	trans	-73	-49.6	178.3	-61.6	173.7	0	0	0	108.7	D240 R244 Q245 S246 M436 M469	D240-I242 WeakPolarHBondContact OD1-CA 3.4Å; D240-I242 WeakPolarHBondContact OD1-CB 3.31Å; D240-I242 PolarHBondContact OD1-N 2.83Å; I242-R244 VanDerWaalsContact C-N 3.33Å; I242-R244 PolarHBondContact O-N 3.3Å; I242-Q245 PolarHBondContact O-N 2.73Å; I242-S246 VanDerWaalsContact O-CB 3.27Å; I242-S246 WeakPolarHBondContact O-CB 3.25Å; I242-S246 PolarHBondContact O-N 3.11Å; I242-S246 PolarHBondContact O-OG 2.67Å; I242-M436 HydrophobicContact CG2-CE 3.86Å; I242-M469 HydrophobicContact CB-CE 4.43Å; I242-M469 HydrophobicContact CG2-CE 3.92Å
243	V	92.1	Very high	92.1	Very high	2 Å²	2	35.4 Å²	35.4	1%	0.012	17%	0.172	C	C	.	.	H	α-helix	trans	-58.2	-45.5	176.7	176.9	0	0	0	0	110.8	L236 F237 D240 S246 Q247 L440	L236-V243 HydrophobicContact CD1-CG2 4.4Å; L236-V243 HydrophobicContact CD2-CG1 4.13Å; L236-V243 HydrophobicContact CD2-CG2 4.42Å; L236-V243 HydrophobicContact CG-CG1 4.27Å; L236-V243 HydrophobicContact CG-CG2 4.42Å; F237-V243 HydrophobicContact CD1-CG1 4.11Å; F237-V243 HydrophobicContact CE1-CG1 3.68Å; F237-V243 HydrophobicContact CZ-CG1 3.92Å; D240-V243 HydrophobicContact CB-CB 4.12Å; D240-V243 HydrophobicContact CB-CG2 4.05Å; D240-V243 PolarHBondContact OD1-N 3.08Å; V243-S246 PolarHBondContact O-N 3.08Å; V243-Q247 PolarHBondContact O-N 3.37Å; V243-L440 HydrophobicContact CG2-CB 3.94Å; V243-L440 HydrophobicContact CG2-CD1 3.92Å; V243-L440 HydrophobicContact CG2-CG 4.48Å
244	R	93.9	Very high	92.5	Very high	9 Å²	9	35.8 Å²	35.8	3%	0.034	17%	0.173	C	C	.	.	H	α-helix	trans	-64.2	-49.6	178.2	-178.3	171.7	61	-101	-9.9	113.4	P11 D208 F237 Q238 D240 A241 I242 S246 Q247 L248	P11-R244 HydrophobicContact CB-CG 4.28Å; P11-R244 HydrophobicContact CG-CG 3.5Å; D208-R244 WeakPolarHBondContact OD1-CD 3.26Å; D208-R244 IonicContact OD1-CZ 2.71Å; D208-R244 IonicContact OD1-NE 3.74Å; D208-R244 PolarHBondContact OD1-NE 2.93Å; D208-R244 IonicContact OD1-NH2 3.18Å; D208-R244 IonicContact OD2-NE 2.73Å; D208-R244 PolarHBondContact OD2-NE 2.87Å; D208-R244 IonicContact OD2-NH2 2.75Å; F237-R244 HydrophobicContact CD1-CB 4.07Å; F237-R244 WeakPolarHBondContact O-CD 3.2Å; F237-R244 PolarHBondContact O-NH1 2.74Å; Q238-R244 PolarHBondContact O-NH1 2.86Å; D240-R244 WeakPolarHBondContact O-CB 3.5Å; D240-R244 PolarHBondContact O-N 3.11Å; A241-R244 VanDerWaalsContact CA-NH2 3.3Å; A241-R244 VanDerWaalsContact CB-NH2 3.33Å; I242-R244 VanDerWaalsContact C-N 3.33Å; I242-R244 PolarHBondContact O-N 3.3Å; R244-S246 VanDerWaalsContact C-N 3.3Å; R244-S246 PolarHBondContact O-N 3.08Å; R244-Q247 PolarHBondContact O-N 3.01Å; R244-Q247 VanDerWaalsContact O-N 3.13Å; R244-L248 PolarHBondContact O-N 3.1Å
245	Q	94.8	Very high	92.8	Very high	18 Å²	18	34.7 Å²	34.7	8%	0.084	17%	0.171	C	C	.	.	H	α-helix	trans	-67.1	-33	179.2	-72.1	174.3	29.3	0	0	111.8	L205 D208 R209 A241 I242 Q247 L248 V249 M469	L205-Q245 HydrophobicContact CD2-CB 3.85Å; L205-Q245 HydrophobicContact CD2-CG 3.98Å; D208-Q245 VanDerWaalsContact OD2-CG 3.28Å; D208-Q245 WeakPolarHBondContact OD2-CG 3.3Å; D208-Q245 PolarHBondContact OD2-NE2 3.19Å; R209-Q245 VanDerWaalsContact CG-NE2 3.35Å; R209-Q245 VanDerWaalsContact CZ-OE1 3.31Å; A241-Q245 VanDerWaalsContact O-CB 3.3Å; A241-Q245 WeakPolarHBondContact O-CB 3.36Å; A241-Q245 WeakPolarHBondContact O-CG 3.48Å; A241-Q245 PolarHBondContact O-N 2.9Å; I242-Q245 PolarHBondContact O-N 2.73Å; Q245-Q247 PolarHBondContact O-N 3.39Å; Q245-L248 PolarHBondContact O-N 3.16Å; Q245-V249 WeakPolarHBondContact O-CG2 3.36Å; Q245-V249 PolarHBondContact O-N 3.09Å; Q245-V249 VanDerWaalsContact O-N 3.09Å; Q245-M469 HydrophobicContact CB-CE 3.98Å
246	S	95.9	Very high	93.2	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-61.2	-40.1	169.8	-70.8	0	0	0	0	112.7	I242 V243 R244 V249 V250 M436	I242-S246 VanDerWaalsContact O-CB 3.27Å; I242-S246 WeakPolarHBondContact O-CB 3.25Å; I242-S246 PolarHBondContact O-N 3.11Å; I242-S246 PolarHBondContact O-OG 2.67Å; V243-S246 PolarHBondContact O-N 3.08Å; R244-S246 VanDerWaalsContact C-N 3.3Å; R244-S246 PolarHBondContact O-N 3.08Å; S246-V249 PolarHBondContact O-N 3.44Å; S246-V250 PolarHBondContact O-N 3.17Å; S246-V250 VanDerWaalsContact O-N 3.16Å; S246-M436 WeakPolarHBondContact OG-CE 3.34Å
247	Q	95.5	Very high	93.4	Very high	20 Å²	20	31.6 Å²	31.6	9%	0.093	16%	0.158	C	C	.	.	H	α-helix	trans	-69.4	-37.5	174.4	-177.6	58.3	44.7	0	0	112.2	F237 V243 R244 Q245 V249 V250 D251 V437	F237-Q247 HydrophobicContact CE1-CB 3.53Å; F237-Q247 HydrophobicContact CE1-CG 4.04Å; F237-Q247 HydrophobicContact CZ-CB 3.95Å; F237-Q247 HydrophobicContact CZ-CG 4.13Å; V243-Q247 PolarHBondContact O-N 3.37Å; R244-Q247 PolarHBondContact O-N 3.01Å; R244-Q247 VanDerWaalsContact O-N 3.13Å; Q245-Q247 PolarHBondContact O-N 3.39Å; Q247-V249 PolarHBondContact O-N 3.46Å; Q247-V250 CarbonylContact O-C 3.41Å; Q247-V250 WeakPolarHBondContact O-CA 3.49Å; Q247-V250 WeakPolarHBondContact O-CB 3.37Å; Q247-V250 PolarHBondContact O-N 3.19Å; Q247-D251 PolarHBondContact NE2-OD1 3.09Å; Q247-D251 VanDerWaalsContact O-CG 3.32Å; Q247-D251 PolarHBondContact O-N 3.48Å; Q247-V437 HydrophobicContact CB-CG2 4.39Å
248	L	96.9	Very high	93.5	Very high	35 Å²	35	36.4 Å²	36.4	18%	0.183	18%	0.179	C	C	.	.	H	α-helix	trans	-60.3	-31.6	173.3	-68	174.3	0	0	0	112.5	L205 D208 R244 Q245 W252	L205-L248 HydrophobicContact CD2-CB 4.1Å; L205-L248 HydrophobicContact CD2-CD1 4.35Å; D208-L248 HydrophobicContact CB-CD1 3.73Å; R244-L248 PolarHBondContact O-N 3.1Å; Q245-L248 PolarHBondContact O-N 3.16Å; L248-W252 VanDerWaalsContact O-CB 3.25Å; L248-W252 WeakPolarHBondContact O-CB 3.42Å; L248-W252 PolarHBondContact O-N 2.9Å
249	V	97.7	Very high	93.6	Very high	1 Å²	1	35 Å²	35	1%	0.006	18%	0.175	C	C	.	.	H	α-helix	trans	-69.5	-40.6	171.1	173.3	0	0	0	0	111.6	L201 L205 Q245 S246 Q247 W252 L253 V429 F433 I500	L201-V249 HydrophobicContact CD1-CG2 4.34Å; L205-V249 HydrophobicContact CD1-CG2 4.41Å; L205-V249 HydrophobicContact CD2-CG2 4.46Å; Q245-V249 WeakPolarHBondContact O-CG2 3.36Å; Q245-V249 PolarHBondContact O-N 3.09Å; Q245-V249 VanDerWaalsContact O-N 3.09Å; S246-V249 PolarHBondContact O-N 3.44Å; Q247-V249 PolarHBondContact O-N 3.46Å; V249-W252 HydrophobicContact CG1-CE3 4.29Å; V249-W252 PolarHBondContact O-N 3.47Å; V249-L253 HydrophobicContact CG1-CD1 3.83Å; V249-L253 WeakPolarHBondContact O-CB 3.17Å; V249-L253 WeakPolarHBondContact O-CD1 3.45Å; V249-L253 VanDerWaalsContact O-CG 3.29Å; V249-L253 WeakPolarHBondContact O-CG 3.27Å; V249-L253 PolarHBondContact O-N 2.87Å; V249-V429 HydrophobicContact CG1-CG1 4.42Å; V249-F433 HydrophobicContact CB-CD1 4.04Å; V249-F433 HydrophobicContact CB-CE1 4.26Å; V249-F433 HydrophobicContact CB-CG 4.38Å; V249-F433 HydrophobicContact CG1-CB 4.44Å; V249-F433 HydrophobicContact CG1-CD1 3.96Å; V249-F433 HydrophobicContact CG1-CD2 3.97Å; V249-F433 HydrophobicContact CG1-CE1 4.2Å; V249-F433 HydrophobicContact CG1-CE2 4.22Å; V249-F433 HydrophobicContact CG1-CG 3.85Å; V249-F433 HydrophobicContact CG1-CZ 4.34Å; V249-F433 HydrophobicContact CG2-CE1 4.38Å; V249-I500 HydrophobicContact CG1-CD1 3.97Å; V249-I500 HydrophobicContact CG2-CB 4.49Å; V249-I500 HydrophobicContact CG2-CD1 3.98Å; V249-I500 HydrophobicContact CG2-CG1 3.74Å; V249-I500 HydrophobicContact CG2-CG2 4.01Å
250	V	97.3	Very high	93.6	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-61.1	-49.8	173.1	175.8	0	0	0	0	110.9	S246 Q247 W252 L253 E254 F433	S246-V250 PolarHBondContact O-N 3.17Å; S246-V250 VanDerWaalsContact O-N 3.16Å; Q247-V250 CarbonylContact O-C 3.41Å; Q247-V250 WeakPolarHBondContact O-CA 3.49Å; Q247-V250 WeakPolarHBondContact O-CB 3.37Å; Q247-V250 PolarHBondContact O-N 3.19Å; V250-W252 VanDerWaalsContact C-N 3.32Å; V250-W252 PolarHBondContact O-N 3.17Å; V250-L253 PolarHBondContact O-N 2.76Å; V250-E254 HydrophobicContact CG1-CG 4.31Å; V250-E254 WeakPolarHBondContact O-CB 3.17Å; V250-E254 WeakPolarHBondContact O-CG 3.33Å; V250-E254 PolarHBondContact O-N 2.84Å; V250-F433 HydrophobicContact CG2-CB 3.82Å
251	D	96.4	Very high	93.3	Very high	62 Å²	62	33.6 Å²	33.6	33%	0.332	17%	0.174	S	C	.	.	H	α-helix	trans	-61.7	-39.7	-179.7	-64	-29.7	0	0	0	111.8	Q247 E254 S255	Q247-D251 PolarHBondContact NE2-OD1 3.09Å; Q247-D251 VanDerWaalsContact O-CG 3.32Å; Q247-D251 PolarHBondContact O-N 3.48Å; D251-E254 PolarHBondContact O-N 3.38Å; D251-S255 WeakPolarHBondContact O-CB 3.39Å; D251-S255 PolarHBondContact O-N 3.43Å
252	W	96.8	Very high	92.6	Very high	5 Å²	5	34.2 Å²	34.2	2%	0.019	18%	0.184	C	C	.	.	H	α-helix	trans	-60.8	-49.6	173.4	166.8	67.6	0	0	0	111.7	C197 L201 L248 V249 V250 E254 S255 I256 W425 Q496 I500	C197-W252 HydrophobicContact CB-CZ2 4.46Å; C197-W252 PolarHBondContact O-NE1 3.23Å; L201-W252 HydrophobicContact CB-CD2 3.98Å; L201-W252 HydrophobicContact CB-CG 4.2Å; L201-W252 HydrophobicContact CB-CZ2 4.11Å; L201-W252 HydrophobicContact CD1-CD2 3.78Å; L201-W252 HydrophobicContact CD1-CE3 3.73Å; L201-W252 HydrophobicContact CD1-CG 4.11Å; L201-W252 HydrophobicContact CD1-CZ3 4.27Å; L201-W252 HydrophobicContact CD2-CD2 4.44Å; L201-W252 HydrophobicContact CD2-CE3 4.31Å; L201-W252 HydrophobicContact CD2-CH2 3.93Å; L201-W252 HydrophobicContact CD2-CZ2 4.01Å; L201-W252 HydrophobicContact CD2-CZ3 4.06Å; L201-W252 HydrophobicContact CG-CD2 4.28Å; L201-W252 HydrophobicContact CG-CE3 4.43Å; L248-W252 VanDerWaalsContact O-CB 3.25Å; L248-W252 WeakPolarHBondContact O-CB 3.42Å; L248-W252 PolarHBondContact O-N 2.9Å; V249-W252 HydrophobicContact CG1-CE3 4.29Å; V249-W252 PolarHBondContact O-N 3.47Å; V250-W252 VanDerWaalsContact C-N 3.32Å; V250-W252 PolarHBondContact O-N 3.17Å; W252-E254 VanDerWaalsContact C-N 3.35Å; W252-E254 PolarHBondContact O-N 3.41Å; W252-S255 WeakPolarHBondContact O-CB 3.3Å; W252-S255 PolarHBondContact O-N 3.39Å; W252-S255 VanDerWaalsContact O-N 3.13Å; W252-S255 PolarHBondContact O-OG 2.93Å; W252-I256 HydrophobicContact CD2-CD1 4.22Å; W252-I256 HydrophobicContact CH2-CD1 4.35Å; W252-I256 HydrophobicContact CZ2-CD1 3.61Å; W252-I256 PolarHBondContact O-N 2.86Å; W252-I256 VanDerWaalsContact O-N 3.09Å; W252-W425 HydrophobicContact CH2-CZ3 4.38Å; W252-Q496 HydrophobicContact CH2-CB 4.34Å; W252-Q496 HydrophobicContact CH2-CG 4.1Å; W252-Q496 HydrophobicContact CZ2-CG 4.27Å; W252-I500 HydrophobicContact CZ3-CD1 4.23Å
253	L	97.1	Very high	91.4	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-67.2	-33.5	179.3	-69.9	162.8	0	0	0	112.9	V249 V250 I256 A257 R334 E426 V429 W430	V249-L253 HydrophobicContact CG1-CD1 3.83Å; V249-L253 WeakPolarHBondContact O-CB 3.17Å; V249-L253 WeakPolarHBondContact O-CD1 3.45Å; V249-L253 VanDerWaalsContact O-CG 3.29Å; V249-L253 WeakPolarHBondContact O-CG 3.27Å; V249-L253 PolarHBondContact O-N 2.87Å; V250-L253 PolarHBondContact O-N 2.76Å; L253-I256 PolarHBondContact O-N 2.64Å; L253-A257 PolarHBondContact O-N 2.77Å; L253-R334 PolarHBondContact O-NH1 3.02Å; L253-E426 HydrophobicContact CD2-CB 3.9Å; L253-E426 HydrophobicContact CD2-CG 4.36Å; L253-V429 HydrophobicContact CD1-CB 3.99Å; L253-V429 HydrophobicContact CD1-CG1 3.59Å; L253-W430 HydrophobicContact CB-CB 4.07Å; L253-W430 HydrophobicContact CD1-CB 3.98Å
254	E	95.6	Very high	90.1	Very high	12 Å²	12	37.7 Å²	37.7	6%	0.056	20%	0.202	C	C	.	.	H	α-helix	trans	-66.7	-38.3	171.1	-74.3	-177.6	175.8	0	0	111.1	R14 V250 D251 W252 I256 A257 K258 G336 W430	R14-E254 IonicContact CZ-OE1 3.01Å; R14-E254 IonicContact CZ-OE2 2.7Å; R14-E254 IonicContact NH2-OE1 3.25Å; R14-E254 PolarHBondContact NH2-OE1 3.37Å; R14-E254 IonicContact NH2-OE2 3.61Å; R14-E254 PolarHBondContact NH2-OE2 3.07Å; V250-E254 HydrophobicContact CG1-CG 4.31Å; V250-E254 WeakPolarHBondContact O-CB 3.17Å; V250-E254 WeakPolarHBondContact O-CG 3.33Å; V250-E254 PolarHBondContact O-N 2.84Å; D251-E254 PolarHBondContact O-N 3.38Å; W252-E254 VanDerWaalsContact C-N 3.35Å; W252-E254 PolarHBondContact O-N 3.41Å; E254-I256 VanDerWaalsContact C-N 3.34Å; E254-I256 PolarHBondContact O-N 2.84Å; E254-A257 PolarHBondContact O-N 3.28Å; E254-K258 WeakPolarHBondContact O-CB 3.44Å; E254-K258 PolarHBondContact O-N 3.36Å; E254-G336 VanDerWaalsContact CD-CA 3.48Å; E254-G336 WeakPolarHBondContact OE2-CA 3.47Å; E254-W430 PolarHBondContact OE1-NE1 2.82Å
255	S	94.6	Very high	88.4	Confident	30 Å²	30	40.2 Å²	40.2	21%	0.21	22%	0.221	C	C	.	.	H	α-helix	trans	-63	-37.7	174.4	84.7	0	0	0	0	112.7	R200 D251 W252 K258 D259	R200-S255 PolarHBondContact NH1-OG 3.05Å; D251-S255 WeakPolarHBondContact O-CB 3.39Å; D251-S255 PolarHBondContact O-N 3.43Å; W252-S255 WeakPolarHBondContact O-CB 3.3Å; W252-S255 PolarHBondContact O-N 3.39Å; W252-S255 VanDerWaalsContact O-N 3.13Å; W252-S255 PolarHBondContact O-OG 2.93Å; S255-K258 WeakPolarHBondContact O-CB 3.43Å; S255-K258 PolarHBondContact O-N 3.49Å; S255-D259 VanDerWaalsContact O-CG 3.28Å; S255-D259 PolarHBondContact O-N 3.36Å
256	I	93.2	Very high	86.5	Confident	7 Å²	7	44.7 Å²	44.7	4%	0.036	25%	0.246	C	C	.	.	H	α-helix	trans	-65.2	-46.8	175.7	-65.7	173.8	0	0	0	110.5	C197 W252 L253 E254 K258 D259 Q260	C197-I256 HydrophobicContact CB-CD1 3.81Å; C197-I256 HydrophobicContact CB-CG1 4.32Å; W252-I256 HydrophobicContact CD2-CD1 4.22Å; W252-I256 HydrophobicContact CH2-CD1 4.35Å; W252-I256 HydrophobicContact CZ2-CD1 3.61Å; W252-I256 PolarHBondContact O-N 2.86Å; W252-I256 VanDerWaalsContact O-N 3.09Å; L253-I256 PolarHBondContact O-N 2.64Å; E254-I256 VanDerWaalsContact C-N 3.34Å; E254-I256 PolarHBondContact O-N 2.84Å; I256-K258 VanDerWaalsContact C-N 3.27Å; I256-K258 PolarHBondContact O-N 2.86Å; I256-D259 PolarHBondContact O-N 3.13Å; I256-Q260 WeakPolarHBondContact O-CG 3.43Å; I256-Q260 PolarHBondContact O-N 3.48Å; I256-Q260 VanDerWaalsContact O-N 3.08Å
257	A	91.9	Very high	84.7	Confident	7 Å²	7	50.2 Å²	50.2	6%	0.058	28%	0.275	C	S	.	.	H	α-helix	trans	-62.2	-36.7	177.1	0	0	0	0	0	111.8	L253 E254 Q260 I261 R334 A335	L253-A257 PolarHBondContact O-N 2.77Å; E254-A257 PolarHBondContact O-N 3.28Å; A257-Q260 PolarHBondContact O-N 3.03Å; A257-I261 WeakPolarHBondContact O-CD1 3.4Å; A257-I261 VanDerWaalsContact O-CG1 3.23Å; A257-I261 WeakPolarHBondContact O-CG1 3.42Å; A257-I261 PolarHBondContact O-N 3.48Å; A257-I261 VanDerWaalsContact O-N 3.1Å; A257-R334 HydrophobicContact CB-CG 4.26Å; A257-A335 HydrophobicContact CB-CB 3.87Å
258	K	91.1	Very high	83.1	Confident	114 Å²	114	49.7 Å²	49.7	50%	0.496	27%	0.273	S	S	.	.	H	α-helix	trans	-63.9	-44.2	174.8	-173.1	175.9	179.8	179.7	0	112.8	E254 S255 I256 Q260 I261 G262 A335 M337	E254-K258 WeakPolarHBondContact O-CB 3.44Å; E254-K258 PolarHBondContact O-N 3.36Å; S255-K258 WeakPolarHBondContact O-CB 3.43Å; S255-K258 PolarHBondContact O-N 3.49Å; I256-K258 VanDerWaalsContact C-N 3.27Å; I256-K258 PolarHBondContact O-N 2.86Å; K258-Q260 VanDerWaalsContact C-N 3.29Å; K258-Q260 PolarHBondContact O-N 3.11Å; K258-I261 PolarHBondContact O-N 2.71Å; K258-G262 PolarHBondContact O-N 3.31Å; K258-A335 HydrophobicContact CB-CB 4.14Å; K258-M337 HydrophobicContact CD-SD 4.38Å; K258-M337 HydrophobicContact CG-SD 4.03Å
259	D	88.1	Confident	81.1	Confident	80 Å²	80	54.1 Å²	54.1	43%	0.428	29%	0.293	S	S	.	.	H	α-helix	trans	-63.9	-35	176.5	-67.5	-15.1	0	0	0	112	R200 S255 I256	R200-D259 IonicContact CZ-OD2 2.8Å; R200-D259 IonicContact NH1-OD2 3.13Å; R200-D259 PolarHBondContact NH1-OD2 3.48Å; R200-D259 IonicContact NH2-OD2 3.66Å; R200-D259 PolarHBondContact NH2-OD2 3.04Å; S255-D259 VanDerWaalsContact O-CG 3.28Å; S255-D259 PolarHBondContact O-N 3.36Å; I256-D259 PolarHBondContact O-N 3.13Å
260	Q	85.1	Confident	79.2	Confident	140 Å²	140	63.5 Å²	63.5	65%	0.654	33%	0.33	S	S	*	.	H	α-helix	trans	-69.8	-30	174.9	-69	176.9	15.8	0	0	113.3	I256 A257 K258	I256-Q260 WeakPolarHBondContact O-CG 3.43Å; I256-Q260 PolarHBondContact O-N 3.48Å; I256-Q260 VanDerWaalsContact O-N 3.08Å; A257-Q260 PolarHBondContact O-N 3.03Å; K258-Q260 VanDerWaalsContact C-N 3.29Å; K258-Q260 PolarHBondContact O-N 3.11Å
261	I	83.3	Confident	77.3	Confident	33 Å²	33	71.4 Å²	71.4	17%	0.169	36%	0.361	C	S	.	.	H	α-helix	trans	-73.6	-40	178.6	-73.5	163.5	0	0	0	111.8	A257 K258 F264 T331 A335	A257-I261 WeakPolarHBondContact O-CD1 3.4Å; A257-I261 VanDerWaalsContact O-CG1 3.23Å; A257-I261 WeakPolarHBondContact O-CG1 3.42Å; A257-I261 PolarHBondContact O-N 3.48Å; A257-I261 VanDerWaalsContact O-N 3.1Å; K258-I261 PolarHBondContact O-N 2.71Å; I261-F264 HydrophobicContact CG2-CB 3.61Å; I261-F264 HydrophobicContact CG2-CD2 3.61Å; I261-F264 HydrophobicContact CG2-CG 3.82Å; I261-T331 HydrophobicContact CD1-CG2 3.57Å; I261-T331 HydrophobicContact CG1-CG2 3.73Å; I261-A335 HydrophobicContact CD1-CB 3.46Å; I261-A335 VanDerWaalsContact CD1-CB 3.46Å
262	G	75.8	Confident	75.6	Confident	49 Å²	49	69.6 Å²	69.6	51%	0.505	35%	0.354	S	S	.	.			trans	62	-142.5	-178.5	0	0	0	0	0	113.7	K258 F264	K258-G262 PolarHBondContact O-N 3.31Å; G262-F264 PolarHBondContact O-N 3.24Å
263	D	67.6	Low	74.2	Confident	143 Å²	143	73.2 Å²	73.2	77%	0.765	37%	0.37	S	S	*	.	S	Bend	trans	-73.4	75.1	179.4	-71.8	-47.5	0	0	0	112	S265	D263-S265 PolarHBondContact O-N 3.43Å
264	F	64.2	Low	72.8	Confident	26 Å²	26	80 Å²	80	11%	0.114	41%	0.406	C	S	.	.	H	α-helix	trans	-55.7	-32.3	-176.8	-169.5	-123.7	0	0	0	114.1	I261 G262 D266 N267 I268 N328 L332 E340 L344	I261-F264 HydrophobicContact CG2-CB 3.61Å; I261-F264 HydrophobicContact CG2-CD2 3.61Å; I261-F264 HydrophobicContact CG2-CG 3.82Å; G262-F264 PolarHBondContact O-N 3.24Å; F264-D266 PolarHBondContact O-N 3.07Å; F264-N267 PolarHBondContact O-N 3.49Å; F264-I268 HydrophobicContact CD1-CD1 3.37Å; F264-I268 HydrophobicContact CD1-CG1 4.46Å; F264-I268 HydrophobicContact CD2-CD1 4.49Å; F264-I268 HydrophobicContact CE1-CD1 3.22Å; F264-I268 HydrophobicContact CE1-CG1 4.16Å; F264-I268 HydrophobicContact CE2-CD1 4.41Å; F264-I268 HydrophobicContact CG-CD1 4.01Å; F264-I268 HydrophobicContact CZ-CD1 3.81Å; F264-I268 HydrophobicContact CZ-CG1 4.27Å; F264-I268 WeakPolarHBondContact O-CD1 3.16Å; F264-I268 WeakPolarHBondContact O-CG1 3.21Å; F264-N328 HydrophobicContact CZ-CB 4.29Å; F264-L332 HydrophobicContact CD1-CD1 4.39Å; F264-L332 HydrophobicContact CD1-CD2 3.68Å; F264-L332 HydrophobicContact CD1-CG 4.33Å; F264-L332 HydrophobicContact CE1-CD1 3.38Å; F264-L332 HydrophobicContact CE1-CD2 3.45Å; F264-L332 VanDerWaalsContact CE1-CD2 3.45Å; F264-L332 HydrophobicContact CE1-CG 3.6Å; F264-L332 HydrophobicContact CG-CD2 4.41Å; F264-L332 HydrophobicContact CZ-CD1 3.68Å; F264-L332 HydrophobicContact CZ-CD2 3.96Å; F264-L332 HydrophobicContact CZ-CG 3.71Å; F264-E340 HydrophobicContact CD1-CG 4.38Å; F264-L344 HydrophobicContact CE1-CD2 4.32Å; F264-L344 HydrophobicContact CZ-CD2 4.25Å
265	S	57.3	Low	72.1	Confident	63 Å²	63	82.7 Å²	82.7	44%	0.441	42%	0.424	S	S	.	.	H	α-helix	trans	-55.5	-49.3	-172.6	-177.5	0	0	0	0	113.4	D263 N267 I268	D263-S265 PolarHBondContact O-N 3.43Å; S265-N267 VanDerWaalsContact C-N 3.26Å; S265-N267 PolarHBondContact O-N 2.8Å; S265-I268 WeakPolarHBondContact O-CB 3.29Å; S265-I268 PolarHBondContact O-N 3.17Å; S265-I268 VanDerWaalsContact O-N 3.1Å
266	D	55.2	Low	71.6	Confident	112 Å²	112	82.8 Å²	82.8	60%	0.599	42%	0.424	S	S	*	.	H	α-helix	trans	-67.4	-28.8	-169.3	-71	14.9	0	0	0	112.4	F264 I268	F264-D266 PolarHBondContact O-N 3.07Å; D266-I268 VanDerWaalsContact C-N 3.3Å; D266-I268 PolarHBondContact O-N 2.91Å
267	N	59.3	Low	71.4	Confident	116 Å²	116	83.5 Å²	83.5	62%	0.62	43%	0.426	S	S	*	.	H	α-helix	trans	-74.6	-17.8	178.4	-70.1	-64.3	0	0	0	113.4	F264 S265 Y271	F264-N267 PolarHBondContact O-N 3.49Å; S265-N267 VanDerWaalsContact C-N 3.26Å; S265-N267 PolarHBondContact O-N 2.8Å; N267-Y271 WeakPolarHBondContact O-CD2 3.31Å
268	I	60.2	Low	71.2	Confident	9 Å²	9	87.6 Å²	87.6	5%	0.046	44%	0.444	C	S	.	.	H	α-helix	trans	-90.7	-34.5	-173.5	-64.7	162.2	0	0	0	112.2	F264 S265 D266 Y270 Y271 A272 L344	F264-I268 HydrophobicContact CD1-CD1 3.37Å; F264-I268 HydrophobicContact CD1-CG1 4.46Å; F264-I268 HydrophobicContact CD2-CD1 4.49Å; F264-I268 HydrophobicContact CE1-CD1 3.22Å; F264-I268 HydrophobicContact CE1-CG1 4.16Å; F264-I268 HydrophobicContact CE2-CD1 4.41Å; F264-I268 HydrophobicContact CG-CD1 4.01Å; F264-I268 HydrophobicContact CZ-CD1 3.81Å; F264-I268 HydrophobicContact CZ-CG1 4.27Å; F264-I268 WeakPolarHBondContact O-CD1 3.16Å; F264-I268 WeakPolarHBondContact O-CG1 3.21Å; S265-I268 WeakPolarHBondContact O-CB 3.29Å; S265-I268 PolarHBondContact O-N 3.17Å; S265-I268 VanDerWaalsContact O-N 3.1Å; D266-I268 VanDerWaalsContact C-N 3.3Å; D266-I268 PolarHBondContact O-N 2.91Å; I268-Y270 PolarHBondContact O-N 3.38Å; I268-Y271 PolarHBondContact O-N 3.38Å; I268-A272 HydrophobicContact CG2-CB 3.91Å; I268-A272 PolarHBondContact O-N 2.99Å; I268-L344 HydrophobicContact CD1-CD1 4.44Å; I268-L344 HydrophobicContact CG2-CD1 3.61Å
269	E	56.4	Low	71.1	Confident	127 Å²	127	84.6 Å²	84.6	59%	0.593	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-30.3	-173.5	-58.5	-110.3	112	0	0	112.2	Y271 R347	E269-Y271 PolarHBondContact O-N 3.27Å; E269-R347 IonicContact OE1-CZ 3.56Å; E269-R347 IonicContact OE1-NH2 3.46Å; E269-R347 PolarHBondContact OE1-NH2 3.43Å
270	Y	56.8	Low	71.1	Confident	199 Å²	199	80.8 Å²	80.8	78%	0.78	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-14.5	178.1	-70.5	-80.8	0	0	0	115.2	I268	I268-Y270 PolarHBondContact O-N 3.38Å
271	Y	57.5	Low	71.2	Confident	166 Å²	166	76.1 Å²	76.1	65%	0.651	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.7	-18.4	-172.7	-57.9	-72.3	0	0	0	114.8	N267 I268 E269 K273	N267-Y271 WeakPolarHBondContact O-CD2 3.31Å; I268-Y271 PolarHBondContact O-N 3.38Å; E269-Y271 PolarHBondContact O-N 3.27Å; Y271-K273 PolarHBondContact O-N 3.47Å
272	A	61.3	Low	71.4	Confident	24 Å²	24	79.4 Å²	79.4	20%	0.198	41%	0.407	C	S	.	.			trans	-72.1	87.7	-178	0	0	0	0	0	113.1	I268	I268-A272 HydrophobicContact CG2-CB 3.91Å; I268-A272 PolarHBondContact O-N 2.99Å
273	K	65.9	Low	71.9	Confident	80 Å²	80	78.6 Å²	78.6	35%	0.348	40%	0.396	S	S	.	.			trans	-73.1	132	170.2	-64.2	171.2	-175.5	165.1	0	110.8	Y271 V275 D321 C348	Y271-K273 PolarHBondContact O-N 3.47Å; K273-V275 PolarHBondContact O-N 3.49Å; K273-D321 IonicContact NZ-OD2 2.73Å; K273-D321 PolarHBondContact NZ-OD2 2.7Å; K273-C348 CarbonylContact O-C 3.53Å; K273-C348 WeakPolarHBondContact O-CA 3.43Å
274	N	69.5	Low	72.7	Confident	142 Å²	142	73.7 Å²	73.7	76%	0.759	37%	0.369	S	S	*	.	S	Bend	trans	-69	0.7	179.3	-64.5	-31.8	0	0	0	114.9
275	V	80.6	Confident	73.7	Confident	70 Å²	70	78.9 Å²	78.9	42%	0.424	39%	0.391	S	S	.	.	S	Bend	trans	-134.8	122.9	-174.5	-179.5	0	0	0	0	109.4	K273 L281	K273-V275 PolarHBondContact O-N 3.49Å; V275-L281 HydrophobicContact CG1-CD2 4.1Å
276	C	83.9	Confident	74.7	Confident	32 Å²	32	81 Å²	81	22%	0.216	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	135.8	176	-165.3	0	0	0	0	111.1	E278 Q350	C276-E278 PolarHBondContact O-N 2.8Å; C276-Q350 HydrophobicContact CB-CG 4.26Å; C276-Q350 VanDerWaalsContact SG-CG 3.54Å; C276-Q350 PolarHBondContact SG-NE2 2.94Å
277	W	88.7	Confident	75.2	Confident	21 Å²	21	81.1 Å²	81.1	8%	0.08	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.5	49	176.2	-51.7	-27.9	0	0	0	114.8	N279 T280 L281 L302 D303 P307 L314 D318	W277-N279 VanDerWaalsContact C-N 3.32Å; W277-N279 PolarHBondContact O-N 3.46Å; W277-T280 PolarHBondContact O-N 3.3Å; W277-L281 WeakPolarHBondContact O-CB 3.31Å; W277-L281 PolarHBondContact O-N 2.79Å; W277-L302 HydrophobicContact CE3-CD2 4.01Å; W277-D303 WeakPolarHBondContact CZ3-O 3.22Å; W277-P307 HydrophobicContact CH2-CG 3.95Å; W277-P307 HydrophobicContact CZ3-CG 4.49Å; W277-L314 HydrophobicContact CD2-CD1 3.98Å; W277-L314 HydrophobicContact CD2-CD2 3.6Å; W277-L314 HydrophobicContact CD2-CG 4.45Å; W277-L314 VanDerWaalsContact CE2-CD1 3.47Å; W277-L314 HydrophobicContact CE3-CD2 3.64Å; W277-L314 HydrophobicContact CG-CD1 4.21Å; W277-L314 HydrophobicContact CG-CD2 4.08Å; W277-L314 HydrophobicContact CH2-CD2 4.18Å; W277-L314 HydrophobicContact CZ2-CD1 3.8Å; W277-L314 HydrophobicContact CZ2-CD2 4.18Å; W277-L314 HydrophobicContact CZ3-CD2 3.93Å; W277-D318 WeakPolarHBondContact CA-OD2 3.37Å; W277-D318 HydrophobicContact CB-CB 4.38Å
278	E	87.9	Confident	75	Confident	94 Å²	94	80.7 Å²	80.7	44%	0.439	39%	0.394	S	S	.	.	H	α-helix	trans	-55.7	-40.7	-177	-175.6	177.6	-158.5	0	0	113.2	C276 H282	C276-E278 PolarHBondContact O-N 2.8Å; E278-H282 VanDerWaalsContact O-CB 3.26Å; E278-H282 WeakPolarHBondContact O-CB 3.45Å; E278-H282 PolarHBondContact O-N 2.77Å
279	N	87.7	Confident	74.7	Confident	50 Å²	50	85.4 Å²	85.4	27%	0.267	43%	0.428	S	S	.	.	H	α-helix	trans	-70.3	-36.6	-178.6	-62	-83.8	0	0	0	111.7	W277 H282 A283 A315 D318	W277-N279 VanDerWaalsContact C-N 3.32Å; W277-N279 PolarHBondContact O-N 3.46Å; N279-H282 PolarHBondContact O-N 2.72Å; N279-A283 VanDerWaalsContact O-CB 3.31Å; N279-A283 WeakPolarHBondContact O-CB 3.34Å; N279-A283 PolarHBondContact O-N 2.93Å; N279-A315 HydrophobicContact CB-CB 3.91Å; N279-D318 WeakPolarHBondContact CB-OD1 3.34Å; N279-D318 PolarHBondContact N-OD1 3.14Å; N279-D318 PolarHBondContact N-OD2 3.44Å; N279-D318 PolarHBondContact ND2-OD1 3.11Å
280	T	88.3	Confident	74.5	Confident	0 Å²	0	83 Å²	83	0%	0	43%	0.425	C	S	.	.	H	α-helix	trans	-70.1	-44	177.3	-54.4	0	0	0	0	110.3	W277 H282 A283 L284 V299 L302 L314 A315 D318	W277-T280 PolarHBondContact O-N 3.3Å; T280-H282 VanDerWaalsContact C-N 3.32Å; T280-H282 PolarHBondContact O-N 3.41Å; T280-A283 PolarHBondContact O-N 3.44Å; T280-L284 HydrophobicContact CG2-CD1 4.29Å; T280-L284 WeakPolarHBondContact O-CB 3.43Å; T280-L284 WeakPolarHBondContact O-CG 3.26Å; T280-L284 PolarHBondContact O-N 3.48Å; T280-V299 HydrophobicContact CG2-CG2 3.62Å; T280-L302 HydrophobicContact CG2-CD2 4Å; T280-L314 HydrophobicContact CG2-CD2 4.28Å; T280-A315 WeakPolarHBondContact OG1-CB 3.37Å; T280-A315 PolarHBondContact OG1-N 3.35Å; T280-D318 VanDerWaalsContact CB-OD2 3.26Å; T280-D318 WeakPolarHBondContact CB-OD2 3.46Å; T280-D318 PolarHBondContact N-OD2 2.85Å; T280-D318 PolarHBondContact OG1-OD2 3.42Å
281	L	88.6	Confident	74.2	Confident	43 Å²	43	78.4 Å²	78.4	23%	0.225	43%	0.428	C	S	.	.	H	α-helix	trans	-58.8	-41.7	171.2	174.2	63.4	0	0	0	111.9	V275 W277 K285 L302	V275-L281 HydrophobicContact CG1-CD2 4.1Å; W277-L281 WeakPolarHBondContact O-CB 3.31Å; W277-L281 PolarHBondContact O-N 2.79Å; L281-K285 HydrophobicContact CD1-CD 4.23Å; L281-K285 HydrophobicContact CG-CD 4.3Å; L281-K285 WeakPolarHBondContact O-CB 3.49Å; L281-K285 VanDerWaalsContact O-CG 3.32Å; L281-K285 WeakPolarHBondContact O-CG 3.47Å; L281-K285 PolarHBondContact O-N 2.94Å; L281-L302 HydrophobicContact CB-CD1 3.96Å; L281-L302 HydrophobicContact CD1-CD1 3.56Å; L281-L302 HydrophobicContact CG-CD1 4.3Å
282	H	87.4	Confident	73.9	Confident	101 Å²	101	74.4 Å²	74.4	47%	0.468	43%	0.425	S	S	.	.	H	α-helix	trans	-66.6	-46.7	176	179.5	-95.1	0	0	0	111.9	E278 N279 T280 L284 K285 M286	E278-H282 VanDerWaalsContact O-CB 3.26Å; E278-H282 WeakPolarHBondContact O-CB 3.45Å; E278-H282 PolarHBondContact O-N 2.77Å; N279-H282 PolarHBondContact O-N 2.72Å; T280-H282 VanDerWaalsContact C-N 3.32Å; T280-H282 PolarHBondContact O-N 3.41Å; H282-L284 VanDerWaalsContact C-N 3.33Å; H282-L284 PolarHBondContact O-N 2.91Å; H282-K285 PolarHBondContact O-N 3.12Å; H282-M286 VanDerWaalsContact CE1-CE 3.47Å; H282-M286 WeakPolarHBondContact CE1-CE 3.35Å; H282-M286 PolarHBondContact CE1-SD 3.02Å; H282-M286 WeakPolarHBondContact NE2-CE 3.39Å; H282-M286 PolarHBondContact O-N 3.34Å
283	A	85.6	Confident	73.3	Confident	33 Å²	33	80.7 Å²	80.7	27%	0.273	46%	0.455	S	S	.	.	H	α-helix	trans	-60.8	-40.3	176.7	0	0	0	0	0	112.2	N279 T280 M286 R287 L298	N279-A283 VanDerWaalsContact O-CB 3.31Å; N279-A283 WeakPolarHBondContact O-CB 3.34Å; N279-A283 PolarHBondContact O-N 2.93Å; T280-A283 PolarHBondContact O-N 3.44Å; A283-M286 PolarHBondContact O-N 2.89Å; A283-R287 WeakPolarHBondContact O-CB 3.31Å; A283-R287 PolarHBondContact O-N 3.49Å; A283-L298 HydrophobicContact CB-CD1 3.78Å
284	L	85.1	Confident	72.5	Confident	40 Å²	40	86.3 Å²	86.3	21%	0.209	48%	0.479	C	S	.	.	H	α-helix	trans	-64.7	-45.4	174.9	-81.4	166.3	0	0	0	112.5	T280 H282 M286 R287 S288 V299 L302	T280-L284 HydrophobicContact CG2-CD1 4.29Å; T280-L284 WeakPolarHBondContact O-CB 3.43Å; T280-L284 WeakPolarHBondContact O-CG 3.26Å; T280-L284 PolarHBondContact O-N 3.48Å; H282-L284 VanDerWaalsContact C-N 3.33Å; H282-L284 PolarHBondContact O-N 2.91Å; L284-M286 VanDerWaalsContact C-N 3.32Å; L284-M286 PolarHBondContact O-N 3.47Å; L284-R287 PolarHBondContact O-N 3.28Å; L284-S288 PolarHBondContact O-N 2.88Å; L284-V299 WeakPolarHBondContact CD2-O 3.5Å; L284-L302 HydrophobicContact CD1-CD1 4.49Å; L284-L302 HydrophobicContact CD1-CD2 4.09Å; L284-L302 HydrophobicContact CD1-CG 4.2Å
285	K	85.2	Confident	72	Confident	134 Å²	134	86.7 Å²	86.7	58%	0.583	48%	0.477	S	S	*	.	H	α-helix	trans	-59.6	-41.5	174.4	-76.6	167.4	176.1	165.9	0	112	L281 H282 S288	L281-K285 HydrophobicContact CD1-CD 4.23Å; L281-K285 HydrophobicContact CG-CD 4.3Å; L281-K285 WeakPolarHBondContact O-CB 3.49Å; L281-K285 VanDerWaalsContact O-CG 3.32Å; L281-K285 WeakPolarHBondContact O-CG 3.47Å; L281-K285 PolarHBondContact O-N 2.94Å; H282-K285 PolarHBondContact O-N 3.12Å; K285-S288 PolarHBondContact O-N 3.02Å
286	M	77.6	Confident	71.5	Confident	108 Å²	108	87.9 Å²	87.9	53%	0.532	48%	0.484	S	S	.	.	H	α-helix	trans	-71.7	-34	177	-73.7	-161.2	163.4	0	0	113.5	H282 A283 L284 S288 S289 S290	H282-M286 VanDerWaalsContact CE1-CE 3.47Å; H282-M286 WeakPolarHBondContact CE1-CE 3.35Å; H282-M286 PolarHBondContact CE1-SD 3.02Å; H282-M286 WeakPolarHBondContact NE2-CE 3.39Å; H282-M286 PolarHBondContact O-N 3.34Å; A283-M286 PolarHBondContact O-N 2.89Å; L284-M286 VanDerWaalsContact C-N 3.32Å; L284-M286 PolarHBondContact O-N 3.47Å; M286-S288 PolarHBondContact O-N 3.23Å; M286-S288 VanDerWaalsContact O-N 3.12Å; M286-S289 PolarHBondContact O-N 3.44Å; M286-S290 PolarHBondContact O-N 2.91Å
287	R	65.4	Low	71.2	Confident	114 Å²	114	89.5 Å²	89.5	43%	0.43	49%	0.494	S	S	.	.	H	α-helix	trans	-58.6	-23.3	175	-115.3	-179.3	173.5	169.6	2.1	113.7	A283 L284 S289	A283-R287 WeakPolarHBondContact O-CB 3.31Å; A283-R287 PolarHBondContact O-N 3.49Å; L284-R287 PolarHBondContact O-N 3.28Å; R287-S289 PolarHBondContact O-N 2.97Å
288	S	55.3	Low	71.1	Confident	107 Å²	107	89.9 Å²	89.9	75%	0.748	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-5.1	172.8	-169.2	0	0	0	0	114.3	L284 K285 M286	L284-S288 PolarHBondContact O-N 2.88Å; K285-S288 PolarHBondContact O-N 3.02Å; M286-S288 PolarHBondContact O-N 3.23Å; M286-S288 VanDerWaalsContact O-N 3.12Å
289	S	54.6	Low	71.1	Confident	108 Å²	108	85.4 Å²	85.4	76%	0.755	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.1	-11.8	-171.7	-62.4	0	0	0	0	114.9	M286 R287	M286-S289 PolarHBondContact O-N 3.44Å; R287-S289 PolarHBondContact O-N 2.97Å
290	S	51.3	Low	71	Confident	77 Å²	77	86.8 Å²	86.8	54%	0.538	49%	0.487	S	S	.	.			trans	-147.1	128.3	178	51.1	0	0	0	0	112.9	M286	M286-S290 PolarHBondContact O-N 2.91Å
291	A	51.2	Low	71	Confident	102 Å²	102	90.8 Å²	90.8	84%	0.843	51%	0.505	S	S	*	.			trans	-91.9	124.1	170.7	0	0	0	0	0	110
292	S	50.4	Low	70.9	Confident	83 Å²	83	92.1 Å²	92.1	58%	0.58	51%	0.512	S	S	*	.			trans	-149.7	125.8	169.8	57.6	0	0	0	0	110.8	F294	S292-F294 VanDerWaalsContact C-N 3.31Å; S292-F294 PolarHBondContact O-N 2.96Å; S292-F294 VanDerWaalsContact O-N 3.15Å
293	D	49.4	Very low	71	Confident	155 Å²	155	89.6 Å²	89.6	83%	0.829	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	24	-159.4	-59.8	-53.6	0	0	0	115.5
294	F	48	Very low	71.1	Confident	198 Å²	198	90.8 Å²	90.8	87%	0.868	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.7	18.6	-169.1	-73.5	-75.8	0	0	0	115.9	S292	S292-F294 VanDerWaalsContact C-N 3.31Å; S292-F294 PolarHBondContact O-N 2.96Å; S292-F294 VanDerWaalsContact O-N 3.15Å
295	H	60.7	Low	71.3	Confident	151 Å²	151	92.4 Å²	92.4	70%	0.699	52%	0.516	S	S	*	.	S	Bend	trans	-114.4	140.3	171.5	-79.7	-86.1	0	0	0	112.7
296	V	68.3	Low	71.5	Confident	95 Å²	95	86 Å²	86	58%	0.576	49%	0.488	S	S	*	.			trans	-49.1	136.4	171.2	179.1	0	0	0	0	109.8	L298 P313	V296-L298 PolarHBondContact O-N 3.4Å; V296-P313 HydrophobicContact CG1-CG 3.75Å
297	P	78.4	Confident	72.1	Confident	65 Å²	65	82.5 Å²	82.5	42%	0.422	47%	0.473	S	S	.	.			trans	-69.5	96	178.5	28.3	-34.6	0	0	0	110.8	R312	P297-R312 WeakPolarHBondContact O-CB 3.47Å; P297-R312 VanDerWaalsContact O-CD 3.32Å; P297-R312 WeakPolarHBondContact O-CD 3.35Å; P297-R312 VanDerWaalsContact O-CG 3.25Å; P297-R312 WeakPolarHBondContact O-CG 3.3Å
298	L	86	Confident	73.2	Confident	30 Å²	30	79.9 Å²	79.9	16%	0.157	47%	0.468	C	S	.	.			trans	-57	160.1	166.1	-55.8	-177	0	0	0	111.6	A283 V296 R312 P313 A315	A283-L298 HydrophobicContact CB-CD1 3.78Å; V296-L298 PolarHBondContact O-N 3.4Å; L298-R312 WeakPolarHBondContact O-CD 3.39Å; L298-R312 PolarHBondContact O-NH1 3.47Å; L298-P313 WeakPolarHBondContact CA-O 3.35Å; L298-P313 HydrophobicContact CD2-CG 4.44Å; L298-A315 HydrophobicContact CD1-CB 4.45Å
299	V	88.5	Confident	74.9	Confident	0 Å²	0	80.9 Å²	80.9	0%	0	46%	0.455	C	S	.	.			trans	-48.5	147	168.8	-64.8	0	0	0	0	111.8	T280 L284 E301 A306 P307 Q310 R312 P313 L314	T280-V299 HydrophobicContact CG2-CG2 3.62Å; L284-V299 WeakPolarHBondContact CD2-O 3.5Å; V299-E301 WeakPolarHBondContact CG2-O 3.37Å; V299-A306 HydrophobicContact CB-CB 4.39Å; V299-A306 HydrophobicContact CG1-CB 4.36Å; V299-P307 HydrophobicContact CG1-CB 4.26Å; V299-P307 HydrophobicContact CG1-CG 4.17Å; V299-Q310 VanDerWaalsContact CA-OE1 3.3Å; V299-R312 HydrophobicContact CG1-CB 3.9Å; V299-R312 WeakPolarHBondContact CG1-O 3.17Å; V299-P313 PolarHBondContact N-O 2.97Å; V299-L314 HydrophobicContact CG2-CD2 3.97Å
300	T	86.8	Confident	76.6	Confident	79 Å²	79	77.5 Å²	77.5	49%	0.485	43%	0.427	S	S	.	.	S	Bend	trans	-97.8	-10.2	177.1	49.2	0	0	0	0	114	Q310	T300-Q310 PolarHBondContact OG1-NE2 2.91Å; T300-Q310 PolarHBondContact OG1-OE1 3.45Å
301	E	87.9	Confident	78.4	Confident	84 Å²	84	79.5 Å²	79.5	39%	0.393	43%	0.428	S	S	.	.			trans	-133.7	165.4	-175	-54.8	171	154.9	0	0	108.1	V299 D303 A306 R309 Q310	V299-E301 WeakPolarHBondContact CG2-O 3.37Å; E301-D303 WeakPolarHBondContact CB-OD1 3.38Å; E301-A306 HydrophobicContact CB-CB 4.28Å; E301-A306 WeakPolarHBondContact O-CB 3.29Å; E301-R309 IonicContact OE2-CZ 2.69Å; E301-R309 IonicContact OE2-NH1 3.56Å; E301-R309 PolarHBondContact OE2-NH1 2.64Å; E301-R309 IonicContact OE2-NH2 2.7Å; E301-R309 PolarHBondContact OE2-NH2 3.01Å; E301-Q310 PolarHBondContact OE2-NE2 2.78Å; E301-Q310 VanDerWaalsContact OE2-NE2 3.07Å
302	L	86.8	Confident	80.1	Confident	71 Å²	71	79 Å²	79	37%	0.372	40%	0.404	S	S	.	.			trans	-129.3	15.4	-168.7	-65.4	171.7	0	0	0	113.3	W277 T280 L281 L284	W277-L302 HydrophobicContact CE3-CD2 4.01Å; T280-L302 HydrophobicContact CG2-CD2 4Å; L281-L302 HydrophobicContact CB-CD1 3.96Å; L281-L302 HydrophobicContact CD1-CD1 3.56Å; L281-L302 HydrophobicContact CG-CD1 4.3Å; L284-L302 HydrophobicContact CD1-CD1 4.49Å; L284-L302 HydrophobicContact CD1-CD2 4.09Å; L284-L302 HydrophobicContact CD1-CG 4.2Å
303	D	89.3	Confident	81.9	Confident	47 Å²	47	77.4 Å²	77.4	25%	0.251	39%	0.392	S	S	.	.	S	Bend	trans	-65	153.4	160.2	49.9	-81.8	0	0	0	111.1	W277 E301 D305 A306 R309	W277-D303 WeakPolarHBondContact CZ3-O 3.22Å; E301-D303 WeakPolarHBondContact CB-OD1 3.38Å; D303-D305 VanDerWaalsContact C-N 3.26Å; D303-D305 PolarHBondContact O-N 3.46Å; D303-A306 WeakPolarHBondContact O-CB 3.48Å; D303-A306 PolarHBondContact O-N 3.17Å; D303-A306 WeakPolarHBondContact OD2-CA 3.27Å; D303-A306 WeakPolarHBondContact OD2-CB 3.3Å; D303-A306 PolarHBondContact OD2-N 2.85Å; D303-R309 IonicContact OD1-NH2 2.73Å; D303-R309 PolarHBondContact OD1-NH2 3.45Å; D303-R309 VanDerWaalsContact OD1-NH2 3.15Å; D303-R309 IonicContact OD2-CZ 3.54Å; D303-R309 IonicContact OD2-NE 3.47Å; D303-R309 IonicContact OD2-NH2 3.57Å; D303-R309 PolarHBondContact OD2-NH2 2.88Å
304	P	87.4	Confident	83.8	Confident	58 Å²	58	70.7 Å²	70.7	38%	0.377	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-28.1	-173.5	24.6	-34.6	0	0	0	113.9	P307 W352	P304-P307 WeakPolarHBondContact O-CD 3.42Å; P304-W352 HydrophobicContact CB-CD2 3.77Å; P304-W352 HydrophobicContact CB-CE3 3.66Å; P304-W352 HydrophobicContact CB-CH2 3.71Å; P304-W352 HydrophobicContact CB-CZ2 3.81Å; P304-W352 HydrophobicContact CB-CZ3 3.63Å; P304-W352 HydrophobicContact CG-CD2 4.04Å; P304-W352 HydrophobicContact CG-CE3 4.04Å; P304-W352 HydrophobicContact CG-CG 4.4Å; P304-W352 HydrophobicContact CG-CZ3 4.46Å
305	D	89.1	Confident	85.8	Confident	74 Å²	74	62 Å²	62	40%	0.396	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-11.5	178.9	64	-77.6	0	0	0	114	D303 P307 L308 R309	D303-D305 VanDerWaalsContact C-N 3.26Å; D303-D305 PolarHBondContact O-N 3.46Å; D305-P307 VanDerWaalsContact C-CD 3.42Å; D305-P307 VanDerWaalsContact C-N 3.35Å; D305-L308 PolarHBondContact O-N 3.16Å; D305-R309 WeakPolarHBondContact O-CB 3.47Å; D305-R309 PolarHBondContact O-N 3.04Å; D305-R309 WeakPolarHBondContact OD2-CD 3.37Å; D305-R309 IonicContact OD2-CZ 3.99Å; D305-R309 IonicContact OD2-NE 2.71Å; D305-R309 PolarHBondContact OD2-NE 2.87Å; D305-R309 IonicContact OD2-NH2 3.79Å
306	A	90	Very high	87.1	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-48.9	-42.6	-179	0	0	0	0	0	114.9	V299 E301 D303 L308 Q310	V299-A306 HydrophobicContact CB-CB 4.39Å; V299-A306 HydrophobicContact CG1-CB 4.36Å; E301-A306 HydrophobicContact CB-CB 4.28Å; E301-A306 WeakPolarHBondContact O-CB 3.29Å; D303-A306 WeakPolarHBondContact O-CB 3.48Å; D303-A306 PolarHBondContact O-N 3.17Å; D303-A306 WeakPolarHBondContact OD2-CA 3.27Å; D303-A306 WeakPolarHBondContact OD2-CB 3.3Å; D303-A306 PolarHBondContact OD2-N 2.85Å; A306-L308 PolarHBondContact O-N 3.23Å; A306-Q310 WeakPolarHBondContact O-CB 3.47Å; A306-Q310 VanDerWaalsContact O-CG 3.22Å; A306-Q310 WeakPolarHBondContact O-CG 3.23Å; A306-Q310 PolarHBondContact O-N 3.14Å
307	P	89.4	Confident	88	Confident	34 Å²	34	59.7 Å²	59.7	22%	0.221	31%	0.31	C	S	.	.	H	α-helix	trans	-61.5	-42.4	177.6	-22.5	34.7	0	0	0	112.9	W277 V299 P304 D305 Q311 R312 L314	W277-P307 HydrophobicContact CH2-CG 3.95Å; W277-P307 HydrophobicContact CZ3-CG 4.49Å; V299-P307 HydrophobicContact CG1-CB 4.26Å; V299-P307 HydrophobicContact CG1-CG 4.17Å; P304-P307 WeakPolarHBondContact O-CD 3.42Å; D305-P307 VanDerWaalsContact C-CD 3.42Å; D305-P307 VanDerWaalsContact C-N 3.35Å; P307-Q311 WeakPolarHBondContact O-CA 3.35Å; P307-Q311 PolarHBondContact O-N 3.07Å; P307-Q311 VanDerWaalsContact O-N 3.08Å; P307-R312 WeakPolarHBondContact CA-O 3.45Å; P307-R312 PolarHBondContact O-N 2.97Å; P307-R312 VanDerWaalsContact O-N 3.08Å; P307-L314 HydrophobicContact CG-CD2 4.02Å; P307-L314 HydrophobicContact CG-CG 4.16Å
308	L	88.9	Confident	88.5	Confident	59 Å²	59	56.8 Å²	56.8	31%	0.309	29%	0.291	S	S	.	.	H	α-helix	trans	-74.7	-52.3	-179.4	-173.6	69.2	0	0	0	110.8	D305 A306 Q310 Q311 E397 Q399	D305-L308 PolarHBondContact O-N 3.16Å; A306-L308 PolarHBondContact O-N 3.23Å; L308-Q310 VanDerWaalsContact C-N 3.31Å; L308-Q310 PolarHBondContact O-N 3.06Å; L308-Q311 PolarHBondContact O-N 3.23Å; L308-Q311 PolarHBondContact O-NE2 3.5Å; L308-E397 HydrophobicContact CD1-CG 4.04Å; L308-Q399 HydrophobicContact CD1-CB 3.94Å
309	R	91.4	Very high	88.6	Confident	129 Å²	129	60.9 Å²	60.9	49%	0.487	30%	0.304	S	S	.	.	H	α-helix	trans	-61.9	-33.9	-179.5	177.9	167.5	54.8	86.1	5.3	113.1	E301 D303 D305	E301-R309 IonicContact OE2-CZ 2.69Å; E301-R309 IonicContact OE2-NH1 3.56Å; E301-R309 PolarHBondContact OE2-NH1 2.64Å; E301-R309 IonicContact OE2-NH2 2.7Å; E301-R309 PolarHBondContact OE2-NH2 3.01Å; D303-R309 IonicContact OD1-NH2 2.73Å; D303-R309 PolarHBondContact OD1-NH2 3.45Å; D303-R309 VanDerWaalsContact OD1-NH2 3.15Å; D303-R309 IonicContact OD2-CZ 3.54Å; D303-R309 IonicContact OD2-NE 3.47Å; D303-R309 IonicContact OD2-NH2 3.57Å; D303-R309 PolarHBondContact OD2-NH2 2.88Å; D305-R309 WeakPolarHBondContact O-CB 3.47Å; D305-R309 PolarHBondContact O-N 3.04Å; D305-R309 WeakPolarHBondContact OD2-CD 3.37Å; D305-R309 IonicContact OD2-CZ 3.99Å; D305-R309 IonicContact OD2-NE 2.71Å; D305-R309 PolarHBondContact OD2-NE 2.87Å; D305-R309 IonicContact OD2-NH2 3.79Å
310	Q	90.1	Very high	88.6	Confident	36 Å²	36	65.1 Å²	65.1	17%	0.168	32%	0.324	C	S	.	.	H	α-helix	trans	-97.2	-8.8	-179.7	-55.3	176.6	13.1	0	0	113.6	V299 T300 E301 A306 L308 R312	V299-Q310 VanDerWaalsContact CA-OE1 3.3Å; T300-Q310 PolarHBondContact OG1-NE2 2.91Å; T300-Q310 PolarHBondContact OG1-OE1 3.45Å; E301-Q310 PolarHBondContact OE2-NE2 2.78Å; E301-Q310 VanDerWaalsContact OE2-NE2 3.07Å; A306-Q310 WeakPolarHBondContact O-CB 3.47Å; A306-Q310 VanDerWaalsContact O-CG 3.22Å; A306-Q310 WeakPolarHBondContact O-CG 3.23Å; A306-Q310 PolarHBondContact O-N 3.14Å; L308-Q310 VanDerWaalsContact C-N 3.31Å; L308-Q310 PolarHBondContact O-N 3.06Å; Q310-R312 VanDerWaalsContact C-N 3.35Å; Q310-R312 HydrophobicContact CB-CB 4.35Å; Q310-R312 HydrophobicContact CB-CG 4.31Å; Q310-R312 WeakPolarHBondContact O-CG 3.4Å
311	Q	87.5	Confident	88.7	Confident	120 Å²	120	63.5 Å²	63.5	56%	0.561	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	49.1	-172.2	-62.7	-71.8	-66.9	0	0	112	P307 L308	P307-Q311 WeakPolarHBondContact O-CA 3.35Å; P307-Q311 PolarHBondContact O-N 3.07Å; P307-Q311 VanDerWaalsContact O-N 3.08Å; L308-Q311 PolarHBondContact O-N 3.23Å; L308-Q311 PolarHBondContact O-NE2 3.5Å
312	R	88.4	Confident	88.7	Confident	91 Å²	91	60.4 Å²	60.4	34%	0.343	30%	0.299	S	S	.	.			trans	-137	143.1	-174.1	-74.1	177.9	-172.2	-165.1	6.4	112.3	P297 L298 V299 P307 Q310	P297-R312 WeakPolarHBondContact O-CB 3.47Å; P297-R312 VanDerWaalsContact O-CD 3.32Å; P297-R312 WeakPolarHBondContact O-CD 3.35Å; P297-R312 VanDerWaalsContact O-CG 3.25Å; P297-R312 WeakPolarHBondContact O-CG 3.3Å; L298-R312 WeakPolarHBondContact O-CD 3.39Å; L298-R312 PolarHBondContact O-NH1 3.47Å; V299-R312 HydrophobicContact CG1-CB 3.9Å; V299-R312 WeakPolarHBondContact CG1-O 3.17Å; P307-R312 WeakPolarHBondContact CA-O 3.45Å; P307-R312 PolarHBondContact O-N 2.97Å; P307-R312 VanDerWaalsContact O-N 3.08Å; Q310-R312 VanDerWaalsContact C-N 3.35Å; Q310-R312 HydrophobicContact CB-CB 4.35Å; Q310-R312 HydrophobicContact CB-CG 4.31Å; Q310-R312 WeakPolarHBondContact O-CG 3.4Å
313	P	87.8	Confident	88.9	Confident	49 Å²	49	58.7 Å²	58.7	32%	0.318	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-76.7	154.8	179	32.5	-35.3	0	0	0	112.4	V296 L298 V299	V296-P313 HydrophobicContact CG1-CG 3.75Å; L298-P313 WeakPolarHBondContact CA-O 3.35Å; L298-P313 HydrophobicContact CD2-CG 4.44Å; V299-P313 PolarHBondContact N-O 2.97Å
314	L	89.4	Confident	88.9	Confident	15 Å²	15	62.2 Å²	62.2	8%	0.079	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-70.1	168.8	157.4	-59.6	171.8	0	0	0	110.4	W277 T280 V299 P307 D318	W277-L314 HydrophobicContact CD2-CD1 3.98Å; W277-L314 HydrophobicContact CD2-CD2 3.6Å; W277-L314 HydrophobicContact CD2-CG 4.45Å; W277-L314 VanDerWaalsContact CE2-CD1 3.47Å; W277-L314 HydrophobicContact CE3-CD2 3.64Å; W277-L314 HydrophobicContact CG-CD1 4.21Å; W277-L314 HydrophobicContact CG-CD2 4.08Å; W277-L314 HydrophobicContact CH2-CD2 4.18Å; W277-L314 HydrophobicContact CZ2-CD1 3.8Å; W277-L314 HydrophobicContact CZ2-CD2 4.18Å; W277-L314 HydrophobicContact CZ3-CD2 3.93Å; T280-L314 HydrophobicContact CG2-CD2 4.28Å; V299-L314 HydrophobicContact CG2-CD2 3.97Å; P307-L314 HydrophobicContact CG-CD2 4.02Å; P307-L314 HydrophobicContact CG-CG 4.16Å; L314-D318 HydrophobicContact CB-CB 4.4Å
315	A	89.1	Confident	89	Confident	15 Å²	15	60.2 Å²	60.2	12%	0.124	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-58.1	142	166.9	0	0	0	0	0	110.5	N279 T280 L298 L317 D318 R319	N279-A315 HydrophobicContact CB-CB 3.91Å; T280-A315 WeakPolarHBondContact OG1-CB 3.37Å; T280-A315 PolarHBondContact OG1-N 3.35Å; L298-A315 HydrophobicContact CD1-CB 4.45Å; A315-L317 VanDerWaalsContact C-N 3.27Å; A315-L317 PolarHBondContact O-N 2.71Å; A315-L317 VanDerWaalsContact O-N 3.16Å; A315-D318 PolarHBondContact O-N 3.34Å; A315-R319 PolarHBondContact O-N 2.81Å
316	D	87.8	Confident	89.2	Confident	97 Å²	97	56.8 Å²	56.8	52%	0.519	27%	0.272	S	S	.	.	H	α-helix	trans	-56.8	-38.3	-170	-62.3	-72.3	0	0	0	113.5	R319 E320	D316-R319 PolarHBondContact O-N 2.62Å; D316-R319 IonicContact OD1-CZ 3.95Å; D316-R319 IonicContact OD1-NH1 2.66Å; D316-R319 PolarHBondContact OD1-NH1 2.85Å; D316-R319 IonicContact OD1-NH2 3.51Å; D316-R319 PolarHBondContact OD1-NH2 2.96Å; D316-E320 PolarHBondContact O-N 3.09Å
317	L	87.9	Confident	89.3	Confident	101 Å²	101	60.6 Å²	60.6	53%	0.529	29%	0.289	S	S	.	.	H	α-helix	trans	-64.3	-41.1	175.2	-65.9	176.9	0	0	0	112.9	A315 R319 E320 D321	A315-L317 VanDerWaalsContact C-N 3.27Å; A315-L317 PolarHBondContact O-N 2.71Å; A315-L317 VanDerWaalsContact O-N 3.16Å; L317-R319 VanDerWaalsContact C-N 3.32Å; L317-E320 PolarHBondContact O-N 2.77Å; L317-D321 WeakPolarHBondContact O-CB 3.45Å; L317-D321 PolarHBondContact O-N 2.86Å
318	D	89	Confident	89.3	Confident	4 Å²	4	62.1 Å²	62.1	2%	0.021	30%	0.295	C	S	.	.	H	α-helix	trans	-70.1	-32.9	178	-65.2	-22.5	0	0	0	111.2	W277 N279 T280 L314 A315 D322	W277-D318 WeakPolarHBondContact CA-OD2 3.37Å; W277-D318 HydrophobicContact CB-CB 4.38Å; N279-D318 WeakPolarHBondContact CB-OD1 3.34Å; N279-D318 PolarHBondContact N-OD1 3.14Å; N279-D318 PolarHBondContact N-OD2 3.44Å; N279-D318 PolarHBondContact ND2-OD1 3.11Å; T280-D318 VanDerWaalsContact CB-OD2 3.26Å; T280-D318 WeakPolarHBondContact CB-OD2 3.46Å; T280-D318 PolarHBondContact N-OD2 2.85Å; T280-D318 PolarHBondContact OG1-OD2 3.42Å; L314-D318 HydrophobicContact CB-CB 4.4Å; A315-D318 PolarHBondContact O-N 3.34Å; D318-D322 WeakPolarHBondContact O-CB 3.17Å; D318-D322 PolarHBondContact O-N 3.05Å
319	R	89.1	Confident	89.5	Confident	115 Å²	115	59.3 Å²	59.3	43%	0.434	28%	0.28	S	S	.	.	H	α-helix	trans	-67.9	-37.5	174.1	-171.3	-176.2	65.4	-119.1	-8.6	111.7	A315 D316 L317 A323	A315-R319 PolarHBondContact O-N 2.81Å; D316-R319 PolarHBondContact O-N 2.62Å; D316-R319 IonicContact OD1-CZ 3.95Å; D316-R319 IonicContact OD1-NH1 2.66Å; D316-R319 PolarHBondContact OD1-NH1 2.85Å; D316-R319 IonicContact OD1-NH2 3.51Å; D316-R319 PolarHBondContact OD1-NH2 2.96Å; L317-R319 VanDerWaalsContact C-N 3.32Å; R319-A323 VanDerWaalsContact O-CB 3.25Å; R319-A323 WeakPolarHBondContact O-CB 3.34Å; R319-A323 PolarHBondContact O-N 3.16Å; R319-A323 VanDerWaalsContact O-N 3.1Å
320	E	88.4	Confident	89.7	Confident	90 Å²	90	53.5 Å²	53.5	42%	0.421	26%	0.259	S	S	.	.	H	α-helix	trans	-69	-44.9	172.4	-77.7	-170.6	-137.3	0	0	112.4	D316 L317 A323 R324	D316-E320 PolarHBondContact O-N 3.09Å; L317-E320 PolarHBondContact O-N 2.77Å; E320-A323 PolarHBondContact O-N 2.8Å; E320-R324 VanDerWaalsContact O-CG 3.25Å; E320-R324 WeakPolarHBondContact O-CG 3.48Å; E320-R324 PolarHBondContact O-N 3.29Å; E320-R324 IonicContact OE2-CZ 2.83Å; E320-R324 IonicContact OE2-NH2 3.74Å; E320-R324 PolarHBondContact OE2-NH2 2.9Å
321	D	87.3	Confident	89.8	Confident	44 Å²	44	54 Å²	54	24%	0.235	26%	0.264	C	S	.	.	H	α-helix	trans	-62.2	-44.3	178	-74.1	-18	0	0	0	111.2	K273 L317 R324 L325	K273-D321 IonicContact NZ-OD2 2.73Å; K273-D321 PolarHBondContact NZ-OD2 2.7Å; L317-D321 WeakPolarHBondContact O-CB 3.45Å; L317-D321 PolarHBondContact O-N 2.86Å; D321-R324 PolarHBondContact O-N 3.49Å; D321-L325 WeakPolarHBondContact O-CB 3.29Å; D321-L325 PolarHBondContact O-N 2.86Å
322	D	89	Confident	90	Very high	20 Å²	20	48.2 Å²	48.2	11%	0.107	24%	0.237	C	C	.	.	H	α-helix	trans	-66.8	-37.2	176.7	-160.5	64.3	0	0	0	112.2	D318 R324 L325 L326 Q350 R353	D318-D322 WeakPolarHBondContact O-CB 3.17Å; D318-D322 PolarHBondContact O-N 3.05Å; D322-R324 VanDerWaalsContact C-N 3.33Å; D322-R324 PolarHBondContact O-N 3.49Å; D322-L325 PolarHBondContact O-N 3.19Å; D322-L326 WeakPolarHBondContact O-CB 3.31Å; D322-L326 VanDerWaalsContact O-CG 3.29Å; D322-L326 WeakPolarHBondContact O-CG 3.48Å; D322-L326 PolarHBondContact O-N 3.42Å; D322-L326 WeakPolarHBondContact OD2-CD1 3.32Å; D322-Q350 PolarHBondContact OD1-NE2 2.88Å; D322-R353 IonicContact OD1-CZ 3.5Å; D322-R353 IonicContact OD1-NH1 2.77Å; D322-R353 PolarHBondContact OD1-NH1 2.85Å; D322-R353 IonicContact OD1-NH2 3.41Å; D322-R353 IonicContact OD2-CZ 2.73Å; D322-R353 IonicContact OD2-NH1 2.64Å; D322-R353 PolarHBondContact OD2-NH1 3.42Å; D322-R353 IonicContact OD2-NH2 3.17Å; D322-R353 PolarHBondContact OD2-NH2 3.25Å
323	A	90.6	Very high	90.2	Very high	35 Å²	35	44.2 Å²	44.2	29%	0.289	22%	0.222	S	C	.	.	H	α-helix	trans	-66.2	-33.8	176.1	0	0	0	0	0	113.2	R319 E320 K327 N401	R319-A323 VanDerWaalsContact O-CB 3.25Å; R319-A323 WeakPolarHBondContact O-CB 3.34Å; R319-A323 PolarHBondContact O-N 3.16Å; R319-A323 VanDerWaalsContact O-N 3.1Å; E320-A323 PolarHBondContact O-N 2.8Å; A323-K327 PolarHBondContact O-N 3Å; A323-N401 WeakPolarHBondContact CA-ND2 3.18Å; A323-N401 WeakPolarHBondContact CB-ND2 3.09Å
324	R	88.8	Confident	90.5	Very high	120 Å²	120	42.5 Å²	42.5	45%	0.453	21%	0.209	S	C	.	.	H	α-helix	trans	-71.8	-44.8	173	-65.9	165.7	-162.6	-177.3	7.4	111	E320 D321 D322 L326 K327 N328	E320-R324 VanDerWaalsContact O-CG 3.25Å; E320-R324 WeakPolarHBondContact O-CG 3.48Å; E320-R324 PolarHBondContact O-N 3.29Å; E320-R324 IonicContact OE2-CZ 2.83Å; E320-R324 IonicContact OE2-NH2 3.74Å; E320-R324 PolarHBondContact OE2-NH2 2.9Å; D321-R324 PolarHBondContact O-N 3.49Å; D322-R324 VanDerWaalsContact C-N 3.33Å; D322-R324 PolarHBondContact O-N 3.49Å; R324-L326 VanDerWaalsContact C-N 3.35Å; R324-L326 PolarHBondContact O-N 3.28Å; R324-K327 PolarHBondContact O-N 3.43Å; R324-N328 PolarHBondContact O-N 2.9Å; R324-N328 PolarHBondContact O-OD1 3.38Å
325	L	89.9	Confident	90.7	Very high	17 Å²	17	42 Å²	42	9%	0.089	21%	0.207	C	C	.	.	H	α-helix	trans	-56.7	-47.7	175	175.4	55.8	0	0	0	111.2	D321 D322 K327 N328 L329 L344 C348	D321-L325 WeakPolarHBondContact O-CB 3.29Å; D321-L325 PolarHBondContact O-N 2.86Å; D322-L325 PolarHBondContact O-N 3.19Å; L325-K327 PolarHBondContact O-N 2.81Å; L325-N328 PolarHBondContact O-N 3.47Å; L325-N328 VanDerWaalsContact O-N 3.16Å; L325-L329 HydrophobicContact CD1-CD1 3.98Å; L325-L329 HydrophobicContact CD1-CD2 4.49Å; L325-L329 HydrophobicContact CD1-CG 4Å; L325-L329 HydrophobicContact CG-CD1 3.91Å; L325-L329 HydrophobicContact CG-CG 4.39Å; L325-L329 VanDerWaalsContact O-CG 3.27Å; L325-L329 WeakPolarHBondContact O-CG 3.17Å; L325-L329 PolarHBondContact O-N 2.89Å; L325-L344 HydrophobicContact CD1-CD1 4.21Å; L325-L344 HydrophobicContact CD1-CD2 3.87Å; L325-L344 HydrophobicContact CD1-CG 3.69Å; L325-C348 HydrophobicContact CD1-CB 4.44Å; L325-C348 HydrophobicContact CD2-CB 3.71Å
326	L	93.2	Very high	90.8	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-62.2	-39.2	177.2	-77.3	167.3	0	0	0	113.5	D322 R324 L329 F330 R353 N401 E404 I407	D322-L326 WeakPolarHBondContact O-CB 3.31Å; D322-L326 VanDerWaalsContact O-CG 3.29Å; D322-L326 WeakPolarHBondContact O-CG 3.48Å; D322-L326 PolarHBondContact O-N 3.42Å; D322-L326 WeakPolarHBondContact OD2-CD1 3.32Å; R324-L326 VanDerWaalsContact C-N 3.35Å; R324-L326 PolarHBondContact O-N 3.28Å; L326-L329 HydrophobicContact CD2-CD1 4.49Å; L326-L329 PolarHBondContact O-N 3.18Å; L326-F330 PolarHBondContact O-N 3.2Å; L326-R353 VanDerWaalsContact CD2-CZ 3.48Å; L326-N401 HydrophobicContact CD1-CB 3.72Å; L326-E404 HydrophobicContact CD1-CB 3.89Å; L326-E404 HydrophobicContact CD2-CB 3.64Å; L326-E404 HydrophobicContact CD2-CG 3.97Å; L326-E404 HydrophobicContact CG-CB 4.37Å; L326-I407 HydrophobicContact CD2-CD1 3.98Å
327	K	92.3	Very high	91	Very high	80 Å²	80	39.9 Å²	39.9	35%	0.348	20%	0.198	S	C	.	.	H	α-helix	trans	-61	-47.2	171.8	-177	167.6	-176.6	161.2	0	110.7	A323 R324 L325 L329 F330 T331 Y403 E423	A323-K327 PolarHBondContact O-N 3Å; R324-K327 PolarHBondContact O-N 3.43Å; L325-K327 PolarHBondContact O-N 2.81Å; K327-L329 VanDerWaalsContact C-N 3.35Å; K327-L329 PolarHBondContact O-N 3.36Å; K327-F330 PolarHBondContact O-N 2.73Å; K327-T331 PolarHBondContact O-N 2.92Å; K327-T331 PolarHBondContact O-OG1 3.28Å; K327-Y403 HydrophobicContact CB-CD1 4.46Å; K327-Y403 HydrophobicContact CB-CD2 3.86Å; K327-Y403 HydrophobicContact CB-CE1 4.43Å; K327-Y403 HydrophobicContact CB-CE2 3.81Å; K327-Y403 HydrophobicContact CB-CG 4.2Å; K327-Y403 HydrophobicContact CD-CE1 4.34Å; K327-Y403 HydrophobicContact CD-CE2 3.95Å; K327-Y403 WeakPolarHBondContact CD-OH 3.47Å; K327-Y403 HydrophobicContact CG-CD1 4.41Å; K327-Y403 HydrophobicContact CG-CD2 4.39Å; K327-Y403 HydrophobicContact CG-CE1 3.98Å; K327-Y403 HydrophobicContact CG-CE2 3.93Å; K327-Y403 PolarHBondContact NZ-OH 2.97Å; K327-E423 IonicContact NZ-OE1 3.83Å
328	N	90.3	Very high	91.1	Very high	66 Å²	66	35.7 Å²	35.7	35%	0.353	18%	0.177	S	C	.	.	H	α-helix	trans	-63.7	-38.3	-179.5	-67.9	0.3	0	0	0	112.5	F264 R324 L325 T331 L332 L344	F264-N328 HydrophobicContact CZ-CB 4.29Å; R324-N328 PolarHBondContact O-N 2.9Å; R324-N328 PolarHBondContact O-OD1 3.38Å; L325-N328 PolarHBondContact O-N 3.47Å; L325-N328 VanDerWaalsContact O-N 3.16Å; N328-T331 PolarHBondContact O-N 3.03Å; N328-L332 WeakPolarHBondContact O-CG 3.2Å; N328-L332 PolarHBondContact O-N 3.34Å; N328-L344 HydrophobicContact CB-CD2 4.24Å
329	L	92.6	Very high	91.1	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-65.3	-41.1	174.6	-70.3	169.7	0	0	0	112.1	L325 L326 K327 L332 I333 A341 L344 C345 I407	L325-L329 HydrophobicContact CD1-CD1 3.98Å; L325-L329 HydrophobicContact CD1-CD2 4.49Å; L325-L329 HydrophobicContact CD1-CG 4Å; L325-L329 HydrophobicContact CG-CD1 3.91Å; L325-L329 HydrophobicContact CG-CG 4.39Å; L325-L329 VanDerWaalsContact O-CG 3.27Å; L325-L329 WeakPolarHBondContact O-CG 3.17Å; L325-L329 PolarHBondContact O-N 2.89Å; L326-L329 HydrophobicContact CD2-CD1 4.49Å; L326-L329 PolarHBondContact O-N 3.18Å; K327-L329 VanDerWaalsContact C-N 3.35Å; K327-L329 PolarHBondContact O-N 3.36Å; L329-L332 PolarHBondContact O-N 3.13Å; L329-I333 WeakPolarHBondContact O-CG1 3.45Å; L329-I333 PolarHBondContact O-N 2.9Å; L329-I333 VanDerWaalsContact O-N 3.09Å; L329-A341 HydrophobicContact CD2-CB 3.77Å; L329-A341 WeakPolarHBondContact CD2-O 3.43Å; L329-L344 HydrophobicContact CD2-CB 4.2Å; L329-L344 HydrophobicContact CD2-CD2 4Å; L329-L344 HydrophobicContact CD2-CG 4.22Å; L329-L344 HydrophobicContact CG-CD2 4.4Å; L329-C345 WeakPolarHBondContact CD1-SG 3.44Å; L329-C345 VanDerWaalsContact CD2-SG 3.53Å; L329-I407 HydrophobicContact CB-CD1 3.72Å
330	F	94.3	Very high	91.1	Very high	8 Å²	8	34.8 Å²	34.8	4%	0.035	18%	0.179	C	C	.	.	H	α-helix	trans	-63.3	-45.7	173.7	-179.5	-100.4	0	0	0	111.2	L326 K327 L332 I333 R334 Y403 A406 I407 I418 V421 W430	L326-F330 PolarHBondContact O-N 3.2Å; K327-F330 PolarHBondContact O-N 2.73Å; F330-L332 VanDerWaalsContact C-N 3.31Å; F330-L332 PolarHBondContact O-N 3.25Å; F330-I333 PolarHBondContact O-N 3.22Å; F330-R334 HydrophobicContact CE1-CB 4.48Å; F330-R334 VanDerWaalsContact O-CB 3.22Å; F330-R334 WeakPolarHBondContact O-CB 3.47Å; F330-R334 PolarHBondContact O-N 3.41Å; F330-Y403 HydrophobicContact CB-CD1 4.01Å; F330-Y403 HydrophobicContact CD1-CD1 4.04Å; F330-Y403 HydrophobicContact CD1-CE1 4.29Å; F330-Y403 HydrophobicContact CG-CD1 4.09Å; F330-A406 HydrophobicContact CD2-CB 3.78Å; F330-A406 HydrophobicContact CE2-CB 3.64Å; F330-A406 HydrophobicContact CZ-CB 4.39Å; F330-I407 HydrophobicContact CB-CD1 4.21Å; F330-I407 HydrophobicContact CB-CG1 3.91Å; F330-I407 HydrophobicContact CD2-CG1 4.12Å; F330-I418 HydrophobicContact CE2-CG2 4.39Å; F330-I418 HydrophobicContact CZ-CG2 4.26Å; F330-V421 HydrophobicContact CD1-CG2 4.16Å; F330-V421 HydrophobicContact CD2-CG2 4.41Å; F330-V421 HydrophobicContact CE1-CG2 3.59Å; F330-V421 HydrophobicContact CE2-CG2 3.89Å; F330-V421 HydrophobicContact CZ-CG2 3.44Å; F330-V421 VanDerWaalsContact CZ-CG2 3.44Å; F330-W430 HydrophobicContact CE2-CZ3 4.37Å; F330-W430 HydrophobicContact CZ-CZ3 4.14Å
331	T	92.4	Very high	91.2	Very high	45 Å²	45	30.5 Å²	30.5	28%	0.276	16%	0.159	S	C	.	.	H	α-helix	trans	-57.7	-39.3	176.2	-67.2	0	0	0	0	112.7	I261 K327 N328 A335	I261-T331 HydrophobicContact CD1-CG2 3.57Å; I261-T331 HydrophobicContact CG1-CG2 3.73Å; K327-T331 PolarHBondContact O-N 2.92Å; K327-T331 PolarHBondContact O-OG1 3.28Å; N328-T331 PolarHBondContact O-N 3.03Å; T331-A335 PolarHBondContact O-N 3.36Å
332	L	91.9	Very high	91.4	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-65.5	-45.9	173.7	-77.5	166.4	0	0	0	113.2	F264 N328 L329 F330 R334 A335 G336 M337 E340 A341 L344	F264-L332 HydrophobicContact CD1-CD1 4.39Å; F264-L332 HydrophobicContact CD1-CD2 3.68Å; F264-L332 HydrophobicContact CD1-CG 4.33Å; F264-L332 HydrophobicContact CE1-CD1 3.38Å; F264-L332 HydrophobicContact CE1-CD2 3.45Å; F264-L332 VanDerWaalsContact CE1-CD2 3.45Å; F264-L332 HydrophobicContact CE1-CG 3.6Å; F264-L332 HydrophobicContact CG-CD2 4.41Å; F264-L332 HydrophobicContact CZ-CD1 3.68Å; F264-L332 HydrophobicContact CZ-CD2 3.96Å; F264-L332 HydrophobicContact CZ-CG 3.71Å; N328-L332 WeakPolarHBondContact O-CG 3.2Å; N328-L332 PolarHBondContact O-N 3.34Å; L329-L332 PolarHBondContact O-N 3.13Å; F330-L332 VanDerWaalsContact C-N 3.31Å; F330-L332 PolarHBondContact O-N 3.25Å; L332-R334 VanDerWaalsContact C-N 3.31Å; L332-R334 PolarHBondContact O-N 2.81Å; L332-A335 CarbonylContact O-C 3.57Å; L332-A335 WeakPolarHBondContact O-CA 3.42Å; L332-A335 PolarHBondContact O-N 3.27Å; L332-G336 PolarHBondContact O-N 3.48Å; L332-M337 HydrophobicContact CB-CB 4.41Å; L332-M337 HydrophobicContact CD2-CB 3.73Å; L332-M337 HydrophobicContact CD2-CE 4.06Å; L332-M337 HydrophobicContact CD2-SD 4.13Å; L332-M337 PolarHBondContact O-N 3.39Å; L332-E340 HydrophobicContact CD2-CB 4.1Å; L332-E340 HydrophobicContact CD2-CG 4.32Å; L332-A341 HydrophobicContact CB-CB 3.92Å; L332-A341 HydrophobicContact CD1-CB 3.93Å; L332-L344 HydrophobicContact CD1-CB 4.48Å; L332-L344 HydrophobicContact CD1-CD2 3.88Å
333	I	93.3	Very high	91.4	Very high	6 Å²	6	34 Å²	34	3%	0.031	17%	0.168	C	C	.	.	H	α-helix	trans	-66.1	-37.8	-180	-70.2	165.8	0	0	0	110.4	L329 F330 A335 G336 A341 L357 I407 L411	L329-I333 WeakPolarHBondContact O-CG1 3.45Å; L329-I333 PolarHBondContact O-N 2.9Å; L329-I333 VanDerWaalsContact O-N 3.09Å; F330-I333 PolarHBondContact O-N 3.22Å; I333-A335 PolarHBondContact O-N 3.47Å; I333-G336 PolarHBondContact O-N 2.89Å; I333-G336 VanDerWaalsContact O-N 3.11Å; I333-A341 HydrophobicContact CD1-CB 4.44Å; I333-A341 HydrophobicContact CG1-CB 4.12Å; I333-L357 HydrophobicContact CD1-CD1 4.41Å; I333-L357 HydrophobicContact CD1-CD2 3.68Å; I333-I407 HydrophobicContact CD1-CG1 4.15Å; I333-I407 HydrophobicContact CD1-CG2 3.83Å; I333-L411 HydrophobicContact CG2-CD2 4.47Å
334	R	94.2	Very high	91.3	Very high	13 Å²	13	32.5 Å²	32.5	5%	0.049	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-18.1	171.1	173.5	58.9	-172.6	92.6	4	114	L253 A257 F330 L332 E426 D427 W430	L253-R334 PolarHBondContact O-NH1 3.02Å; A257-R334 HydrophobicContact CB-CG 4.26Å; F330-R334 HydrophobicContact CE1-CB 4.48Å; F330-R334 VanDerWaalsContact O-CB 3.22Å; F330-R334 WeakPolarHBondContact O-CB 3.47Å; F330-R334 PolarHBondContact O-N 3.41Å; L332-R334 VanDerWaalsContact C-N 3.31Å; L332-R334 PolarHBondContact O-N 2.81Å; R334-E426 PolarHBondContact NH2-O 3.09Å; R334-D427 IonicContact CZ-OD1 2.67Å; R334-D427 VanDerWaalsContact CZ-OD1 3.32Å; R334-D427 IonicContact NE-OD1 3.6Å; R334-D427 PolarHBondContact NE-OD1 3.14Å; R334-D427 IonicContact NH2-OD1 2.67Å; R334-D427 PolarHBondContact NH2-OD1 3.39Å; R334-W430 HydrophobicContact CB-CH2 4.38Å
335	A	92.9	Very high	91.4	Very high	4 Å²	4	26.8 Å²	26.8	3%	0.033	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.5	15	176	0	0	0	0	0	113.5	A257 K258 I261 T331 L332 I333 M337	A257-A335 HydrophobicContact CB-CB 3.87Å; K258-A335 HydrophobicContact CB-CB 4.14Å; I261-A335 HydrophobicContact CD1-CB 3.46Å; I261-A335 VanDerWaalsContact CD1-CB 3.46Å; T331-A335 PolarHBondContact O-N 3.36Å; L332-A335 CarbonylContact O-C 3.57Å; L332-A335 WeakPolarHBondContact O-CA 3.42Å; L332-A335 PolarHBondContact O-N 3.27Å; I333-A335 PolarHBondContact O-N 3.47Å; A335-M337 PolarHBondContact O-N 2.97Å; A335-M337 VanDerWaalsContact O-N 3.11Å
336	G	91.6	Very high	91.4	Very high	20 Å²	20	30.7 Å²	30.7	21%	0.206	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.5	0.1	-179.5	0	0	0	0	0	115.1	E254 L332 I333 T338	E254-G336 VanDerWaalsContact CD-CA 3.48Å; E254-G336 WeakPolarHBondContact OE2-CA 3.47Å; L332-G336 PolarHBondContact O-N 3.48Å; I333-G336 PolarHBondContact O-N 2.89Å; I333-G336 VanDerWaalsContact O-N 3.11Å; G336-T338 PolarHBondContact O-N 2.93Å
337	M	91.3	Very high	91.1	Very high	49 Å²	49	34.5 Å²	34.5	24%	0.241	16%	0.164	C	C	.	.			trans	-84.4	51.9	-174.2	-68	178	68.1	0	0	112.2	K258 L332 A335 D339 E340 A341	K258-M337 HydrophobicContact CD-SD 4.38Å; K258-M337 HydrophobicContact CG-SD 4.03Å; L332-M337 HydrophobicContact CB-CB 4.41Å; L332-M337 HydrophobicContact CD2-CB 3.73Å; L332-M337 HydrophobicContact CD2-CE 4.06Å; L332-M337 HydrophobicContact CD2-SD 4.13Å; L332-M337 PolarHBondContact O-N 3.39Å; A335-M337 PolarHBondContact O-N 2.97Å; A335-M337 VanDerWaalsContact O-N 3.11Å; M337-D339 VanDerWaalsContact C-N 3.27Å; M337-D339 PolarHBondContact O-N 3.38Å; M337-E340 HydrophobicContact CB-CB 4.31Å; M337-E340 HydrophobicContact CE-CB 4.07Å; M337-E340 HydrophobicContact CE-CG 4.24Å; M337-E340 PolarHBondContact O-N 3.15Å; M337-E340 VanDerWaalsContact O-N 3.15Å; M337-A341 PolarHBondContact O-N 3.04Å
338	T	89.7	Confident	90.8	Very high	13 Å²	13	31.6 Å²	31.6	8%	0.08	15%	0.154	C	C	.	.	H	α-helix	trans	-54.2	-42	-177.7	44.1	0	0	0	0	112.9	G336 E340 A341 Q342 W360	G336-T338 PolarHBondContact O-N 2.93Å; T338-E340 VanDerWaalsContact C-N 3.33Å; T338-E340 PolarHBondContact O-N 3.21Å; T338-A341 WeakPolarHBondContact O-CB 3.33Å; T338-A341 PolarHBondContact O-N 2.97Å; T338-Q342 PolarHBondContact O-N 3.41Å; T338-W360 HydrophobicContact CG2-CZ2 4.24Å
339	D	89.4	Confident	90.7	Very high	52 Å²	52	30 Å²	30	28%	0.278	15%	0.152	S	C	.	.	H	α-helix	trans	-69.7	-34.9	-176.4	-40.1	-13	0	0	0	111.1	M337 A341 Q342 R343	M337-D339 VanDerWaalsContact C-N 3.27Å; M337-D339 PolarHBondContact O-N 3.38Å; D339-A341 VanDerWaalsContact C-N 3.33Å; D339-Q342 CarbonylContact O-C 3.6Å; D339-Q342 WeakPolarHBondContact O-CB 3.31Å; D339-Q342 PolarHBondContact O-N 2.99Å; D339-R343 VanDerWaalsContact CB-NH2 3.34Å; D339-R343 VanDerWaalsContact O-CG 3.3Å; D339-R343 WeakPolarHBondContact O-CG 3.28Å; D339-R343 PolarHBondContact O-N 3.16Å; D339-R343 IonicContact OD2-NH2 2.73Å
340	E	89.3	Confident	90.6	Very high	48 Å²	48	30.1 Å²	30.1	22%	0.224	15%	0.153	C	C	.	.	H	α-helix	trans	-73.8	-30.9	176.9	-159.7	55.8	-139	0	0	110.8	F264 L332 M337 T338 R343 L344	F264-E340 HydrophobicContact CD1-CG 4.38Å; L332-E340 HydrophobicContact CD2-CB 4.1Å; L332-E340 HydrophobicContact CD2-CG 4.32Å; M337-E340 HydrophobicContact CB-CB 4.31Å; M337-E340 HydrophobicContact CE-CB 4.07Å; M337-E340 HydrophobicContact CE-CG 4.24Å; M337-E340 PolarHBondContact O-N 3.15Å; M337-E340 VanDerWaalsContact O-N 3.15Å; T338-E340 VanDerWaalsContact C-N 3.33Å; T338-E340 PolarHBondContact O-N 3.21Å; E340-R343 PolarHBondContact O-N 3.22Å; E340-R343 WeakPolarHBondContact OE2-CD 3.19Å; E340-R343 IonicContact OE2-CZ 2.73Å; E340-R343 IonicContact OE2-NE 3.21Å; E340-R343 IonicContact OE2-NH1 3.91Å; E340-R343 PolarHBondContact OE2-NH1 3.09Å; E340-L344 WeakPolarHBondContact O-CB 3.4Å; E340-L344 PolarHBondContact O-N 3.49Å
341	A	90.3	Very high	90.4	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-61.5	-43.7	166.3	0	0	0	0	0	111.5	L329 L332 I333 M337 T338 D339 L344 C345 L357	L329-A341 HydrophobicContact CD2-CB 3.77Å; L329-A341 WeakPolarHBondContact CD2-O 3.43Å; L332-A341 HydrophobicContact CB-CB 3.92Å; L332-A341 HydrophobicContact CD1-CB 3.93Å; I333-A341 HydrophobicContact CD1-CB 4.44Å; I333-A341 HydrophobicContact CG1-CB 4.12Å; M337-A341 PolarHBondContact O-N 3.04Å; T338-A341 WeakPolarHBondContact O-CB 3.33Å; T338-A341 PolarHBondContact O-N 2.97Å; D339-A341 VanDerWaalsContact C-N 3.33Å; A341-L344 PolarHBondContact O-N 2.99Å; A341-C345 WeakPolarHBondContact O-CB 3.23Å; A341-C345 PolarHBondContact O-N 3.46Å; A341-C345 PolarHBondContact O-SG 2.91Å; A341-L357 HydrophobicContact CB-CD1 4.28Å
342	Q	91.6	Very high	90.4	Very high	24 Å²	24	34.2 Å²	34.2	11%	0.112	18%	0.176	C	C	.	.	H	α-helix	trans	-64.9	-42.4	173.8	-67.9	178.7	14.7	0	0	112.7	T338 D339 L344 C345 K346 A354 L357 E358	T338-Q342 PolarHBondContact O-N 3.41Å; D339-Q342 CarbonylContact O-C 3.6Å; D339-Q342 WeakPolarHBondContact O-CB 3.31Å; D339-Q342 PolarHBondContact O-N 2.99Å; Q342-L344 VanDerWaalsContact C-N 3.34Å; Q342-C345 PolarHBondContact O-N 3.07Å; Q342-K346 WeakPolarHBondContact O-CB 3.32Å; Q342-K346 WeakPolarHBondContact O-CD 3.3Å; Q342-K346 VanDerWaalsContact O-CG 3.27Å; Q342-K346 WeakPolarHBondContact O-CG 3.39Å; Q342-K346 PolarHBondContact O-N 3.23Å; Q342-A354 HydrophobicContact CB-CB 4.24Å; Q342-L357 HydrophobicContact CG-CB 4.02Å; Q342-L357 PolarHBondContact NE2-O 3.1Å; Q342-E358 VanDerWaalsContact NE2-CG 3.26Å; Q342-E358 PolarHBondContact OE1-OE1 3.34Å
343	R	89.8	Confident	90.4	Very high	113 Å²	113	34.6 Å²	34.6	43%	0.426	18%	0.178	S	C	.	.	H	α-helix	trans	-63.1	-40.2	175.9	-70.9	178.3	-153.7	106.4	9.4	110.9	D339 E340 K346 R347	D339-R343 VanDerWaalsContact CB-NH2 3.34Å; D339-R343 VanDerWaalsContact O-CG 3.3Å; D339-R343 WeakPolarHBondContact O-CG 3.28Å; D339-R343 PolarHBondContact O-N 3.16Å; D339-R343 IonicContact OD2-NH2 2.73Å; E340-R343 PolarHBondContact O-N 3.22Å; E340-R343 WeakPolarHBondContact OE2-CD 3.19Å; E340-R343 IonicContact OE2-CZ 2.73Å; E340-R343 IonicContact OE2-NE 3.21Å; E340-R343 IonicContact OE2-NH1 3.91Å; E340-R343 PolarHBondContact OE2-NH1 3.09Å; R343-K346 PolarHBondContact O-N 2.85Å; R343-R347 WeakPolarHBondContact O-CB 3.44Å; R343-R347 WeakPolarHBondContact O-CG 3.44Å; R343-R347 PolarHBondContact O-N 3.45Å
344	L	88.7	Confident	90.4	Very high	4 Å²	4	34.3 Å²	34.3	2%	0.021	18%	0.176	C	C	.	.	H	α-helix	trans	-63.4	-48.2	174.1	-179	58.1	0	0	0	111.8	F264 I268 L325 N328 L329 L332 E340 A341 Q342 K346 R347 C348	F264-L344 HydrophobicContact CE1-CD2 4.32Å; F264-L344 HydrophobicContact CZ-CD2 4.25Å; I268-L344 HydrophobicContact CD1-CD1 4.44Å; I268-L344 HydrophobicContact CG2-CD1 3.61Å; L325-L344 HydrophobicContact CD1-CD1 4.21Å; L325-L344 HydrophobicContact CD1-CD2 3.87Å; L325-L344 HydrophobicContact CD1-CG 3.69Å; N328-L344 HydrophobicContact CB-CD2 4.24Å; L329-L344 HydrophobicContact CD2-CB 4.2Å; L329-L344 HydrophobicContact CD2-CD2 4Å; L329-L344 HydrophobicContact CD2-CG 4.22Å; L329-L344 HydrophobicContact CG-CD2 4.4Å; L332-L344 HydrophobicContact CD1-CB 4.48Å; L332-L344 HydrophobicContact CD1-CD2 3.88Å; E340-L344 WeakPolarHBondContact O-CB 3.4Å; E340-L344 PolarHBondContact O-N 3.49Å; A341-L344 PolarHBondContact O-N 2.99Å; Q342-L344 VanDerWaalsContact C-N 3.34Å; L344-K346 VanDerWaalsContact C-N 3.32Å; L344-K346 PolarHBondContact O-N 3.23Å; L344-R347 PolarHBondContact O-N 3.09Å; L344-C348 WeakPolarHBondContact O-CB 3.38Å; L344-C348 PolarHBondContact O-N 2.96Å; L344-C348 PolarHBondContact O-SG 3.4Å
345	C	90.5	Very high	90.3	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-55	-46	171.4	-78.1	0	0	0	0	112	L329 A341 Q342 C348 Q350 A354	L329-C345 WeakPolarHBondContact CD1-SG 3.44Å; L329-C345 VanDerWaalsContact CD2-SG 3.53Å; A341-C345 WeakPolarHBondContact O-CB 3.23Å; A341-C345 PolarHBondContact O-N 3.46Å; A341-C345 PolarHBondContact O-SG 2.91Å; Q342-C345 PolarHBondContact O-N 3.07Å; C345-C348 PolarHBondContact O-N 3.27Å; C345-Q350 CarbonylContact O-C 3.33Å; C345-Q350 WeakPolarHBondContact O-CA 3.24Å; C345-Q350 PolarHBondContact O-N 3.38Å; C345-A354 HydrophobicContact CB-CB 3.7Å
346	K	89.9	Confident	90.3	Very high	99 Å²	99	38.1 Å²	38.1	43%	0.43	21%	0.207	S	C	.	.	H	α-helix	trans	-64.2	-39.2	177.8	-74.2	156.9	179.4	158.3	0	111.5	Q342 R343 L344 A354 E358	Q342-K346 WeakPolarHBondContact O-CB 3.32Å; Q342-K346 WeakPolarHBondContact O-CD 3.3Å; Q342-K346 VanDerWaalsContact O-CG 3.27Å; Q342-K346 WeakPolarHBondContact O-CG 3.39Å; Q342-K346 PolarHBondContact O-N 3.23Å; R343-K346 PolarHBondContact O-N 2.85Å; L344-K346 VanDerWaalsContact C-N 3.32Å; L344-K346 PolarHBondContact O-N 3.23Å; K346-A354 HydrophobicContact CD-CB 3.94Å; K346-A354 HydrophobicContact CG-CB 3.67Å; K346-E358 IonicContact NZ-OE1 2.77Å; K346-E358 PolarHBondContact NZ-OE1 3.21Å
347	R	86.6	Confident	90.3	Very high	81 Å²	81	37.5 Å²	37.5	31%	0.306	20%	0.199	S	C	.	.	H	α-helix	trans	-64.9	-43	173.5	-75.3	174.6	76.5	163.1	8.5	112.7	E269 R343 L344 G349	E269-R347 IonicContact OE1-CZ 3.56Å; E269-R347 IonicContact OE1-NH2 3.46Å; E269-R347 PolarHBondContact OE1-NH2 3.43Å; R343-R347 WeakPolarHBondContact O-CB 3.44Å; R343-R347 WeakPolarHBondContact O-CG 3.44Å; R343-R347 PolarHBondContact O-N 3.45Å; L344-R347 PolarHBondContact O-N 3.09Å; R347-G349 PolarHBondContact O-N 2.62Å; R347-G349 VanDerWaalsContact O-N 3.15Å
348	C	87.3	Confident	90.2	Very high	18 Å²	18	39 Å²	39	12%	0.122	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	13.3	-179.2	-67.9	0	0	0	0	114.5	K273 L325 L344 C345 Q350	K273-C348 CarbonylContact O-C 3.53Å; K273-C348 WeakPolarHBondContact O-CA 3.43Å; L325-C348 HydrophobicContact CD1-CB 4.44Å; L325-C348 HydrophobicContact CD2-CB 3.71Å; L344-C348 WeakPolarHBondContact O-CB 3.38Å; L344-C348 PolarHBondContact O-N 2.96Å; L344-C348 PolarHBondContact O-SG 3.4Å; C345-C348 PolarHBondContact O-N 3.27Å; C348-Q350 PolarHBondContact O-N 3.03Å
349	G	87.6	Confident	90.1	Very high	32 Å²	32	38.8 Å²	38.8	33%	0.33	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.7	11	-178.9	0	0	0	0	0	114.9	R347	R347-G349 PolarHBondContact O-N 2.62Å; R347-G349 VanDerWaalsContact O-N 3.15Å
350	Q	90.3	Very high	89.9	Confident	4 Å²	4	37.9 Å²	37.9	2%	0.019	20%	0.198	C	C	.	.			trans	-104.2	52.7	-178.4	-67.6	-178.5	-13.1	0	0	111.6	C276 D322 C345 C348 W352 R353 A354	C276-Q350 HydrophobicContact CB-CG 4.26Å; C276-Q350 VanDerWaalsContact SG-CG 3.54Å; C276-Q350 PolarHBondContact SG-NE2 2.94Å; D322-Q350 PolarHBondContact OD1-NE2 2.88Å; C345-Q350 CarbonylContact O-C 3.33Å; C345-Q350 WeakPolarHBondContact O-CA 3.24Å; C345-Q350 PolarHBondContact O-N 3.38Å; C348-Q350 PolarHBondContact O-N 3.03Å; Q350-W352 HydrophobicContact CB-CZ2 4.33Å; Q350-W352 HydrophobicContact CG-CZ2 3.99Å; Q350-W352 PolarHBondContact O-N 3.02Å; Q350-W352 VanDerWaalsContact O-N 3.12Å; Q350-R353 HydrophobicContact CB-CB 4.08Å; Q350-R353 PolarHBondContact O-N 2.79Å; Q350-A354 PolarHBondContact O-N 2.82Å; Q350-A354 VanDerWaalsContact O-N 3.15Å
351	A	90.4	Very high	89.9	Confident	61 Å²	61	37.4 Å²	37.4	50%	0.504	20%	0.195	S	C	.	.	H	α-helix	trans	-57.3	-27.3	177.3	0	0	0	0	0	113	A354 A355	A351-A354 PolarHBondContact O-N 2.94Å; A351-A355 PolarHBondContact O-N 3.37Å
352	W	91.9	Very high	89.8	Confident	77 Å²	77	38.9 Å²	38.9	29%	0.292	20%	0.203	S	C	.	.	H	α-helix	trans	-62.8	-42.2	171.8	58.9	-95.4	0	0	0	112.7	P304 Q350 A354 A355 T356	P304-W352 HydrophobicContact CB-CD2 3.77Å; P304-W352 HydrophobicContact CB-CE3 3.66Å; P304-W352 HydrophobicContact CB-CH2 3.71Å; P304-W352 HydrophobicContact CB-CZ2 3.81Å; P304-W352 HydrophobicContact CB-CZ3 3.63Å; P304-W352 HydrophobicContact CG-CD2 4.04Å; P304-W352 HydrophobicContact CG-CE3 4.04Å; P304-W352 HydrophobicContact CG-CG 4.4Å; P304-W352 HydrophobicContact CG-CZ3 4.46Å; Q350-W352 HydrophobicContact CB-CZ2 4.33Å; Q350-W352 HydrophobicContact CG-CZ2 3.99Å; Q350-W352 PolarHBondContact O-N 3.02Å; Q350-W352 VanDerWaalsContact O-N 3.12Å; W352-A354 VanDerWaalsContact C-N 3.31Å; W352-A355 PolarHBondContact O-N 2.89Å; W352-T356 PolarHBondContact O-N 2.97Å
353	R	92.5	Very high	89.6	Confident	8 Å²	8	40.2 Å²	40.2	3%	0.03	21%	0.208	C	C	.	.	H	α-helix	trans	-73	-26.1	177.5	-162.4	-179.8	-92.4	157.7	-9.1	111.3	D322 L326 Q350 T356 L357 E404	D322-R353 IonicContact OD1-CZ 3.5Å; D322-R353 IonicContact OD1-NH1 2.77Å; D322-R353 PolarHBondContact OD1-NH1 2.85Å; D322-R353 IonicContact OD1-NH2 3.41Å; D322-R353 IonicContact OD2-CZ 2.73Å; D322-R353 IonicContact OD2-NH1 2.64Å; D322-R353 PolarHBondContact OD2-NH1 3.42Å; D322-R353 IonicContact OD2-NH2 3.17Å; D322-R353 PolarHBondContact OD2-NH2 3.25Å; L326-R353 VanDerWaalsContact CD2-CZ 3.48Å; Q350-R353 HydrophobicContact CB-CB 4.08Å; Q350-R353 PolarHBondContact O-N 2.79Å; R353-T356 PolarHBondContact O-OG1 2.7Å; R353-T356 VanDerWaalsContact O-OG1 3.05Å; R353-L357 VanDerWaalsContact O-CG 3.26Å; R353-L357 WeakPolarHBondContact O-CG 3.46Å; R353-L357 PolarHBondContact O-N 3.26Å; R353-E404 IonicContact CZ-OE1 2.68Å; R353-E404 VanDerWaalsContact CZ-OE1 3.25Å; R353-E404 IonicContact NE-OE1 3.15Å; R353-E404 PolarHBondContact NE-OE1 3.21Å; R353-E404 VanDerWaalsContact NH2-CD 3.34Å; R353-E404 IonicContact NH2-OE1 2.77Å; R353-E404 PolarHBondContact NH2-OE1 3.42Å; R353-E404 IonicContact NH2-OE2 3.72Å; R353-E404 PolarHBondContact NH2-OE2 3.24Å
354	A	92.5	Very high	89.5	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-69.3	-40.6	168.8	0	0	0	0	0	112.1	Q342 C345 K346 Q350 A351 W352 L357 E358	Q342-A354 HydrophobicContact CB-CB 4.24Å; C345-A354 HydrophobicContact CB-CB 3.7Å; K346-A354 HydrophobicContact CD-CB 3.94Å; K346-A354 HydrophobicContact CG-CB 3.67Å; Q350-A354 PolarHBondContact O-N 2.82Å; Q350-A354 VanDerWaalsContact O-N 3.15Å; A351-A354 PolarHBondContact O-N 2.94Å; W352-A354 VanDerWaalsContact C-N 3.31Å; A354-L357 WeakPolarHBondContact O-CB 3.3Å; A354-L357 PolarHBondContact O-N 2.98Å; A354-E358 PolarHBondContact O-N 3.17Å
355	A	91.8	Very high	89.3	Confident	55 Å²	55	37 Å²	37	46%	0.455	20%	0.198	S	C	.	.	H	α-helix	trans	-68.1	-35.2	177.3	0	0	0	0	0	112.8	A351 W352 L357 E358	A351-A355 PolarHBondContact O-N 3.37Å; W352-A355 PolarHBondContact O-N 2.89Å; A355-L357 PolarHBondContact O-N 3.23Å; A355-E358 PolarHBondContact O-N 3.05Å; A355-E358 VanDerWaalsContact O-N 3.13Å
356	T	92.6	Very high	88.8	Confident	43 Å²	43	37.7 Å²	37.7	26%	0.264	20%	0.202	S	C	.	.	H	α-helix	trans	-64.7	-30.5	172.3	56.8	0	0	0	0	112.1	W352 R353 E358 W387 Y408	W352-T356 PolarHBondContact O-N 2.97Å; R353-T356 PolarHBondContact O-OG1 2.7Å; R353-T356 VanDerWaalsContact O-OG1 3.05Å; T356-E358 VanDerWaalsContact C-N 3.28Å; T356-E358 PolarHBondContact O-N 3.47Å; T356-W387 VanDerWaalsContact O-CZ2 3.31Å; T356-W387 WeakPolarHBondContact O-CZ2 3.13Å; T356-W387 PolarHBondContact O-NE1 3.23Å; T356-Y408 PolarHBondContact OG1-OH 2.94Å
357	L	91.9	Very high	88.4	Confident	7 Å²	7	35 Å²	35	4%	0.037	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-0.3	173.3	-66.9	174.7	0	0	0	114.9	I333 A341 Q342 R353 A354 A355 W360 I407 L411	I333-L357 HydrophobicContact CD1-CD1 4.41Å; I333-L357 HydrophobicContact CD1-CD2 3.68Å; A341-L357 HydrophobicContact CB-CD1 4.28Å; Q342-L357 HydrophobicContact CG-CB 4.02Å; Q342-L357 PolarHBondContact NE2-O 3.1Å; R353-L357 VanDerWaalsContact O-CG 3.26Å; R353-L357 WeakPolarHBondContact O-CG 3.46Å; R353-L357 PolarHBondContact O-N 3.26Å; A354-L357 WeakPolarHBondContact O-CB 3.3Å; A354-L357 PolarHBondContact O-N 2.98Å; A355-L357 PolarHBondContact O-N 3.23Å; L357-W360 PolarHBondContact O-NE1 3.13Å; L357-I407 HydrophobicContact CD2-CG2 3.71Å; L357-L411 HydrophobicContact CD2-CD1 3.61Å
358	E	89.6	Confident	87.7	Confident	80 Å²	80	36.4 Å²	36.4	37%	0.374	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-23.8	172.8	-71	166.3	-158.7	0	0	111.6	Q342 K346 A354 A355 T356 W360 K361	Q342-E358 VanDerWaalsContact NE2-CG 3.26Å; Q342-E358 PolarHBondContact OE1-OE1 3.34Å; K346-E358 IonicContact NZ-OE1 2.77Å; K346-E358 PolarHBondContact NZ-OE1 3.21Å; A354-E358 PolarHBondContact O-N 3.17Å; A355-E358 PolarHBondContact O-N 3.05Å; A355-E358 VanDerWaalsContact O-N 3.13Å; T356-E358 VanDerWaalsContact C-N 3.28Å; T356-E358 PolarHBondContact O-N 3.47Å; E358-W360 VanDerWaalsContact C-N 3.28Å; E358-W360 PolarHBondContact O-N 2.87Å; E358-W360 VanDerWaalsContact O-N 3.14Å; E358-K361 PolarHBondContact O-N 2.98Å
359	G	87.8	Confident	86.5	Confident	9 Å²	9	41 Å²	41	9%	0.093	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-4.7	-169.1	0	0	0	0	0	117.8	N381	G359-N381 WeakPolarHBondContact O-CB 3.35Å; G359-N381 PolarHBondContact O-ND2 2.62Å
360	W	85.1	Confident	85.1	Confident	33 Å²	33	41.3 Å²	41.3	13%	0.125	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-17.5	173.3	68.1	-87.9	0	0	0	113.3	R14 T338 L357 E358 L362 W387 L411	R14-W360 HydrophobicContact CB-CH2 3.92Å; R14-W360 HydrophobicContact CB-CZ3 4.44Å; R14-W360 HydrophobicContact CG-CH2 4.42Å; T338-W360 HydrophobicContact CG2-CZ2 4.24Å; L357-W360 PolarHBondContact O-NE1 3.13Å; E358-W360 VanDerWaalsContact C-N 3.28Å; E358-W360 PolarHBondContact O-N 2.87Å; E358-W360 VanDerWaalsContact O-N 3.14Å; W360-L362 PolarHBondContact O-N 2.91Å; W360-W387 HydrophobicContact CB-CH2 3.61Å; W360-W387 HydrophobicContact CB-CZ2 4.25Å; W360-W387 HydrophobicContact CB-CZ3 3.75Å; W360-L411 HydrophobicContact CB-CB 4.44Å; W360-L411 HydrophobicContact CG-CD2 4.21Å
361	K	88.4	Confident	83.5	Confident	38 Å²	38	45.3 Å²	45.3	17%	0.165	27%	0.265	C	S	.	.	S	Bend	trans	-60.9	130.8	-179.5	-78.9	-163.4	170.4	-154.2	0	110.6	D16 E358 G380 N381	D16-K361 IonicContact OD1-NZ 2.71Å; D16-K361 PolarHBondContact OD1-NZ 3.05Å; D16-K361 IonicContact OD2-NZ 3.79Å; D16-K361 PolarHBondContact OD2-NZ 3.29Å; E358-K361 PolarHBondContact O-N 2.98Å; K361-G380 VanDerWaalsContact O-CA 3.28Å; K361-G380 WeakPolarHBondContact O-CA 3.23Å; K361-N381 PolarHBondContact O-N 3.01Å
362	L	88.5	Confident	82.1	Confident	31 Å²	31	47.6 Å²	47.6	16%	0.162	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-62.3	143.2	-179.8	-60.6	175.1	0	0	0	111.4	V13 E229 K230 V233 W360 H364 G380 L445	V13-L362 HydrophobicContact CG1-CD1 3.78Å; E229-L362 HydrophobicContact CB-CB 4.43Å; K230-L362 HydrophobicContact CB-CB 4.17Å; V233-L362 HydrophobicContact CB-CD1 3.67Å; V233-L362 HydrophobicContact CG1-CD1 3.86Å; V233-L362 HydrophobicContact CG2-CD1 3.69Å; V233-L362 HydrophobicContact CG2-CD2 4.43Å; W360-L362 PolarHBondContact O-N 2.91Å; L362-H364 PolarHBondContact O-N 3.25Å; L362-G380 WeakPolarHBondContact O-CA 3.37Å; L362-L445 HydrophobicContact CD2-CD1 4.26Å
363	Y	88	Confident	80.8	Confident	52 Å²	52	50.2 Å²	50.2	20%	0.204	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-73.1	129.4	-178	177.2	-118.2	0	0	0	113.1	S228 E229 K230 V378 P382	S228-Y363 PolarHBondContact OG-O 3.35Å; E229-Y363 PolarHBondContact N-O 3.04Å; E229-Y363 VanDerWaalsContact OE2-CB 3.29Å; E229-Y363 WeakPolarHBondContact OE2-CB 3.33Å; E229-Y363 PolarHBondContact OE2-N 2.9Å; K230-Y363 PolarHBondContact N-O 3.25Å; Y363-V378 HydrophobicContact CD2-CG1 4.36Å; Y363-V378 HydrophobicContact CE2-CG1 3.55Å; Y363-P382 HydrophobicContact CD1-CB 4.17Å; Y363-P382 HydrophobicContact CD2-CB 3.71Å; Y363-P382 HydrophobicContact CD2-CG 4.15Å; Y363-P382 HydrophobicContact CE1-CB 4.4Å; Y363-P382 HydrophobicContact CE2-CB 3.97Å; Y363-P382 HydrophobicContact CE2-CG 4.28Å; Y363-P382 HydrophobicContact CG-CB 3.83Å
364	H	87.2	Confident	80	Confident	24 Å²	24	57.8 Å²	57.8	11%	0.111	34%	0.335	C	S	.	.	B	Isolated β-bridge	trans	-145.3	132.6	175.5	-172.6	68.6	0	0	0	112.9	S228 K230 L362 V378 E379	S228-H364 WeakPolarHBondContact OG-CA 3.47Å; S228-H364 PolarHBondContact OG-ND1 2.73Å; K230-H364 HydrophobicContact CB-CB 3.84Å; K230-H364 HydrophobicContact CD-CB 3.5Å; K230-H364 VanDerWaalsContact CD-CB 3.5Å; K230-H364 HydrophobicContact CG-CB 4.33Å; L362-H364 PolarHBondContact O-N 3.25Å; H364-V378 WeakPolarHBondContact O-CG1 3.47Å; H364-E379 HydrophobicContact CB-CB 4.34Å; H364-E379 IonicContact CD2-OE2 2.88Å; H364-E379 PolarHBondContact N-O 2.9Å; H364-E379 PolarHBondContact O-N 3.44Å
365	D	85.1	Confident	79.3	Confident	24 Å²	24	65 Å²	65	13%	0.128	37%	0.373	C	S	.	.			trans	-122.9	100.7	170.4	-172.3	-16.5	0	0	0	108.9	N367 M368 V378	D365-N367 PolarHBondContact O-N 3.28Å; D365-N367 WeakPolarHBondContact OD1-CB 3.39Å; D365-N367 PolarHBondContact OD1-N 3.15Å; D365-N367 PolarHBondContact OD1-ND2 3.45Å; D365-M368 HydrophobicContact CB-CE 4.48Å; D365-M368 HydrophobicContact CB-CG 3.84Å; D365-M368 PolarHBondContact O-N 2.93Å; D365-V378 HydrophobicContact CB-CG1 4.26Å; D365-V378 HydrophobicContact CB-CG2 4.28Å
366	P	80.8	Confident	78.9	Confident	15 Å²	15	67.4 Å²	67.4	10%	0.097	38%	0.375	C	S	.	.	H	α-helix	trans	-60.1	-19.3	179.8	-19.6	28.5	0	0	0	113.6	M368 S370 Q376 P377	P366-M368 VanDerWaalsContact C-N 3.35Å; P366-S370 WeakPolarHBondContact O-CB 3.37Å; P366-S370 PolarHBondContact O-N 3.44Å; P366-S370 PolarHBondContact O-OG 2.64Å; P366-Q376 HydrophobicContact CB-CB 4.02Å; P366-Q376 HydrophobicContact CG-CB 4.01Å; P366-P377 WeakPolarHBondContact CD-O 3.48Å
367	N	80.8	Confident	78.5	Confident	42 Å²	42	70 Å²	70	23%	0.225	39%	0.392	C	S	.	.	H	α-helix	trans	-82.4	-12.5	-174.8	-46	-79.9	0	0	0	112.7	D365 L375 Q376	D365-N367 PolarHBondContact O-N 3.28Å; D365-N367 WeakPolarHBondContact OD1-CB 3.39Å; D365-N367 PolarHBondContact OD1-N 3.15Å; D365-N367 PolarHBondContact OD1-ND2 3.45Å; N367-L375 HydrophobicContact CB-CD2 4.05Å; N367-L375 VanDerWaalsContact OD1-CA 3.25Å; N367-L375 WeakPolarHBondContact OD1-CA 3.26Å; N367-L375 WeakPolarHBondContact OD1-CD2 3.31Å; N367-Q376 PolarHBondContact ND2-O 2.93Å; N367-Q376 PolarHBondContact OD1-N 3.35Å
368	M	70.9	Confident	78.2	Confident	112 Å²	112	73.5 Å²	73.5	55%	0.552	41%	0.414	S	S	*	.	H	α-helix	trans	-71.7	-38.1	173.8	-65	-71.6	-179.2	0	0	111.7	D365 P366	D365-M368 HydrophobicContact CB-CE 4.48Å; D365-M368 HydrophobicContact CB-CG 3.84Å; D365-M368 PolarHBondContact O-N 2.93Å; P366-M368 VanDerWaalsContact C-N 3.35Å
369	I	63.6	Low	78.1	Confident	114 Å²	114	72.6 Å²	72.6	59%	0.585	41%	0.41	S	S	*	.	H	α-helix	trans	-98.8	-34.2	-172.5	-55.3	176	0	0	0	111.4
370	S	57.8	Low	78	Confident	38 Å²	38	73.9 Å²	73.9	27%	0.266	42%	0.423	S	S	.	.			trans	-91.3	122.6	-174.1	70.2	0	0	0	0	113.4	P366 N372	P366-S370 WeakPolarHBondContact O-CB 3.37Å; P366-S370 PolarHBondContact O-N 3.44Å; P366-S370 PolarHBondContact O-OG 2.64Å; S370-N372 PolarHBondContact O-N 3.01Å
371	G	57.4	Low	78.1	Confident	88 Å²	88	73.9 Å²	73.9	91%	0.907	43%	0.425	S	S	*	.			trans	-74.5	32.7	171.9	0	0	0	0	0	114.3
372	N	60.8	Low	77.9	Confident	110 Å²	110	75.5 Å²	75.5	59%	0.588	44%	0.44	S	S	*	.			trans	-83.6	147.4	-173.7	-80.1	-30.7	0	0	0	112.4	S370 E374	S370-N372 PolarHBondContact O-N 3.01Å; N372-E374 VanDerWaalsContact C-N 3.3Å; N372-E374 PolarHBondContact O-N 3.11Å
373	S	64	Low	77.7	Confident	132 Å²	132	78.7 Å²	78.7	92%	0.923	45%	0.454	S	S	*	.	S	Bend	trans	-78.7	-10.1	179.7	-55.7	0	0	0	0	114.5
374	E	75.2	Confident	77.7	Confident	167 Å²	167	76.8 Å²	76.8	78%	0.78	45%	0.446	S	S	*	.	S	Bend	trans	-117.2	121.6	-179.1	-64.9	-172.7	165.2	0	0	108.8	N372	N372-E374 VanDerWaalsContact C-N 3.3Å; N372-E374 PolarHBondContact O-N 3.11Å
375	L	79.3	Confident	77.6	Confident	152 Å²	152	75.9 Å²	75.9	80%	0.796	44%	0.444	S	S	*	.	P	Polyproline II helix	trans	-75.1	130.2	-178.5	-66.3	171.7	0	0	0	110.8	N367	N367-L375 HydrophobicContact CB-CD2 4.05Å; N367-L375 VanDerWaalsContact OD1-CA 3.25Å; N367-L375 WeakPolarHBondContact OD1-CA 3.26Å; N367-L375 WeakPolarHBondContact OD1-CD2 3.31Å
376	Q	81.7	Confident	77.7	Confident	104 Å²	104	78.8 Å²	78.8	49%	0.486	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-90.8	154.2	172.8	-71.1	-175.4	-28.3	0	0	110.7	P366 N367	P366-Q376 HydrophobicContact CB-CB 4.02Å; P366-Q376 HydrophobicContact CG-CB 4.01Å; N367-Q376 PolarHBondContact ND2-O 2.93Å; N367-Q376 PolarHBondContact OD1-N 3.35Å
377	P	84.9	Confident	78.2	Confident	98 Å²	98	79.8 Å²	79.8	64%	0.636	46%	0.46	S	S	*	.	P	Polyproline II helix	trans	-61.5	147.9	175.4	27.9	-35.3	0	0	0	111.2	P366	P366-P377 WeakPolarHBondContact CD-O 3.48Å
378	V	86.4	Confident	78.6	Confident	81 Å²	81	77.9 Å²	77.9	49%	0.491	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-86.3	137.2	172.2	179.6	0	0	0	0	108.5	Y363 H364 D365	Y363-V378 HydrophobicContact CD2-CG1 4.36Å; Y363-V378 HydrophobicContact CE2-CG1 3.55Å; H364-V378 WeakPolarHBondContact O-CG1 3.47Å; D365-V378 HydrophobicContact CB-CG1 4.26Å; D365-V378 HydrophobicContact CB-CG2 4.28Å
379	E	86.1	Confident	79.5	Confident	60 Å²	60	73 Å²	73	28%	0.28	43%	0.427	S	S	.	.	B	Isolated β-bridge	trans	-114.7	151.4	-170.9	-66.2	173	168.9	0	0	112.2	K230 H364	K230-E379 IonicContact NZ-OE2 3.46Å; K230-E379 PolarHBondContact NZ-OE2 3.36Å; H364-E379 HydrophobicContact CB-CB 4.34Å; H364-E379 IonicContact CD2-OE2 2.88Å; H364-E379 PolarHBondContact N-O 2.9Å; H364-E379 PolarHBondContact O-N 3.44Å
380	G	86.5	Confident	80.9	Confident	36 Å²	36	70.4 Å²	70.4	37%	0.371	42%	0.418	S	S	.	.	S	Bend	trans	69.8	-162.5	173.6	0	0	0	0	0	115.5	K361 L362	K361-G380 VanDerWaalsContact O-CA 3.28Å; K361-G380 WeakPolarHBondContact O-CA 3.23Å; L362-G380 WeakPolarHBondContact O-CA 3.37Å
381	N	87.1	Confident	82.5	Confident	33 Å²	33	68.8 Å²	68.8	18%	0.176	41%	0.407	C	S	.	.			trans	-120.1	105.9	-168.8	178.1	8.9	0	0	0	111.5	G359 K361 Q383 R384 W387	G359-N381 WeakPolarHBondContact O-CB 3.35Å; G359-N381 PolarHBondContact O-ND2 2.62Å; K361-N381 PolarHBondContact O-N 3.01Å; N381-Q383 PolarHBondContact O-N 2.78Å; N381-Q383 WeakPolarHBondContact OD1-CA 3.36Å; N381-Q383 PolarHBondContact OD1-N 3.27Å; N381-R384 WeakPolarHBondContact ND2-CA 3.43Å; N381-R384 PolarHBondContact O-N 2.95Å; N381-R384 VanDerWaalsContact O-N 3.08Å; N381-W387 VanDerWaalsContact ND2-CB 3.35Å; N381-W387 WeakPolarHBondContact ND2-CB 3.42Å
382	P	83.6	Confident	84.2	Confident	72 Å²	72	65.6 Å²	65.6	47%	0.468	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	0.1	178.2	28.6	-35.2	0	0	0	114	Y363	Y363-P382 HydrophobicContact CD1-CB 4.17Å; Y363-P382 HydrophobicContact CD2-CB 3.71Å; Y363-P382 HydrophobicContact CD2-CG 4.15Å; Y363-P382 HydrophobicContact CE1-CB 4.4Å; Y363-P382 HydrophobicContact CE2-CB 3.97Å; Y363-P382 HydrophobicContact CE2-CG 4.28Å; Y363-P382 HydrophobicContact CG-CB 3.83Å
383	Q	85.2	Confident	85.6	Confident	99 Å²	99	67.1 Å²	67.1	46%	0.463	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.2	39.9	173.3	-61	-72.5	-91.6	0	0	110.6	N381 G385 I386 W387	N381-Q383 PolarHBondContact O-N 2.78Å; N381-Q383 WeakPolarHBondContact OD1-CA 3.36Å; N381-Q383 PolarHBondContact OD1-N 3.27Å; Q383-G385 VanDerWaalsContact C-N 3.27Å; Q383-G385 PolarHBondContact O-N 2.89Å; Q383-I386 HydrophobicContact CB-CD1 4.4Å; Q383-I386 PolarHBondContact O-N 3.06Å; Q383-W387 PolarHBondContact O-N 3.36Å
384	R	87.2	Confident	86.9	Confident	11 Å²	11	64 Å²	64	4%	0.042	34%	0.337	C	S	.	.	H	α-helix	trans	-51.6	-43.1	179.4	-172.2	-172.6	63.6	-83.5	-11.1	112.3	E229 N381 I386 W387 K388 E442 L445	E229-R384 IonicContact OE1-CZ 2.69Å; E229-R384 IonicContact OE1-NH1 3.94Å; E229-R384 PolarHBondContact OE1-NH1 2.95Å; E229-R384 IonicContact OE1-NH2 3.9Å; E229-R384 PolarHBondContact OE1-NH2 3.34Å; E229-R384 IonicContact OE2-NH1 3.73Å; E229-R384 PolarHBondContact OE2-NH1 3.43Å; N381-R384 WeakPolarHBondContact ND2-CA 3.43Å; N381-R384 PolarHBondContact O-N 2.95Å; N381-R384 VanDerWaalsContact O-N 3.08Å; R384-I386 PolarHBondContact O-N 3.47Å; R384-W387 HydrophobicContact CG-CE3 4.37Å; R384-W387 CarbonylContact O-C 3.53Å; R384-W387 WeakPolarHBondContact O-CB 3.41Å; R384-W387 PolarHBondContact O-N 3.23Å; R384-W387 VanDerWaalsContact O-N 3.14Å; R384-K388 VanDerWaalsContact O-CB 3.27Å; R384-K388 WeakPolarHBondContact O-CB 3.17Å; R384-K388 PolarHBondContact O-N 2.87Å; R384-E442 IonicContact CZ-OE1 3.79Å; R384-E442 IonicContact CZ-OE2 3.02Å; R384-E442 IonicContact NE-OE1 2.76Å; R384-E442 PolarHBondContact NE-OE1 2.94Å; R384-E442 IonicContact NE-OE2 3.69Å; R384-E442 IonicContact NH2-OE1 2.68Å; R384-E442 PolarHBondContact NH2-OE1 3.34Å; R384-E442 IonicContact NH2-OE2 2.74Å; R384-E442 PolarHBondContact NH2-OE2 3.05Å; R384-L445 VanDerWaalsContact NH2-CD1 3.33Å
385	G	84.7	Confident	87.8	Confident	6 Å²	6	56.1 Å²	56.1	6%	0.062	30%	0.3	C	S	.	.	H	α-helix	trans	-59.5	-42.1	-179.2	0	0	0	0	0	114.2	Q383 K388 A389 E454	Q383-G385 VanDerWaalsContact C-N 3.27Å; Q383-G385 PolarHBondContact O-N 2.89Å; G385-K388 PolarHBondContact O-N 3.42Å; G385-A389 WeakPolarHBondContact O-CB 3.44Å; G385-A389 PolarHBondContact O-N 3.36Å; G385-E454 WeakPolarHBondContact CA-OE1 3.39Å
386	I	87.9	Confident	88.5	Confident	85 Å²	85	53.8 Å²	53.8	44%	0.436	29%	0.285	S	S	.	.	H	α-helix	trans	-63.6	-44.3	174.4	-58.4	-178.9	0	0	0	110.5	Q383 R384 K388 A389 C390	Q383-I386 HydrophobicContact CB-CD1 4.4Å; Q383-I386 PolarHBondContact O-N 3.06Å; R384-I386 PolarHBondContact O-N 3.47Å; I386-K388 VanDerWaalsContact C-N 3.3Å; I386-K388 PolarHBondContact O-N 3.11Å; I386-A389 PolarHBondContact O-N 3.47Å; I386-C390 PolarHBondContact O-N 3.41Å; I386-C390 PolarHBondContact O-SG 3.34Å; I386-C390 VanDerWaalsContact O-SG 3.4Å
387	W	90.6	Very high	89	Confident	36 Å²	36	52.1 Å²	52.1	14%	0.136	28%	0.277	C	S	.	.	H	α-helix	trans	-61.3	-39.9	175.2	171.3	95.5	0	0	0	111.5	T356 W360 N381 Q383 R384 C390 C391 L411	T356-W387 VanDerWaalsContact O-CZ2 3.31Å; T356-W387 WeakPolarHBondContact O-CZ2 3.13Å; T356-W387 PolarHBondContact O-NE1 3.23Å; W360-W387 HydrophobicContact CB-CH2 3.61Å; W360-W387 HydrophobicContact CB-CZ2 4.25Å; W360-W387 HydrophobicContact CB-CZ3 3.75Å; N381-W387 VanDerWaalsContact ND2-CB 3.35Å; N381-W387 WeakPolarHBondContact ND2-CB 3.42Å; Q383-W387 PolarHBondContact O-N 3.36Å; R384-W387 HydrophobicContact CG-CE3 4.37Å; R384-W387 CarbonylContact O-C 3.53Å; R384-W387 WeakPolarHBondContact O-CB 3.41Å; R384-W387 PolarHBondContact O-N 3.23Å; R384-W387 VanDerWaalsContact O-N 3.14Å; W387-C390 WeakPolarHBondContact O-CB 3.15Å; W387-C390 PolarHBondContact O-N 3.28Å; W387-C391 HydrophobicContact CH2-CB 4.39Å; W387-C391 WeakPolarHBondContact CZ2-SG 3.36Å; W387-C391 WeakPolarHBondContact O-CB 3.45Å; W387-C391 PolarHBondContact O-N 3.3Å; W387-C391 PolarHBondContact O-SG 3.1Å; W387-C391 VanDerWaalsContact O-SG 3.42Å; W387-L411 HydrophobicContact CH2-CB 3.71Å; W387-L411 WeakPolarHBondContact CZ3-O 3.36Å
388	K	90.4	Very high	89.2	Confident	2 Å²	2	55.1 Å²	55.1	1%	0.009	28%	0.283	C	S	.	.	H	α-helix	trans	-68.2	-41.8	-179.9	-169.5	157.4	176.2	161.9	0	111.6	R384 G385 I386 C391 W392 S412 D438 E442 L458 Y462	R384-K388 VanDerWaalsContact O-CB 3.27Å; R384-K388 WeakPolarHBondContact O-CB 3.17Å; R384-K388 PolarHBondContact O-N 2.87Å; G385-K388 PolarHBondContact O-N 3.42Å; I386-K388 VanDerWaalsContact C-N 3.3Å; I386-K388 PolarHBondContact O-N 3.11Å; K388-C391 PolarHBondContact O-N 3.38Å; K388-W392 WeakPolarHBondContact O-CB 3.37Å; K388-W392 PolarHBondContact O-N 3.25Å; K388-S412 WeakPolarHBondContact CE-O 3.43Å; K388-D438 IonicContact NZ-OD1 3.06Å; K388-D438 PolarHBondContact NZ-OD1 2.95Å; K388-D438 IonicContact NZ-OD2 3.9Å; K388-D438 PolarHBondContact NZ-OD2 2.98Å; K388-E442 HydrophobicContact CD-CG 4.44Å; K388-E442 WeakPolarHBondContact CD-OE1 3.36Å; K388-E442 WeakPolarHBondContact CE-OE1 3.33Å; K388-E442 IonicContact NZ-OE1 2.66Å; K388-E442 PolarHBondContact NZ-OE1 3.3Å; K388-L458 HydrophobicContact CD-CD1 4.25Å; K388-L458 HydrophobicContact CG-CD1 4.14Å; K388-L458 HydrophobicContact CG-CD2 4.27Å; K388-Y462 VanDerWaalsContact CE-OH 3.29Å; K388-Y462 WeakPolarHBondContact CE-OH 3.44Å; K388-Y462 PolarHBondContact NZ-OH 3.33Å
389	A	89.7	Confident	89.2	Confident	8 Å²	8	56.6 Å²	56.6	7%	0.066	28%	0.284	C	S	.	.	H	α-helix	trans	-63.5	-41.1	172.3	0	0	0	0	0	112.4	G385 I386 W392 R393 L458	G385-A389 WeakPolarHBondContact O-CB 3.44Å; G385-A389 PolarHBondContact O-N 3.36Å; I386-A389 PolarHBondContact O-N 3.47Å; A389-W392 PolarHBondContact O-N 2.98Å; A389-R393 WeakPolarHBondContact O-CG 3.27Å; A389-R393 PolarHBondContact O-N 2.96Å; A389-L458 HydrophobicContact CB-CD2 4.14Å
390	C	91.4	Very high	89.4	Confident	60 Å²	60	55.4 Å²	55.4	41%	0.405	28%	0.28	S	S	.	.	H	α-helix	trans	-61.4	-48.4	171.9	-75.8	0	0	0	0	112	I386 W387 W392 R393 M394	I386-C390 PolarHBondContact O-N 3.41Å; I386-C390 PolarHBondContact O-SG 3.34Å; I386-C390 VanDerWaalsContact O-SG 3.4Å; W387-C390 WeakPolarHBondContact O-CB 3.15Å; W387-C390 PolarHBondContact O-N 3.28Å; C390-W392 VanDerWaalsContact C-N 3.32Å; C390-W392 PolarHBondContact O-N 2.69Å; C390-R393 PolarHBondContact O-N 3.23Å; C390-M394 WeakPolarHBondContact O-CG 3.44Å; C390-M394 PolarHBondContact O-N 3.25Å
391	C	92.8	Very high	89.7	Confident	4 Å²	4	55.9 Å²	55.9	3%	0.027	27%	0.274	C	S	.	.	H	α-helix	trans	-63.2	-35.5	177.4	-75.1	0	0	0	0	112.8	W387 K388 M394 A395 Y408	W387-C391 HydrophobicContact CH2-CB 4.39Å; W387-C391 WeakPolarHBondContact CZ2-SG 3.36Å; W387-C391 WeakPolarHBondContact O-CB 3.45Å; W387-C391 PolarHBondContact O-N 3.3Å; W387-C391 PolarHBondContact O-SG 3.1Å; W387-C391 VanDerWaalsContact O-SG 3.42Å; K388-C391 PolarHBondContact O-N 3.38Å; C391-M394 PolarHBondContact O-N 3.42Å; C391-A395 WeakPolarHBondContact O-CB 3.5Å; C391-A395 PolarHBondContact O-N 2.76Å; C391-Y408 HydrophobicContact CB-CD1 4.34Å; C391-Y408 VanDerWaalsContact SG-CD1 3.56Å
392	W	92.4	Very high	90.1	Very high	21 Å²	21	60.2 Å²	60.2	8%	0.08	29%	0.288	C	S	.	.	H	α-helix	trans	-61.4	-49.6	173.2	-167.5	-69	0	0	0	111.4	K388 A389 C390 M394 A395 E396 N414 L458 P459 Y462	K388-W392 WeakPolarHBondContact O-CB 3.37Å; K388-W392 PolarHBondContact O-N 3.25Å; A389-W392 PolarHBondContact O-N 2.98Å; C390-W392 VanDerWaalsContact C-N 3.32Å; C390-W392 PolarHBondContact O-N 2.69Å; W392-M394 VanDerWaalsContact C-N 3.32Å; W392-M394 PolarHBondContact O-N 2.8Å; W392-A395 WeakPolarHBondContact O-CB 3.31Å; W392-A395 PolarHBondContact O-N 2.94Å; W392-E396 VanDerWaalsContact CD1-CD 3.48Å; W392-E396 VanDerWaalsContact NE1-CD 3.3Å; W392-E396 PolarHBondContact NE1-OE1 3.3Å; W392-E396 PolarHBondContact O-N 3.09Å; W392-E396 VanDerWaalsContact O-N 3.11Å; W392-N414 HydrophobicContact CD2-CB 3.87Å; W392-N414 VanDerWaalsContact CE2-ND2 3.27Å; W392-N414 HydrophobicContact CE3-CB 3.82Å; W392-N414 HydrophobicContact CH2-CB 3.69Å; W392-N414 HydrophobicContact CZ2-CB 3.74Å; W392-N414 VanDerWaalsContact CZ2-CG 3.44Å; W392-N414 HydrophobicContact CZ3-CB 3.74Å; W392-N414 PolarHBondContact NE1-ND2 2.89Å; W392-L458 HydrophobicContact CB-CD2 4.35Å; W392-L458 HydrophobicContact CE3-CD2 4.32Å; W392-P459 HydrophobicContact CD2-CG 4.22Å; W392-P459 HydrophobicContact CZ2-CB 4.46Å; W392-P459 HydrophobicContact CZ2-CG 3.89Å; W392-Y462 AromaticContact CH2-CD2 3.97Å; W392-Y462 HydrophobicContact CH2-CD2 3.97Å; W392-Y462 AromaticContact CH2-CG 3.97Å; W392-Y462 HydrophobicContact CH2-CG 3.97Å; W392-Y462 HydrophobicContact CZ3-CD1 4.41Å; W392-Y462 AromaticContact CZ3-CD2 3.69Å; W392-Y462 HydrophobicContact CZ3-CD2 3.69Å; W392-Y462 HydrophobicContact CZ3-CE2 4.28Å; W392-Y462 AromaticContact CZ3-CG 3.76Å; W392-Y462 HydrophobicContact CZ3-CG 3.76Å
393	R	91.1	Very high	90.6	Very high	143 Å²	143	57.5 Å²	57.5	54%	0.54	27%	0.268	S	S	.	.	H	α-helix	trans	-62.2	-37.2	177.8	-69.9	167.5	61.3	174.9	-0.8	112.2	A389 C390 E396 E397 E456	A389-R393 WeakPolarHBondContact O-CG 3.27Å; A389-R393 PolarHBondContact O-N 2.96Å; C390-R393 PolarHBondContact O-N 3.23Å; R393-E396 PolarHBondContact O-N 2.89Å; R393-E397 PolarHBondContact O-N 2.78Å; R393-E456 IonicContact CZ-OE2 2.95Å; R393-E456 VanDerWaalsContact NH1-CD 3.28Å; R393-E456 IonicContact NH1-OE1 3.69Å; R393-E456 PolarHBondContact NH1-OE1 3.34Å; R393-E456 IonicContact NH1-OE2 3.43Å; R393-E456 PolarHBondContact NH1-OE2 2.97Å
394	M	91.4	Very high	91.1	Very high	67 Å²	67	53.6 Å²	53.6	33%	0.33	25%	0.25	S	C	.	.	H	α-helix	trans	-66.2	-35	172.3	-70.1	178.8	71.9	0	0	112.5	C390 C391 W392 E396 E397 L400 Y408	C390-M394 WeakPolarHBondContact O-CG 3.44Å; C390-M394 PolarHBondContact O-N 3.25Å; C391-M394 PolarHBondContact O-N 3.42Å; W392-M394 VanDerWaalsContact C-N 3.32Å; W392-M394 PolarHBondContact O-N 2.8Å; M394-E396 VanDerWaalsContact C-N 3.29Å; M394-E396 PolarHBondContact O-N 2.86Å; M394-E397 PolarHBondContact O-N 3Å; M394-L400 HydrophobicContact CB-CD1 4.24Å; M394-L400 HydrophobicContact CE-CD1 4.29Å; M394-Y408 HydrophobicContact CB-CD2 4.26Å; M394-Y408 HydrophobicContact CE-CD2 3.87Å; M394-Y408 HydrophobicContact CE-CE2 3.43Å; M394-Y408 VanDerWaalsContact CE-CE2 3.43Å; M394-Y408 HydrophobicContact SD-CD2 4.46Å; M394-Y408 HydrophobicContact SD-CE2 4.39Å
395	A	93.9	Very high	91.5	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-70.6	-25.7	176.5	0	0	0	0	0	113	C391 W392 R405 A409 P417	C391-A395 WeakPolarHBondContact O-CB 3.5Å; C391-A395 PolarHBondContact O-N 2.76Å; W392-A395 WeakPolarHBondContact O-CB 3.31Å; W392-A395 PolarHBondContact O-N 2.94Å; A395-R405 WeakPolarHBondContact CB-O 3.36Å; A395-R405 PolarHBondContact O-NE 3.15Å; A395-R405 PolarHBondContact O-NH2 3.27Å; A395-R405 VanDerWaalsContact O-NH2 3.12Å; A395-A409 HydrophobicContact CB-CB 3.92Å; A395-P417 HydrophobicContact CB-CG 4.06Å; A395-P417 WeakPolarHBondContact O-CG 3.44Å
396	E	93	Very high	92	Very high	104 Å²	104	55.2 Å²	55.2	49%	0.486	25%	0.254	S	S	.	.	H	α-helix	trans	-81.8	-26	175.8	-69.8	-179	158.7	0	0	113.7	W392 R393 M394 E398 R405	W392-E396 VanDerWaalsContact CD1-CD 3.48Å; W392-E396 VanDerWaalsContact NE1-CD 3.3Å; W392-E396 PolarHBondContact NE1-OE1 3.3Å; W392-E396 PolarHBondContact O-N 3.09Å; W392-E396 VanDerWaalsContact O-N 3.11Å; R393-E396 PolarHBondContact O-N 2.89Å; M394-E396 VanDerWaalsContact C-N 3.29Å; M394-E396 PolarHBondContact O-N 2.86Å; E396-E398 PolarHBondContact O-N 2.86Å; E396-E398 VanDerWaalsContact O-N 3.13Å; E396-R405 PolarHBondContact O-NH2 3.34Å
397	E	92.6	Very high	92.4	Very high	69 Å²	69	51.4 Å²	51.4	32%	0.322	24%	0.235	S	C	.	.			trans	-62	110.1	179.5	178.5	52.4	-98.1	0	0	112.6	L308 R393 M394 Q399 L400 R405	L308-E397 HydrophobicContact CD1-CG 4.04Å; R393-E397 PolarHBondContact O-N 2.78Å; M394-E397 PolarHBondContact O-N 3Å; E397-Q399 VanDerWaalsContact C-N 3.26Å; E397-Q399 HydrophobicContact CG-CB 4.34Å; E397-Q399 PolarHBondContact O-N 2.86Å; E397-Q399 WeakPolarHBondContact OE1-CB 3.39Å; E397-Q399 WeakPolarHBondContact OE1-CG 3.17Å; E397-Q399 PolarHBondContact OE1-N 2.88Å; E397-L400 HydrophobicContact CB-CD1 4.33Å; E397-L400 HydrophobicContact CB-CG 4.28Å; E397-L400 HydrophobicContact CG-CD1 4.41Å; E397-L400 HydrophobicContact CG-CG 3.95Å; E397-L400 PolarHBondContact O-N 3.33Å; E397-R405 VanDerWaalsContact O-CD 3.22Å; E397-R405 WeakPolarHBondContact O-CD 3.45Å; E397-R405 PolarHBondContact O-NE 3.01Å
398	E	88.8	Confident	92.6	Very high	161 Å²	161	49.8 Å²	49.8	75%	0.752	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-20.9	-175.9	-63.5	-165.2	148.7	0	0	114.1	E396 L400	E396-E398 PolarHBondContact O-N 2.86Å; E396-E398 VanDerWaalsContact O-N 3.13Å; E398-L400 VanDerWaalsContact C-N 3.3Å; E398-L400 PolarHBondContact O-N 3.31Å
399	Q	87.3	Confident	92.8	Very high	111 Å²	111	49.7 Å²	49.7	52%	0.519	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-17.6	177.1	-61.7	-165.1	0.7	0	0	113.8	L308 E397	L308-Q399 HydrophobicContact CD1-CB 3.94Å; E397-Q399 VanDerWaalsContact C-N 3.26Å; E397-Q399 HydrophobicContact CG-CB 4.34Å; E397-Q399 PolarHBondContact O-N 2.86Å; E397-Q399 WeakPolarHBondContact OE1-CB 3.39Å; E397-Q399 WeakPolarHBondContact OE1-CG 3.17Å; E397-Q399 PolarHBondContact OE1-N 2.88Å
400	L	90.1	Very high	93	Very high	35 Å²	35	49.4 Å²	49.4	18%	0.183	23%	0.226	C	C	.	.	S	Bend	trans	-79.7	154.4	176.1	-66.4	-175.8	0	0	0	111.8	M394 E397 E398 R402 R405	M394-L400 HydrophobicContact CB-CD1 4.24Å; M394-L400 HydrophobicContact CE-CD1 4.29Å; E397-L400 HydrophobicContact CB-CD1 4.33Å; E397-L400 HydrophobicContact CB-CG 4.28Å; E397-L400 HydrophobicContact CG-CD1 4.41Å; E397-L400 HydrophobicContact CG-CG 3.95Å; E397-L400 PolarHBondContact O-N 3.33Å; E398-L400 VanDerWaalsContact C-N 3.3Å; E398-L400 PolarHBondContact O-N 3.31Å; L400-R402 PolarHBondContact O-N 3.06Å; L400-R405 HydrophobicContact CB-CG 3.85Å; L400-R405 WeakPolarHBondContact O-CD 3.29Å
401	N	92.3	Very high	93	Very high	47 Å²	47	46.8 Å²	46.8	25%	0.251	21%	0.207	S	C	.	.			trans	-61.3	135.8	179.2	-176.6	-37.2	0	0	0	110.6	A323 L326 Y403 E404 R405	A323-N401 WeakPolarHBondContact CA-ND2 3.18Å; A323-N401 WeakPolarHBondContact CB-ND2 3.09Å; L326-N401 HydrophobicContact CD1-CB 3.72Å; N401-Y403 PolarHBondContact O-N 3.26Å; N401-Y403 PolarHBondContact OD1-N 3.11Å; N401-E404 HydrophobicContact CB-CB 4.2Å; N401-E404 WeakPolarHBondContact O-CA 3.46Å; N401-E404 WeakPolarHBondContact O-CB 3.16Å; N401-E404 PolarHBondContact O-N 3.29Å; N401-R405 WeakPolarHBondContact O-CG 3.43Å; N401-R405 PolarHBondContact O-N 3.46Å
402	R	94.8	Very high	92.9	Very high	124 Å²	124	46.6 Å²	46.6	47%	0.468	21%	0.206	S	C	.	.	H	α-helix	trans	-48.7	-37.5	178.5	69.7	178.6	-168.5	161.2	3.4	113.9	L400 A406 V421	L400-R402 PolarHBondContact O-N 3.06Å; R402-A406 VanDerWaalsContact O-CB 3.29Å; R402-A406 WeakPolarHBondContact O-CB 3.33Å; R402-A406 PolarHBondContact O-N 3.43Å; R402-V421 HydrophobicContact CB-CG1 3.96Å; R402-V421 HydrophobicContact CG-CG1 3.75Å
403	Y	95.5	Very high	92.8	Very high	14 Å²	14	45.7 Å²	45.7	6%	0.055	20%	0.203	C	C	.	.	H	α-helix	trans	-75.2	-33.8	177.6	-68.8	-67.7	0	0	0	112.7	K327 F330 N401 A406 I407 V421	K327-Y403 HydrophobicContact CB-CD1 4.46Å; K327-Y403 HydrophobicContact CB-CD2 3.86Å; K327-Y403 HydrophobicContact CB-CE1 4.43Å; K327-Y403 HydrophobicContact CB-CE2 3.81Å; K327-Y403 HydrophobicContact CB-CG 4.2Å; K327-Y403 HydrophobicContact CD-CE1 4.34Å; K327-Y403 HydrophobicContact CD-CE2 3.95Å; K327-Y403 WeakPolarHBondContact CD-OH 3.47Å; K327-Y403 HydrophobicContact CG-CD1 4.41Å; K327-Y403 HydrophobicContact CG-CD2 4.39Å; K327-Y403 HydrophobicContact CG-CE1 3.98Å; K327-Y403 HydrophobicContact CG-CE2 3.93Å; K327-Y403 PolarHBondContact NZ-OH 2.97Å; F330-Y403 HydrophobicContact CB-CD1 4.01Å; F330-Y403 HydrophobicContact CD1-CD1 4.04Å; F330-Y403 HydrophobicContact CD1-CE1 4.29Å; F330-Y403 HydrophobicContact CG-CD1 4.09Å; N401-Y403 PolarHBondContact O-N 3.26Å; N401-Y403 PolarHBondContact OD1-N 3.11Å; Y403-A406 PolarHBondContact O-N 3.45Å; Y403-I407 WeakPolarHBondContact O-CB 3.27Å; Y403-I407 WeakPolarHBondContact O-CD1 3.44Å; Y403-I407 WeakPolarHBondContact O-CG1 3.41Å; Y403-I407 PolarHBondContact O-N 2.64Å; Y403-V421 HydrophobicContact CD1-CB 3.99Å; Y403-V421 HydrophobicContact CD1-CG1 3.8Å; Y403-V421 HydrophobicContact CD1-CG2 4.34Å; Y403-V421 HydrophobicContact CE1-CB 3.75Å; Y403-V421 HydrophobicContact CE1-CG1 3.84Å; Y403-V421 HydrophobicContact CE1-CG2 4.44Å; Y403-V421 HydrophobicContact CG-CG1 4.4Å
404	E	94.4	Very high	92.9	Very high	17 Å²	17	39.2 Å²	39.2	8%	0.079	18%	0.179	C	C	.	.	H	α-helix	trans	-67.3	-42.4	173.4	-170.9	155.5	-135	0	0	111.4	L326 R353 N401 A406 I407 Y408	L326-E404 HydrophobicContact CD1-CB 3.89Å; L326-E404 HydrophobicContact CD2-CB 3.64Å; L326-E404 HydrophobicContact CD2-CG 3.97Å; L326-E404 HydrophobicContact CG-CB 4.37Å; R353-E404 IonicContact CZ-OE1 2.68Å; R353-E404 VanDerWaalsContact CZ-OE1 3.25Å; R353-E404 IonicContact NE-OE1 3.15Å; R353-E404 PolarHBondContact NE-OE1 3.21Å; R353-E404 VanDerWaalsContact NH2-CD 3.34Å; R353-E404 IonicContact NH2-OE1 2.77Å; R353-E404 PolarHBondContact NH2-OE1 3.42Å; R353-E404 IonicContact NH2-OE2 3.72Å; R353-E404 PolarHBondContact NH2-OE2 3.24Å; N401-E404 HydrophobicContact CB-CB 4.2Å; N401-E404 WeakPolarHBondContact O-CA 3.46Å; N401-E404 WeakPolarHBondContact O-CB 3.16Å; N401-E404 PolarHBondContact O-N 3.29Å; E404-A406 VanDerWaalsContact C-N 3.35Å; E404-A406 PolarHBondContact O-N 3.04Å; E404-I407 PolarHBondContact O-N 3.14Å; E404-Y408 HydrophobicContact CG-CD2 3.92Å; E404-Y408 HydrophobicContact CG-CE2 3.53Å; E404-Y408 WeakPolarHBondContact O-CD2 3.29Å; E404-Y408 PolarHBondContact O-N 2.8Å; E404-Y408 VanDerWaalsContact O-N 3.09Å
405	R	95.8	Very high	93	Very high	52 Å²	52	37.4 Å²	37.4	20%	0.196	17%	0.171	C	C	.	.	H	α-helix	trans	-58.7	-46.2	172	-62.8	173	66.5	179.6	7.5	111	A395 E396 E397 L400 N401 Y408 A409 P417	A395-R405 WeakPolarHBondContact CB-O 3.36Å; A395-R405 PolarHBondContact O-NE 3.15Å; A395-R405 PolarHBondContact O-NH2 3.27Å; A395-R405 VanDerWaalsContact O-NH2 3.12Å; E396-R405 PolarHBondContact O-NH2 3.34Å; E397-R405 VanDerWaalsContact O-CD 3.22Å; E397-R405 WeakPolarHBondContact O-CD 3.45Å; E397-R405 PolarHBondContact O-NE 3.01Å; L400-R405 HydrophobicContact CB-CG 3.85Å; L400-R405 WeakPolarHBondContact O-CD 3.29Å; N401-R405 WeakPolarHBondContact O-CG 3.43Å; N401-R405 PolarHBondContact O-N 3.46Å; R405-Y408 PolarHBondContact O-N 3.3Å; R405-A409 WeakPolarHBondContact O-CB 3.37Å; R405-A409 PolarHBondContact O-N 2.99Å; R405-P417 HydrophobicContact CB-CB 4.11Å
406	A	96.4	Very high	93	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-66	-34	177.9	0	0	0	0	0	114	F330 R402 Y403 E404 S410 P417 V421	F330-A406 HydrophobicContact CD2-CB 3.78Å; F330-A406 HydrophobicContact CE2-CB 3.64Å; F330-A406 HydrophobicContact CZ-CB 4.39Å; R402-A406 VanDerWaalsContact O-CB 3.29Å; R402-A406 WeakPolarHBondContact O-CB 3.33Å; R402-A406 PolarHBondContact O-N 3.43Å; Y403-A406 PolarHBondContact O-N 3.45Å; E404-A406 VanDerWaalsContact C-N 3.35Å; E404-A406 PolarHBondContact O-N 3.04Å; A406-S410 WeakPolarHBondContact O-CB 3.46Å; A406-S410 PolarHBondContact O-N 2.93Å; A406-S410 PolarHBondContact O-OG 2.62Å; A406-P417 WeakPolarHBondContact CB-O 3.48Å; A406-V421 HydrophobicContact CB-CB 4.44Å; A406-V421 HydrophobicContact CB-CG1 4.21Å; A406-V421 HydrophobicContact CB-CG2 3.35Å
407	I	95.6	Very high	93	Very high	4 Å²	4	41 Å²	41	2%	0.021	19%	0.186	C	C	.	.	H	α-helix	trans	-63.3	-51.8	173.4	-75.4	163.4	0	0	0	110.7	L326 L329 F330 I333 L357 Y403 E404 A409 S410	L326-I407 HydrophobicContact CD2-CD1 3.98Å; L329-I407 HydrophobicContact CB-CD1 3.72Å; F330-I407 HydrophobicContact CB-CD1 4.21Å; F330-I407 HydrophobicContact CB-CG1 3.91Å; F330-I407 HydrophobicContact CD2-CG1 4.12Å; I333-I407 HydrophobicContact CD1-CG1 4.15Å; I333-I407 HydrophobicContact CD1-CG2 3.83Å; L357-I407 HydrophobicContact CD2-CG2 3.71Å; Y403-I407 WeakPolarHBondContact O-CB 3.27Å; Y403-I407 WeakPolarHBondContact O-CD1 3.44Å; Y403-I407 WeakPolarHBondContact O-CG1 3.41Å; Y403-I407 PolarHBondContact O-N 2.64Å; E404-I407 PolarHBondContact O-N 3.14Å; I407-A409 VanDerWaalsContact C-N 3.27Å; I407-A409 PolarHBondContact O-N 3.17Å; I407-S410 PolarHBondContact O-N 3.3Å; I407-S410 PolarHBondContact O-OG 2.66Å
408	Y	95.1	Very high	93.2	Very high	2 Å²	2	37.7 Å²	37.7	1%	0.008	17%	0.171	C	C	.	.	H	α-helix	trans	-71.3	-25.8	179.6	-66.6	-56	0	0	0	112.6	T356 C391 M394 E404 R405 S412	T356-Y408 PolarHBondContact OG1-OH 2.94Å; C391-Y408 HydrophobicContact CB-CD1 4.34Å; C391-Y408 VanDerWaalsContact SG-CD1 3.56Å; M394-Y408 HydrophobicContact CB-CD2 4.26Å; M394-Y408 HydrophobicContact CE-CD2 3.87Å; M394-Y408 HydrophobicContact CE-CE2 3.43Å; M394-Y408 VanDerWaalsContact CE-CE2 3.43Å; M394-Y408 HydrophobicContact SD-CD2 4.46Å; M394-Y408 HydrophobicContact SD-CE2 4.39Å; E404-Y408 HydrophobicContact CG-CD2 3.92Å; E404-Y408 HydrophobicContact CG-CE2 3.53Å; E404-Y408 WeakPolarHBondContact O-CD2 3.29Å; E404-Y408 PolarHBondContact O-N 2.8Å; E404-Y408 VanDerWaalsContact O-N 3.09Å; R405-Y408 PolarHBondContact O-N 3.3Å; Y408-S412 WeakPolarHBondContact O-CB 3.46Å; Y408-S412 PolarHBondContact O-N 2.67Å; Y408-S412 PolarHBondContact O-OG 3.33Å
409	A	94.9	Very high	93.4	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-69.1	-45.1	172.9	0	0	0	0	0	113.7	A395 R405 I407 L411 S412 G413 N414 P417 I418	A395-A409 HydrophobicContact CB-CB 3.92Å; R405-A409 WeakPolarHBondContact O-CB 3.37Å; R405-A409 PolarHBondContact O-N 2.99Å; I407-A409 VanDerWaalsContact C-N 3.27Å; I407-A409 PolarHBondContact O-N 3.17Å; A409-L411 PolarHBondContact O-N 2.67Å; A409-S412 PolarHBondContact O-N 3.29Å; A409-G413 PolarHBondContact O-N 3.24Å; A409-N414 HydrophobicContact CB-CB 4.15Å; A409-N414 WeakPolarHBondContact CB-O 3.4Å; A409-N414 PolarHBondContact O-N 3.27Å; A409-P417 HydrophobicContact CB-CB 3.97Å; A409-P417 HydrophobicContact CB-CG 4.24Å; A409-I418 HydrophobicContact CB-CD1 4.32Å; A409-I418 HydrophobicContact CB-CG1 3.62Å
410	S	94.4	Very high	93.7	Very high	2 Å²	2	30.3 Å²	30.3	1%	0.014	15%	0.149	C	C	.	.	H	α-helix	trans	-71	-12.9	-178.4	67.1	0	0	0	0	114.4	A406 I407 R434	A406-S410 WeakPolarHBondContact O-CB 3.46Å; A406-S410 PolarHBondContact O-N 2.93Å; A406-S410 PolarHBondContact O-OG 2.62Å; I407-S410 PolarHBondContact O-N 3.3Å; I407-S410 PolarHBondContact O-OG 2.66Å; S410-R434 PolarHBondContact O-NE 3.49Å
411	L	91.1	Very high	93.9	Very high	5 Å²	5	29 Å²	29	3%	0.026	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.7	-3.8	172	-53.5	173.7	0	0	0	113.2	I333 L357 W360 W387 A409	I333-L411 HydrophobicContact CG2-CD2 4.47Å; L357-L411 HydrophobicContact CD2-CD1 3.61Å; W360-L411 HydrophobicContact CB-CB 4.44Å; W360-L411 HydrophobicContact CG-CD2 4.21Å; W387-L411 HydrophobicContact CH2-CB 3.71Å; W387-L411 WeakPolarHBondContact CZ3-O 3.36Å; A409-L411 PolarHBondContact O-N 2.67Å
412	S	90.7	Very high	93.9	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.5	-2.4	178.9	67.9	0	0	0	0	115.4	K388 Y408 A409	K388-S412 WeakPolarHBondContact CE-O 3.43Å; Y408-S412 WeakPolarHBondContact O-CB 3.46Å; Y408-S412 PolarHBondContact O-N 2.67Å; Y408-S412 PolarHBondContact O-OG 3.33Å; A409-S412 PolarHBondContact O-N 3.29Å
413	G	90.3	Very high	93.7	Very high	2 Å²	2	26.5 Å²	26.5	2%	0.021	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.3	7.5	175	0	0	0	0	0	115.3	A409 I415 V435 D438	A409-G413 PolarHBondContact O-N 3.24Å; G413-I415 PolarHBondContact O-N 3.23Å; G413-V435 VanDerWaalsContact O-CG1 3.25Å; G413-V435 WeakPolarHBondContact O-CG1 3.31Å; G413-D438 VanDerWaalsContact CA-OD2 3.26Å; G413-D438 WeakPolarHBondContact CA-OD2 3.35Å
414	N	92.5	Very high	93.6	Very high	7 Å²	7	26.6 Å²	26.6	4%	0.037	14%	0.139	C	C	.	.			trans	-84.3	100.9	-178.9	-168.5	-17.1	0	0	0	111.4	W392 A409 K416 P417 I418	W392-N414 HydrophobicContact CD2-CB 3.87Å; W392-N414 VanDerWaalsContact CE2-ND2 3.27Å; W392-N414 HydrophobicContact CE3-CB 3.82Å; W392-N414 HydrophobicContact CH2-CB 3.69Å; W392-N414 HydrophobicContact CZ2-CB 3.74Å; W392-N414 VanDerWaalsContact CZ2-CG 3.44Å; W392-N414 HydrophobicContact CZ3-CB 3.74Å; W392-N414 PolarHBondContact NE1-ND2 2.89Å; A409-N414 HydrophobicContact CB-CB 4.15Å; A409-N414 WeakPolarHBondContact CB-O 3.4Å; A409-N414 PolarHBondContact O-N 3.27Å; N414-K416 VanDerWaalsContact C-N 3.35Å; N414-K416 PolarHBondContact O-N 2.93Å; N414-K416 PolarHBondContact OD1-N 3.09Å; N414-P417 WeakPolarHBondContact O-CD 3.44Å; N414-P417 VanDerWaalsContact OD1-CD 3.24Å; N414-P417 WeakPolarHBondContact OD1-CD 3.41Å; N414-I418 WeakPolarHBondContact O-CD1 3.42Å; N414-I418 WeakPolarHBondContact O-CG1 3.39Å
415	I	93.4	Very high	93.6	Very high	30 Å²	30	25.9 Å²	25.9	15%	0.154	14%	0.135	C	C	.	.	H	α-helix	trans	-62.1	-34.7	-174.6	-170.3	59.2	0	0	0	114.6	G413 I418 L419 A431 Y432 V435	G413-I415 PolarHBondContact O-N 3.23Å; I415-I418 PolarHBondContact O-N 3.42Å; I415-L419 HydrophobicContact CD1-CD1 4.24Å; I415-L419 HydrophobicContact CD1-CD2 4.3Å; I415-L419 HydrophobicContact CD1-CG 4.01Å; I415-L419 HydrophobicContact CG1-CD1 3.75Å; I415-L419 HydrophobicContact CG1-CG 3.99Å; I415-L419 PolarHBondContact O-N 3.16Å; I415-L419 VanDerWaalsContact O-N 3.14Å; I415-A431 HydrophobicContact CD1-CB 3.87Å; I415-Y432 HydrophobicContact CD1-CD1 3.69Å; I415-Y432 HydrophobicContact CD1-CE1 4.03Å; I415-Y432 HydrophobicContact CD1-CG 4.17Å; I415-Y432 HydrophobicContact CG1-CD1 3.82Å; I415-Y432 HydrophobicContact CG1-CE1 3.71Å; I415-V435 HydrophobicContact CB-CG1 4.36Å; I415-V435 HydrophobicContact CB-CG2 4.17Å; I415-V435 HydrophobicContact CD1-CB 4.42Å; I415-V435 HydrophobicContact CD1-CG2 3.99Å
416	K	93.3	Very high	93.6	Very high	167 Å²	167	24.2 Å²	24.2	73%	0.726	13%	0.13	S	C	*	.	H	α-helix	trans	-66.4	-45.9	-166.3	-58	176.1	-173.1	171.2	0	113.7	N414 I418 L419 A420	N414-K416 VanDerWaalsContact C-N 3.35Å; N414-K416 PolarHBondContact O-N 2.93Å; N414-K416 PolarHBondContact OD1-N 3.09Å; K416-I418 VanDerWaalsContact C-N 3.28Å; K416-I418 PolarHBondContact O-N 2.86Å; K416-L419 PolarHBondContact O-N 3.39Å; K416-A420 PolarHBondContact O-N 3.39Å
417	P	94.8	Very high	93.5	Very high	12 Å²	12	25.7 Å²	25.7	8%	0.078	14%	0.138	C	C	.	.	H	α-helix	trans	-71.8	-20.7	178.7	-20.5	36.4	0	0	0	113.5	A395 R405 A406 A409 N414	A395-P417 HydrophobicContact CB-CG 4.06Å; A395-P417 WeakPolarHBondContact O-CG 3.44Å; R405-P417 HydrophobicContact CB-CB 4.11Å; A406-P417 WeakPolarHBondContact CB-O 3.48Å; A409-P417 HydrophobicContact CB-CB 3.97Å; A409-P417 HydrophobicContact CB-CG 4.24Å; N414-P417 WeakPolarHBondContact O-CD 3.44Å; N414-P417 VanDerWaalsContact OD1-CD 3.24Å; N414-P417 WeakPolarHBondContact OD1-CD 3.41Å
418	I	95.1	Very high	93.5	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-71.9	-51.6	174.1	-46.4	169.4	0	0	0	109.4	F330 A409 N414 I415 K416 A420 V421 C422 W430 A431 V435	F330-I418 HydrophobicContact CE2-CG2 4.39Å; F330-I418 HydrophobicContact CZ-CG2 4.26Å; A409-I418 HydrophobicContact CB-CD1 4.32Å; A409-I418 HydrophobicContact CB-CG1 3.62Å; N414-I418 WeakPolarHBondContact O-CD1 3.42Å; N414-I418 WeakPolarHBondContact O-CG1 3.39Å; I415-I418 PolarHBondContact O-N 3.42Å; K416-I418 VanDerWaalsContact C-N 3.28Å; K416-I418 PolarHBondContact O-N 2.86Å; I418-A420 PolarHBondContact O-N 3.43Å; I418-A420 VanDerWaalsContact O-N 3.12Å; I418-V421 WeakPolarHBondContact O-CG2 3.28Å; I418-V421 PolarHBondContact O-N 2.99Å; I418-C422 PolarHBondContact O-N 2.88Å; I418-C422 PolarHBondContact O-SG 3.31Å; I418-W430 HydrophobicContact CG2-CE3 4.47Å; I418-W430 HydrophobicContact CG2-CZ3 3.84Å; I418-A431 HydrophobicContact CB-CB 4.18Å; I418-A431 HydrophobicContact CG2-CB 3.56Å; I418-V435 HydrophobicContact CD1-CG2 3.82Å
419	L	94.3	Very high	93.6	Very high	52 Å²	52	25.7 Å²	25.7	27%	0.272	14%	0.139	S	C	.	.	H	α-helix	trans	-59	-27.5	178.6	-66.1	177.5	0	0	0	112.9	I415 K416 V421 C422 C428 A431 Y432	I415-L419 HydrophobicContact CD1-CD1 4.24Å; I415-L419 HydrophobicContact CD1-CD2 4.3Å; I415-L419 HydrophobicContact CD1-CG 4.01Å; I415-L419 HydrophobicContact CG1-CD1 3.75Å; I415-L419 HydrophobicContact CG1-CG 3.99Å; I415-L419 PolarHBondContact O-N 3.16Å; I415-L419 VanDerWaalsContact O-N 3.14Å; K416-L419 PolarHBondContact O-N 3.39Å; L419-V421 PolarHBondContact O-N 3.28Å; L419-C422 PolarHBondContact O-N 3.31Å; L419-C428 HydrophobicContact CD2-CB 4.3Å; L419-A431 HydrophobicContact CD2-CB 4.09Å; L419-Y432 HydrophobicContact CD1-CE1 4.22Å; L419-Y432 HydrophobicContact CD1-CE2 4.44Å; L419-Y432 HydrophobicContact CD2-CE2 4.2Å
420	A	93.4	Very high	93.7	Very high	65 Å²	65	25.8 Å²	25.8	54%	0.537	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-5.1	174.1	0	0	0	0	0	115	K416 I418	K416-A420 PolarHBondContact O-N 3.39Å; I418-A420 PolarHBondContact O-N 3.43Å; I418-A420 VanDerWaalsContact O-N 3.12Å
421	V	93.8	Very high	93.8	Very high	7 Å²	7	25.7 Å²	25.7	4%	0.042	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-129.2	-3	173.7	-59.5	0	0	0	0	114.8	F330 R402 Y403 A406 I418 L419	F330-V421 HydrophobicContact CD1-CG2 4.16Å; F330-V421 HydrophobicContact CD2-CG2 4.41Å; F330-V421 HydrophobicContact CE1-CG2 3.59Å; F330-V421 HydrophobicContact CE2-CG2 3.89Å; F330-V421 HydrophobicContact CZ-CG2 3.44Å; F330-V421 VanDerWaalsContact CZ-CG2 3.44Å; R402-V421 HydrophobicContact CB-CG1 3.96Å; R402-V421 HydrophobicContact CG-CG1 3.75Å; Y403-V421 HydrophobicContact CD1-CB 3.99Å; Y403-V421 HydrophobicContact CD1-CG1 3.8Å; Y403-V421 HydrophobicContact CD1-CG2 4.34Å; Y403-V421 HydrophobicContact CE1-CB 3.75Å; Y403-V421 HydrophobicContact CE1-CG1 3.84Å; Y403-V421 HydrophobicContact CE1-CG2 4.44Å; Y403-V421 HydrophobicContact CG-CG1 4.4Å; A406-V421 HydrophobicContact CB-CB 4.44Å; A406-V421 HydrophobicContact CB-CG1 4.21Å; A406-V421 HydrophobicContact CB-CG2 3.35Å; I418-V421 WeakPolarHBondContact O-CG2 3.28Å; I418-V421 PolarHBondContact O-N 2.99Å; L419-V421 PolarHBondContact O-N 3.28Å
422	C	93.2	Very high	94.1	Very high	20 Å²	20	26.5 Å²	26.5	14%	0.135	14%	0.141	C	C	.	.			trans	-68.9	131.7	171.8	-65	0	0	0	0	110.5	I418 L419 D427	I418-C422 PolarHBondContact O-N 2.88Å; I418-C422 PolarHBondContact O-SG 3.31Å; L419-C422 PolarHBondContact O-N 3.31Å; C422-D427 HydrophobicContact CB-CB 3.63Å; C422-D427 PolarHBondContact SG-O 2.81Å; C422-D427 VanDerWaalsContact SG-O 3.41Å
423	E	90	Very high	94.3	Very high	98 Å²	98	26.5 Å²	26.5	46%	0.458	14%	0.141	S	C	.	.			trans	-114.1	-13.4	-176.8	-69.2	179.1	-158.6	0	0	113.9	K327 D427 R483	K327-E423 IonicContact NZ-OE1 3.83Å; E423-D427 PolarHBondContact N-OD2 3.01Å; E423-D427 VanDerWaalsContact N-OD2 3.13Å; E423-R483 VanDerWaalsContact O-CZ 3.3Å; E423-R483 PolarHBondContact O-NH1 3.09Å
424	S	92.9	Very high	94.6	Very high	16 Å²	16	27.7 Å²	27.7	11%	0.112	15%	0.145	C	C	.	.	S	Bend	trans	-134.3	174.1	176.2	77.7	0	0	0	0	114.1	E426 D427 C428 E487	S424-E426 VanDerWaalsContact CB-OE2 3.24Å; S424-E426 WeakPolarHBondContact CB-OE2 3.34Å; S424-E426 PolarHBondContact OG-N 2.84Å; S424-E426 PolarHBondContact OG-OE2 3.39Å; S424-D427 PolarHBondContact O-N 3.45Å; S424-C428 PolarHBondContact O-N 3.41Å; S424-C428 PolarHBondContact O-SG 3.2Å; S424-E487 WeakPolarHBondContact CA-OE2 3.38Å
425	W	95.1	Very high	94.7	Very high	2 Å²	2	27.6 Å²	27.6	1%	0.008	15%	0.145	C	C	.	.	H	α-helix	trans	-55	-48	171.4	-177.1	88.4	0	0	0	112.8	W252 D427 C428 V429 F473 E487 T488 H493 Q496	W252-W425 HydrophobicContact CH2-CZ3 4.38Å; W425-D427 VanDerWaalsContact C-N 3.25Å; W425-D427 PolarHBondContact O-N 2.97Å; W425-C428 PolarHBondContact O-N 2.91Å; W425-C428 VanDerWaalsContact O-N 3.11Å; W425-V429 HydrophobicContact CD2-CG2 3.68Å; W425-V429 HydrophobicContact CE3-CG2 3.95Å; W425-V429 HydrophobicContact CG-CG2 4.28Å; W425-V429 HydrophobicContact CH2-CG2 3.97Å; W425-V429 HydrophobicContact CZ2-CG2 3.7Å; W425-V429 HydrophobicContact CZ3-CG2 4.08Å; W425-V429 VanDerWaalsContact O-CG2 3.29Å; W425-V429 WeakPolarHBondContact O-CG2 3.34Å; W425-V429 PolarHBondContact O-N 3.12Å; W425-F473 AromaticContact CZ2-CE1 4Å; W425-F473 HydrophobicContact CZ2-CE1 4Å; W425-E487 HydrophobicContact CB-CB 3.82Å; W425-E487 PolarHBondContact N-OE2 2.74Å; W425-T488 VanDerWaalsContact CD1-OG1 3.24Å; W425-H493 HydrophobicContact CD2-CB 4.17Å; W425-H493 AromaticContact CD2-CG 3.88Å; W425-H493 AromaticContact CD2-ND1 3.96Å; W425-H493 HydrophobicContact CE3-CB 4.33Å; W425-H493 AromaticContact CE3-CD2 3.65Å; W425-H493 AromaticContact CE3-CG 3.78Å; W425-H493 AromaticContact CE3-NE2 3.91Å; W425-H493 HydrophobicContact CH2-CB 4.09Å; W425-H493 HydrophobicContact CZ2-CB 3.89Å; W425-H493 HydrophobicContact CZ3-CB 4.31Å; W425-H493 AromaticContact CZ3-CD2 3.72Å; W425-Q496 HydrophobicContact CH2-CB 4.11Å
426	E	95.1	Very high	94.7	Very high	17 Å²	17	26.1 Å²	26.1	8%	0.079	14%	0.137	C	C	.	.	H	α-helix	trans	-59.3	-36.8	179.9	-56.4	92.2	152.9	0	0	112.1	Q194 L253 R334 S424 W430	Q194-E426 PolarHBondContact NE2-OE1 2.99Å; L253-E426 HydrophobicContact CD2-CB 3.9Å; L253-E426 HydrophobicContact CD2-CG 4.36Å; R334-E426 PolarHBondContact NH2-O 3.09Å; S424-E426 VanDerWaalsContact CB-OE2 3.24Å; S424-E426 WeakPolarHBondContact CB-OE2 3.34Å; S424-E426 PolarHBondContact OG-N 2.84Å; S424-E426 PolarHBondContact OG-OE2 3.39Å; E426-W430 VanDerWaalsContact O-CB 3.3Å; E426-W430 WeakPolarHBondContact O-CB 3.22Å; E426-W430 PolarHBondContact O-N 3.12Å
427	D	94.4	Very high	94.7	Very high	31 Å²	31	18.5 Å²	18.5	17%	0.166	11%	0.105	C	C	.	.	H	α-helix	trans	-67.6	-41.5	175.8	-72.7	-16.3	0	0	0	112.7	R334 C422 E423 S424 W425 A431	R334-D427 IonicContact CZ-OD1 2.67Å; R334-D427 VanDerWaalsContact CZ-OD1 3.32Å; R334-D427 IonicContact NE-OD1 3.6Å; R334-D427 PolarHBondContact NE-OD1 3.14Å; R334-D427 IonicContact NH2-OD1 2.67Å; R334-D427 PolarHBondContact NH2-OD1 3.39Å; C422-D427 HydrophobicContact CB-CB 3.63Å; C422-D427 PolarHBondContact SG-O 2.81Å; C422-D427 VanDerWaalsContact SG-O 3.41Å; E423-D427 PolarHBondContact N-OD2 3.01Å; E423-D427 VanDerWaalsContact N-OD2 3.13Å; S424-D427 PolarHBondContact O-N 3.45Å; W425-D427 VanDerWaalsContact C-N 3.25Å; W425-D427 PolarHBondContact O-N 2.97Å; D427-A431 WeakPolarHBondContact O-CB 3.22Å; D427-A431 PolarHBondContact O-N 3.07Å
428	C	95.9	Very high	94.6	Very high	7 Å²	7	19 Å²	19	5%	0.047	11%	0.107	C	C	.	.	H	α-helix	trans	-69.7	-42.4	178.4	-65.8	0	0	0	0	111.4	L419 S424 W425 A431 Y432 L476 V484	L419-C428 HydrophobicContact CD2-CB 4.3Å; S424-C428 PolarHBondContact O-N 3.41Å; S424-C428 PolarHBondContact O-SG 3.2Å; W425-C428 PolarHBondContact O-N 2.91Å; W425-C428 VanDerWaalsContact O-N 3.11Å; C428-A431 PolarHBondContact O-N 2.7Å; C428-Y432 WeakPolarHBondContact O-CD2 3.46Å; C428-Y432 PolarHBondContact O-N 3.38Å; C428-L476 HydrophobicContact CB-CD2 3.44Å; C428-L476 VanDerWaalsContact CB-CD2 3.44Å; C428-V484 HydrophobicContact CB-CG1 4.45Å
429	V	96.6	Very high	94.4	Very high	0 Å²	0	19 Å²	19	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-60.1	-46.7	173.8	-178.6	0	0	0	0	109.9	V249 L253 W425 A431 Y432 F433 F473 L476	V249-V429 HydrophobicContact CG1-CG1 4.42Å; L253-V429 HydrophobicContact CD1-CB 3.99Å; L253-V429 HydrophobicContact CD1-CG1 3.59Å; W425-V429 HydrophobicContact CD2-CG2 3.68Å; W425-V429 HydrophobicContact CE3-CG2 3.95Å; W425-V429 HydrophobicContact CG-CG2 4.28Å; W425-V429 HydrophobicContact CH2-CG2 3.97Å; W425-V429 HydrophobicContact CZ2-CG2 3.7Å; W425-V429 HydrophobicContact CZ3-CG2 4.08Å; W425-V429 VanDerWaalsContact O-CG2 3.29Å; W425-V429 WeakPolarHBondContact O-CG2 3.34Å; W425-V429 PolarHBondContact O-N 3.12Å; V429-A431 VanDerWaalsContact C-N 3.35Å; V429-A431 PolarHBondContact O-N 3.14Å; V429-Y432 PolarHBondContact O-N 2.66Å; V429-F433 HydrophobicContact CG1-CD2 3.61Å; V429-F433 HydrophobicContact CG1-CE2 3.92Å; V429-F433 WeakPolarHBondContact O-CB 3.4Å; V429-F433 WeakPolarHBondContact O-CD2 3.34Å; V429-F433 PolarHBondContact O-N 2.96Å; V429-F473 HydrophobicContact CG2-CE1 4.43Å; V429-L476 HydrophobicContact CB-CD1 4.44Å; V429-L476 HydrophobicContact CG2-CD1 3.59Å; V429-L476 HydrophobicContact CG2-CD2 4.45Å
430	W	97.4	Very high	94.2	Very high	1 Å²	1	18.3 Å²	18.3	0%	0.004	10%	0.103	C	C	.	.	H	α-helix	trans	-59.7	-45.2	177.5	172.3	87.7	0	0	0	111.3	L253 E254 F330 R334 I418 E426 Y432 F433 R434	L253-W430 HydrophobicContact CB-CB 4.07Å; L253-W430 HydrophobicContact CD1-CB 3.98Å; E254-W430 PolarHBondContact OE1-NE1 2.82Å; F330-W430 HydrophobicContact CE2-CZ3 4.37Å; F330-W430 HydrophobicContact CZ-CZ3 4.14Å; R334-W430 HydrophobicContact CB-CH2 4.38Å; I418-W430 HydrophobicContact CG2-CE3 4.47Å; I418-W430 HydrophobicContact CG2-CZ3 3.84Å; E426-W430 VanDerWaalsContact O-CB 3.3Å; E426-W430 WeakPolarHBondContact O-CB 3.22Å; E426-W430 PolarHBondContact O-N 3.12Å; W430-Y432 PolarHBondContact O-N 3.46Å; W430-F433 PolarHBondContact O-N 3.48Å; W430-R434 HydrophobicContact CZ2-CG 4.44Å; W430-R434 WeakPolarHBondContact O-CB 3.43Å; W430-R434 PolarHBondContact O-N 2.86Å
431	A	96.6	Very high	94	Very high	0 Å²	0	16 Å²	16	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-59.3	-46.9	179.2	0	0	0	0	0	112.1	I415 I418 L419 D427 C428 V429 V435	I415-A431 HydrophobicContact CD1-CB 3.87Å; I418-A431 HydrophobicContact CB-CB 4.18Å; I418-A431 HydrophobicContact CG2-CB 3.56Å; L419-A431 HydrophobicContact CD2-CB 4.09Å; D427-A431 WeakPolarHBondContact O-CB 3.22Å; D427-A431 PolarHBondContact O-N 3.07Å; C428-A431 PolarHBondContact O-N 2.7Å; V429-A431 VanDerWaalsContact C-N 3.35Å; V429-A431 PolarHBondContact O-N 3.14Å; A431-V435 WeakPolarHBondContact O-CB 3.18Å; A431-V435 VanDerWaalsContact O-CG2 3.31Å; A431-V435 WeakPolarHBondContact O-CG2 3.44Å; A431-V435 PolarHBondContact O-N 3.45Å; A431-V435 VanDerWaalsContact O-N 3.12Å
432	Y	96.5	Very high	93.7	Very high	22 Å²	22	16.3 Å²	16.3	9%	0.086	8%	0.083	C	C	.	.	H	α-helix	trans	-68.1	-47.8	178.3	-76.2	-62.2	0	0	0	112.9	I415 L419 C428 V429 W430 R434 V435 M436 W467 V472 E475 L476	I415-Y432 HydrophobicContact CD1-CD1 3.69Å; I415-Y432 HydrophobicContact CD1-CE1 4.03Å; I415-Y432 HydrophobicContact CD1-CG 4.17Å; I415-Y432 HydrophobicContact CG1-CD1 3.82Å; I415-Y432 HydrophobicContact CG1-CE1 3.71Å; L419-Y432 HydrophobicContact CD1-CE1 4.22Å; L419-Y432 HydrophobicContact CD1-CE2 4.44Å; L419-Y432 HydrophobicContact CD2-CE2 4.2Å; C428-Y432 WeakPolarHBondContact O-CD2 3.46Å; C428-Y432 PolarHBondContact O-N 3.38Å; V429-Y432 PolarHBondContact O-N 2.66Å; W430-Y432 PolarHBondContact O-N 3.46Å; Y432-R434 VanDerWaalsContact C-N 3.34Å; Y432-R434 PolarHBondContact O-N 3.19Å; Y432-V435 PolarHBondContact O-N 2.84Å; Y432-M436 WeakPolarHBondContact O-CB 3.45Å; Y432-M436 PolarHBondContact O-N 3.29Å; Y432-W467 AromaticContact CD1-CH2 3.93Å; Y432-W467 HydrophobicContact CD1-CH2 3.93Å; Y432-W467 HydrophobicContact CD1-CZ3 4.24Å; Y432-W467 HydrophobicContact CE1-CH2 4.12Å; Y432-V472 VanDerWaalsContact CB-CG1 3.44Å; Y432-V472 HydrophobicContact CD2-CG1 4.35Å; Y432-V472 HydrophobicContact CG-CG1 4.12Å; Y432-E475 HydrophobicContact CE1-CB 3.98Å; Y432-E475 HydrophobicContact CE2-CB 4.33Å; Y432-L476 HydrophobicContact CD2-CD1 4.46Å; Y432-L476 HydrophobicContact CD2-CD2 3.91Å; Y432-L476 HydrophobicContact CD2-CG 3.85Å; Y432-L476 HydrophobicContact CE2-CD2 3.85Å; Y432-L476 HydrophobicContact CE2-CG 3.89Å
433	F	96.8	Very high	93.4	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-64.7	-37.3	178.6	-89	-91.1	0	0	0	112.2	V249 V250 V429 W430 M436 V437 M469 V472 F473 I500	V249-F433 HydrophobicContact CB-CD1 4.04Å; V249-F433 HydrophobicContact CB-CE1 4.26Å; V249-F433 HydrophobicContact CB-CG 4.38Å; V249-F433 HydrophobicContact CG1-CB 4.44Å; V249-F433 HydrophobicContact CG1-CD1 3.96Å; V249-F433 HydrophobicContact CG1-CD2 3.97Å; V249-F433 HydrophobicContact CG1-CE1 4.2Å; V249-F433 HydrophobicContact CG1-CE2 4.22Å; V249-F433 HydrophobicContact CG1-CG 3.85Å; V249-F433 HydrophobicContact CG1-CZ 4.34Å; V249-F433 HydrophobicContact CG2-CE1 4.38Å; V250-F433 HydrophobicContact CG2-CB 3.82Å; V429-F433 HydrophobicContact CG1-CD2 3.61Å; V429-F433 HydrophobicContact CG1-CE2 3.92Å; V429-F433 WeakPolarHBondContact O-CB 3.4Å; V429-F433 WeakPolarHBondContact O-CD2 3.34Å; V429-F433 PolarHBondContact O-N 2.96Å; W430-F433 PolarHBondContact O-N 3.48Å; F433-M436 PolarHBondContact O-N 3.46Å; F433-V437 WeakPolarHBondContact O-CG2 3.09Å; F433-V437 PolarHBondContact O-N 3.37Å; F433-M469 HydrophobicContact CE1-CG 4.06Å; F433-M469 HydrophobicContact CE1-SD 4.24Å; F433-M469 HydrophobicContact CZ-CB 4.25Å; F433-M469 HydrophobicContact CZ-CG 4.25Å; F433-V472 HydrophobicContact CD2-CG1 3.69Å; F433-V472 HydrophobicContact CE2-CB 4.08Å; F433-V472 HydrophobicContact CE2-CG1 3.52Å; F433-V472 HydrophobicContact CE2-CG2 4.5Å; F433-V472 HydrophobicContact CZ-CG1 4.45Å; F433-F473 HydrophobicContact CE2-CE2 4.16Å; F433-F473 HydrophobicContact CE2-CZ 4.07Å; F433-F473 HydrophobicContact CZ-CE2 4.21Å; F433-F473 HydrophobicContact CZ-CZ 4.46Å; F433-I500 HydrophobicContact CE1-CG2 4.21Å; F433-I500 HydrophobicContact CZ-CG2 3.66Å
434	R	95.2	Very high	93.2	Very high	28 Å²	28	14.2 Å²	14.2	11%	0.106	7%	0.071	C	C	.	.	H	α-helix	trans	-60.9	-45.6	174.2	-179	66.5	-172.6	170.1	8	111.6	S410 W430 Y432 D438	S410-R434 PolarHBondContact O-NE 3.49Å; W430-R434 HydrophobicContact CZ2-CG 4.44Å; W430-R434 WeakPolarHBondContact O-CB 3.43Å; W430-R434 PolarHBondContact O-N 2.86Å; Y432-R434 VanDerWaalsContact C-N 3.34Å; Y432-R434 PolarHBondContact O-N 3.19Å; R434-D438 WeakPolarHBondContact O-CB 3.48Å; R434-D438 PolarHBondContact O-N 3.37Å; R434-D438 VanDerWaalsContact O-N 3.1Å
435	V	94.2	Very high	92.8	Very high	4 Å²	4	13.5 Å²	13.5	2%	0.024	7%	0.066	C	C	.	.	H	α-helix	trans	-69.9	-35.2	177	169.3	0	0	0	0	112.1	G413 I415 I418 A431 Y432 S439	G413-V435 VanDerWaalsContact O-CG1 3.25Å; G413-V435 WeakPolarHBondContact O-CG1 3.31Å; I415-V435 HydrophobicContact CB-CG1 4.36Å; I415-V435 HydrophobicContact CB-CG2 4.17Å; I415-V435 HydrophobicContact CD1-CB 4.42Å; I415-V435 HydrophobicContact CD1-CG2 3.99Å; I418-V435 HydrophobicContact CD1-CG2 3.82Å; A431-V435 WeakPolarHBondContact O-CB 3.18Å; A431-V435 VanDerWaalsContact O-CG2 3.31Å; A431-V435 WeakPolarHBondContact O-CG2 3.44Å; A431-V435 PolarHBondContact O-N 3.45Å; A431-V435 VanDerWaalsContact O-N 3.12Å; Y432-V435 PolarHBondContact O-N 2.84Å; V435-S439 WeakPolarHBondContact O-CB 3.44Å; V435-S439 PolarHBondContact O-N 3.25Å
436	M	94.3	Very high	92.2	Very high	0 Å²	0	17 Å²	17	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-62.8	-52.4	175.2	170.7	171	174.1	0	0	111.5	I242 S246 Y432 F433 D438 S439 L440 W467 M469 V472	I242-M436 HydrophobicContact CG2-CE 3.86Å; S246-M436 WeakPolarHBondContact OG-CE 3.34Å; Y432-M436 WeakPolarHBondContact O-CB 3.45Å; Y432-M436 PolarHBondContact O-N 3.29Å; F433-M436 PolarHBondContact O-N 3.46Å; M436-D438 PolarHBondContact O-N 2.78Å; M436-S439 PolarHBondContact O-N 3.4Å; M436-L440 HydrophobicContact CE-CD1 3.88Å; M436-L440 HydrophobicContact CG-CD1 3.83Å; M436-L440 WeakPolarHBondContact O-CB 3.42Å; M436-L440 VanDerWaalsContact O-CG 3.26Å; M436-L440 WeakPolarHBondContact O-CG 3.17Å; M436-L440 PolarHBondContact O-N 2.9Å; M436-W467 HydrophobicContact CB-CB 4.08Å; M436-W467 HydrophobicContact CB-CG 4.16Å; M436-W467 HydrophobicContact CG-CB 3.68Å; M436-W467 HydrophobicContact CG-CG 4.31Å; M436-W467 HydrophobicContact SD-CB 4.09Å; M436-M469 HydrophobicContact CE-CG 4.14Å; M436-V472 HydrophobicContact SD-CG2 4.01Å
437	V	93.5	Very high	91.5	Very high	7 Å²	7	20.6 Å²	20.6	4%	0.042	11%	0.111	C	C	.	.	H	α-helix	trans	-60.3	-46.6	177.5	174.4	0	0	0	0	110.7	F237 Q247 F433 S439 L440 V441	F237-V437 HydrophobicContact CZ-CG1 4.02Å; Q247-V437 HydrophobicContact CB-CG2 4.39Å; F433-V437 WeakPolarHBondContact O-CG2 3.09Å; F433-V437 PolarHBondContact O-N 3.37Å; V437-S439 PolarHBondContact O-N 3.13Å; V437-L440 PolarHBondContact O-N 3.06Å; V437-V441 HydrophobicContact CG1-CG2 4.32Å; V437-V441 WeakPolarHBondContact O-CB 3.38Å; V437-V441 WeakPolarHBondContact O-CG2 3.34Å; V437-V441 PolarHBondContact O-N 3.4Å
438	D	92.1	Very high	90.7	Very high	22 Å²	22	21.9 Å²	21.9	12%	0.118	12%	0.122	C	C	.	.	H	α-helix	trans	-59.2	-43.1	178.3	176.5	88.7	0	0	0	112.6	K388 G413 R434 M436 E442 Y462	K388-D438 IonicContact NZ-OD1 3.06Å; K388-D438 PolarHBondContact NZ-OD1 2.95Å; K388-D438 IonicContact NZ-OD2 3.9Å; K388-D438 PolarHBondContact NZ-OD2 2.98Å; G413-D438 VanDerWaalsContact CA-OD2 3.26Å; G413-D438 WeakPolarHBondContact CA-OD2 3.35Å; R434-D438 WeakPolarHBondContact O-CB 3.48Å; R434-D438 PolarHBondContact O-N 3.37Å; R434-D438 VanDerWaalsContact O-N 3.1Å; M436-D438 PolarHBondContact O-N 2.78Å; D438-E442 WeakPolarHBondContact O-CG 3.49Å; D438-E442 PolarHBondContact O-N 3.41Å; D438-E442 VanDerWaalsContact O-N 3.11Å; D438-Y462 PolarHBondContact O-OH 3.29Å; D438-Y462 PolarHBondContact OD2-OH 2.87Å
439	S	90.9	Very high	89.4	Confident	1 Å²	1	24.4 Å²	24.4	1%	0.007	15%	0.149	C	C	.	.	H	α-helix	trans	-67.7	-38.4	176.3	-177.9	0	0	0	0	112.9	V435 M436 V437 K443 Y462	V435-S439 WeakPolarHBondContact O-CB 3.44Å; V435-S439 PolarHBondContact O-N 3.25Å; M436-S439 PolarHBondContact O-N 3.4Å; V437-S439 PolarHBondContact O-N 3.13Å; S439-K443 WeakPolarHBondContact O-CB 3.44Å; S439-K443 VanDerWaalsContact O-CG 3.28Å; S439-K443 WeakPolarHBondContact O-CG 3.43Å; S439-K443 PolarHBondContact O-N 3.29Å; S439-K443 VanDerWaalsContact O-N 3.1Å; S439-Y462 PolarHBondContact OG-O 3.45Å
440	L	90.4	Very high	88	Confident	37 Å²	37	26.3 Å²	26.3	19%	0.194	16%	0.159	C	C	.	.	H	α-helix	trans	-70	-38.3	177.1	-68.5	169.1	0	0	0	111.8	V243 M436 V437 K443 D444	V243-L440 HydrophobicContact CG2-CB 3.94Å; V243-L440 HydrophobicContact CG2-CD1 3.92Å; V243-L440 HydrophobicContact CG2-CG 4.48Å; M436-L440 HydrophobicContact CE-CD1 3.88Å; M436-L440 HydrophobicContact CG-CD1 3.83Å; M436-L440 WeakPolarHBondContact O-CB 3.42Å; M436-L440 VanDerWaalsContact O-CG 3.26Å; M436-L440 WeakPolarHBondContact O-CG 3.17Å; M436-L440 PolarHBondContact O-N 2.9Å; V437-L440 PolarHBondContact O-N 3.06Å; L440-K443 WeakPolarHBondContact O-CB 3.37Å; L440-K443 PolarHBondContact O-N 3.43Å; L440-D444 PolarHBondContact O-N 3.13Å; L440-D444 VanDerWaalsContact O-N 3.1Å
441	V	89.6	Confident	86.2	Confident	16 Å²	16	28.3 Å²	28.3	10%	0.097	17%	0.171	C	C	.	.	H	α-helix	trans	-62.6	-48.6	174.5	162.2	0	0	0	0	111.7	V233 L236 F237 V437 K443 D444 L445	V233-V441 HydrophobicContact CG1-CG1 4.41Å; V233-V441 HydrophobicContact CG1-CG2 4.18Å; V233-V441 HydrophobicContact CG2-CG1 3.71Å; L236-V441 HydrophobicContact CD2-CG2 4.14Å; F237-V441 HydrophobicContact CE2-CG2 4.46Å; V437-V441 HydrophobicContact CG1-CG2 4.32Å; V437-V441 WeakPolarHBondContact O-CB 3.38Å; V437-V441 WeakPolarHBondContact O-CG2 3.34Å; V437-V441 PolarHBondContact O-N 3.4Å; V441-K443 VanDerWaalsContact C-N 3.27Å; V441-K443 PolarHBondContact O-N 3.41Å; V441-D444 PolarHBondContact O-N 2.91Å; V441-L445 HydrophobicContact CG1-CD1 3.9Å; V441-L445 WeakPolarHBondContact O-CG 3.34Å; V441-L445 PolarHBondContact O-N 3.49Å
442	E	87.3	Confident	84.3	Confident	14 Å²	14	35.7 Å²	35.7	7%	0.065	21%	0.205	C	C	.	.	H	α-helix	trans	-65	-32.5	176.7	-63.3	-60.7	171.9	0	0	112.1	R384 K388 D438 L445 M446 Y462	R384-E442 IonicContact CZ-OE1 3.79Å; R384-E442 IonicContact CZ-OE2 3.02Å; R384-E442 IonicContact NE-OE1 2.76Å; R384-E442 PolarHBondContact NE-OE1 2.94Å; R384-E442 IonicContact NE-OE2 3.69Å; R384-E442 IonicContact NH2-OE1 2.68Å; R384-E442 PolarHBondContact NH2-OE1 3.34Å; R384-E442 IonicContact NH2-OE2 2.74Å; R384-E442 PolarHBondContact NH2-OE2 3.05Å; K388-E442 HydrophobicContact CD-CG 4.44Å; K388-E442 WeakPolarHBondContact CD-OE1 3.36Å; K388-E442 WeakPolarHBondContact CE-OE1 3.33Å; K388-E442 IonicContact NZ-OE1 2.66Å; K388-E442 PolarHBondContact NZ-OE1 3.3Å; D438-E442 WeakPolarHBondContact O-CG 3.49Å; D438-E442 PolarHBondContact O-N 3.41Å; D438-E442 VanDerWaalsContact O-N 3.11Å; E442-L445 PolarHBondContact O-N 3.48Å; E442-M446 WeakPolarHBondContact O-CB 3.34Å; E442-M446 WeakPolarHBondContact O-CE 3.38Å; E442-M446 VanDerWaalsContact O-CG 3.31Å; E442-M446 WeakPolarHBondContact O-CG 3.31Å; E442-M446 PolarHBondContact O-N 3.38Å; E442-Y462 HydrophobicContact CG-CE1 4.48Å; E442-Y462 WeakPolarHBondContact CG-OH 3.39Å
443	K	86.8	Confident	82.2	Confident	52 Å²	52	43.9 Å²	43.9	23%	0.226	24%	0.244	C	C	.	.	H	α-helix	trans	-62.8	-44.9	175.3	-82.4	174.1	168.6	-172.1	0	112.8	S439 L440 V441 M446 S447 L463 A465 N466	S439-K443 WeakPolarHBondContact O-CB 3.44Å; S439-K443 VanDerWaalsContact O-CG 3.28Å; S439-K443 WeakPolarHBondContact O-CG 3.43Å; S439-K443 PolarHBondContact O-N 3.29Å; S439-K443 VanDerWaalsContact O-N 3.1Å; L440-K443 WeakPolarHBondContact O-CB 3.37Å; L440-K443 PolarHBondContact O-N 3.43Å; V441-K443 VanDerWaalsContact C-N 3.27Å; V441-K443 PolarHBondContact O-N 3.41Å; K443-M446 HydrophobicContact CG-CE 4.19Å; K443-S447 WeakPolarHBondContact O-CB 3.44Å; K443-S447 PolarHBondContact O-N 2.99Å; K443-S447 VanDerWaalsContact O-N 3.07Å; K443-L463 WeakPolarHBondContact CE-O 3.48Å; K443-A465 VanDerWaalsContact NZ-C 3.29Å; K443-A465 PolarHBondContact NZ-O 3.02Å; K443-N466 PolarHBondContact NZ-OD1 3.19Å
444	D	86.3	Confident	80.2	Confident	22 Å²	22	47.2 Å²	47.2	12%	0.118	26%	0.26	C	S	.	.	H	α-helix	trans	-68.3	-41.9	176.9	-167.2	85	0	0	0	111.4	V232 L236 R239 L440 V441 M446 S447 S448	V232-D444 WeakPolarHBondContact CG1-OD2 3.5Å; L236-D444 HydrophobicContact CD1-CB 4.13Å; L236-D444 HydrophobicContact CD2-CB 3.81Å; L236-D444 HydrophobicContact CG-CB 4.46Å; R239-D444 IonicContact CZ-OD1 3.19Å; R239-D444 IonicContact NH2-OD1 2.84Å; R239-D444 PolarHBondContact NH2-OD1 3.5Å; L440-D444 PolarHBondContact O-N 3.13Å; L440-D444 VanDerWaalsContact O-N 3.1Å; V441-D444 PolarHBondContact O-N 2.91Å; D444-M446 PolarHBondContact O-N 3.06Å; D444-S447 CarbonylContact O-C 3.54Å; D444-S447 WeakPolarHBondContact O-CA 3.45Å; D444-S447 WeakPolarHBondContact O-CB 3.44Å; D444-S447 PolarHBondContact O-N 2.88Å; D444-S447 PolarHBondContact O-OG 2.98Å; D444-S448 PolarHBondContact O-N 3.06Å
445	L	84.4	Confident	78.1	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-62.4	-37.2	176	-72.4	172.6	0	0	0	113.5	E229 V232 V233 L362 R384 V441 E442 S447 S448 T451	E229-L445 HydrophobicContact CB-CD2 3.9Å; E229-L445 HydrophobicContact CG-CD2 4.3Å; V232-L445 HydrophobicContact CB-CD2 3.95Å; V232-L445 HydrophobicContact CG1-CD2 3.86Å; V233-L445 HydrophobicContact CG2-CD1 3.87Å; V233-L445 HydrophobicContact CG2-CD2 4.09Å; V233-L445 HydrophobicContact CG2-CG 4.05Å; L362-L445 HydrophobicContact CD2-CD1 4.26Å; R384-L445 VanDerWaalsContact NH2-CD1 3.33Å; V441-L445 HydrophobicContact CG1-CD1 3.9Å; V441-L445 WeakPolarHBondContact O-CG 3.34Å; V441-L445 PolarHBondContact O-N 3.49Å; E442-L445 PolarHBondContact O-N 3.48Å; L445-S447 VanDerWaalsContact C-N 3.34Å; L445-S448 PolarHBondContact O-OG 3.41Å; L445-T451 PolarHBondContact O-OG1 2.91Å
446	M	81.1	Confident	76.4	Confident	77 Å²	77	58.9 Å²	58.9	38%	0.379	32%	0.32	S	S	.	.	H	α-helix	trans	-66.1	-36.8	169.4	-75	-174.6	-66.1	0	0	112.1	E442 K443 D444 G449 T451 L463	E442-M446 WeakPolarHBondContact O-CB 3.34Å; E442-M446 WeakPolarHBondContact O-CE 3.38Å; E442-M446 VanDerWaalsContact O-CG 3.31Å; E442-M446 WeakPolarHBondContact O-CG 3.31Å; E442-M446 PolarHBondContact O-N 3.38Å; K443-M446 HydrophobicContact CG-CE 4.19Å; D444-M446 PolarHBondContact O-N 3.06Å; M446-G449 PolarHBondContact O-N 3.11Å; M446-T451 WeakPolarHBondContact CA-OG1 3.49Å; M446-T451 HydrophobicContact CG-CG2 4.49Å; M446-L463 HydrophobicContact CE-CD2 3.73Å; M446-L463 HydrophobicContact SD-CD2 3.92Å
447	S	82.1	Confident	75.2	Confident	92 Å²	92	64.5 Å²	64.5	64%	0.643	35%	0.354	S	S	*	.	H	α-helix	trans	-72.9	-31.5	-178.9	83.9	0	0	0	0	113.6	K443 D444 L445 G449	K443-S447 WeakPolarHBondContact O-CB 3.44Å; K443-S447 PolarHBondContact O-N 2.99Å; K443-S447 VanDerWaalsContact O-N 3.07Å; D444-S447 CarbonylContact O-C 3.54Å; D444-S447 WeakPolarHBondContact O-CA 3.45Å; D444-S447 WeakPolarHBondContact O-CB 3.44Å; D444-S447 PolarHBondContact O-N 2.88Å; D444-S447 PolarHBondContact O-OG 2.98Å; L445-S447 VanDerWaalsContact C-N 3.34Å; S447-G449 PolarHBondContact O-N 3.41Å
448	S	76.2	Confident	74.4	Confident	58 Å²	58	64.8 Å²	64.8	41%	0.406	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-12.7	177	68.6	0	0	0	0	113.2	D444 L445 M450	D444-S448 PolarHBondContact O-N 3.06Å; L445-S448 PolarHBondContact O-OG 3.41Å; S448-M450 VanDerWaalsContact C-N 3.32Å
449	G	69.3	Low	74	Confident	60 Å²	60	65.5 Å²	65.5	62%	0.619	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.6	8.1	179.5	0	0	0	0	0	114.6	M446 S447 T451	M446-G449 PolarHBondContact O-N 3.11Å; S447-G449 PolarHBondContact O-N 3.41Å; G449-T451 VanDerWaalsContact C-N 3.27Å; G449-T451 PolarHBondContact O-N 2.89Å
450	M	66.3	Low	73.5	Confident	40 Å²	40	74 Å²	74	20%	0.197	39%	0.393	C	S	.	.			trans	-69.1	-23.3	176	-70.6	-151	74.8	0	0	113.5	E227 S228 E229 V232 S448 H452	E227-M450 VanDerWaalsContact C-CE 3.45Å; E227-M450 WeakPolarHBondContact O-CE 3.5Å; S228-M450 VanDerWaalsContact C-SD 3.53Å; E229-M450 HydrophobicContact CG-CE 4.11Å; E229-M450 HydrophobicContact CG-SD 4.14Å; V232-M450 HydrophobicContact CG2-SD 3.72Å; S448-M450 VanDerWaalsContact C-N 3.32Å; M450-H452 PolarHBondContact O-N 3.23Å
451	T	61.4	Low	73.1	Confident	42 Å²	42	79.7 Å²	79.7	26%	0.258	42%	0.419	S	S	.	.	S	Bend	trans	-66.8	94.1	178.3	-48.6	0	0	0	0	111.8	L445 M446 G449 Q453 E454	L445-T451 PolarHBondContact O-OG1 2.91Å; M446-T451 WeakPolarHBondContact CA-OG1 3.49Å; M446-T451 HydrophobicContact CG-CG2 4.49Å; G449-T451 VanDerWaalsContact C-N 3.27Å; G449-T451 PolarHBondContact O-N 2.89Å; T451-Q453 PolarHBondContact O-N 3.04Å; T451-E454 HydrophobicContact CG2-CG 3.88Å; T451-E454 WeakPolarHBondContact CG2-OE1 3.31Å
452	H	55.2	Low	72.8	Confident	156 Å²	156	79.4 Å²	79.4	72%	0.722	42%	0.416	S	S	*	.			trans	-59.9	98.4	175.2	-75.2	-66.6	0	0	0	112.2	M450 E454	M450-H452 PolarHBondContact O-N 3.23Å; H452-E454 PolarHBondContact O-N 3.46Å
453	Q	52.6	Low	72.4	Confident	193 Å²	193	81 Å²	81	90%	0.902	43%	0.425	S	S	*	.			trans	8.9	78	170.9	-71.1	-167.6	-30.2	0	0	115.6	T451	T451-Q453 PolarHBondContact O-N 3.04Å
454	E	54.2	Low	72.3	Confident	71 Å²	71	84.9 Å²	84.9	33%	0.332	44%	0.444	S	S	.	.			trans	-70.9	137	-171.2	-63.8	-177.1	167.8	0	0	112.5	G385 T451 H452	G385-E454 WeakPolarHBondContact CA-OE1 3.39Å; T451-E454 HydrophobicContact CG2-CG 3.88Å; T451-E454 WeakPolarHBondContact CG2-OE1 3.31Å; H452-E454 PolarHBondContact O-N 3.46Å
455	L	52.4	Low	72.2	Confident	174 Å²	174	84.4 Å²	84.4	91%	0.911	44%	0.443	S	S	*	.	S	Bend	trans	-83.3	-21.2	-177.2	-76.5	165.2	0	0	0	113.8
456	E	58.8	Low	72.2	Confident	102 Å²	102	90.2 Å²	90.2	48%	0.477	47%	0.474	S	S	.	.	S	Bend	trans	-124.9	120.8	170	-67.2	-164.4	171.8	0	0	108.4	R393	R393-E456 IonicContact CZ-OE2 2.95Å; R393-E456 VanDerWaalsContact NH1-CD 3.28Å; R393-E456 IonicContact NH1-OE1 3.69Å; R393-E456 PolarHBondContact NH1-OE1 3.34Å; R393-E456 IonicContact NH1-OE2 3.43Å; R393-E456 PolarHBondContact NH1-OE2 2.97Å
457	T	67.3	Low	72.7	Confident	118 Å²	118	88 Å²	88	72%	0.724	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-90.3	137.3	-178.6	55.5	0	0	0	0	111.8
458	L	78.5	Confident	73.2	Confident	13 Å²	13	86.6 Å²	86.6	7%	0.068	45%	0.449	C	S	.	.	P	Polyproline II helix	trans	-57.9	158.2	166.8	-66.7	173.2	0	0	0	112	K388 A389 W392 Y462 L463	K388-L458 HydrophobicContact CD-CD1 4.25Å; K388-L458 HydrophobicContact CG-CD1 4.14Å; K388-L458 HydrophobicContact CG-CD2 4.27Å; A389-L458 HydrophobicContact CB-CD2 4.14Å; W392-L458 HydrophobicContact CB-CD2 4.35Å; W392-L458 HydrophobicContact CE3-CD2 4.32Å; L458-Y462 HydrophobicContact CB-CD1 4.29Å; L458-Y462 HydrophobicContact CD1-CD1 4.11Å; L458-Y462 HydrophobicContact CD1-CE1 3.77Å; L458-L463 HydrophobicContact CB-CD1 4.37Å; L458-L463 HydrophobicContact CB-CD2 4.19Å; L458-L463 HydrophobicContact CB-CG 4.29Å; L458-L463 WeakPolarHBondContact O-CD1 3.34Å
459	P	83.8	Confident	74	Confident	37 Å²	37	84.6 Å²	84.6	24%	0.24	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-60.4	143.9	-178.5	-26	37	0	0	0	113.5	W392 E461 Y462 L463	W392-P459 HydrophobicContact CD2-CG 4.22Å; W392-P459 HydrophobicContact CZ2-CB 4.46Å; W392-P459 HydrophobicContact CZ2-CG 3.89Å; P459-E461 WeakPolarHBondContact CB-OE2 3.37Å; P459-E461 PolarHBondContact O-N 3.16Å; P459-Y462 WeakPolarHBondContact O-CB 3.37Å; P459-Y462 PolarHBondContact O-N 3.29Å; P459-Y462 VanDerWaalsContact O-N 3.09Å; P459-L463 PolarHBondContact O-N 3.49Å
460	R	80	Confident	75.3	Confident	180 Å²	180	86.2 Å²	86.2	68%	0.679	43%	0.425	S	S	*	.	H	α-helix	trans	-63.2	-34.8	-177.9	-67.7	-171.9	-173.6	-174.7	0.7	112.1	Y462 L463 E464	R460-Y462 PolarHBondContact O-N 2.98Å; R460-Y462 VanDerWaalsContact O-N 3.14Å; R460-L463 PolarHBondContact O-N 3.41Å; R460-E464 VanDerWaalsContact O-CB 3.22Å; R460-E464 WeakPolarHBondContact O-CB 3.31Å; R460-E464 WeakPolarHBondContact O-CG 3.48Å; R460-E464 PolarHBondContact O-N 3.06Å
461	E	81.1	Confident	76.6	Confident	157 Å²	157	87 Å²	87	73%	0.734	43%	0.427	S	S	*	.	H	α-helix	trans	-58.7	-26.2	177.5	-61.7	79.9	179.4	0	0	112.6	P459 A465	P459-E461 WeakPolarHBondContact CB-OE2 3.37Å; P459-E461 PolarHBondContact O-N 3.16Å; E461-A465 WeakPolarHBondContact O-CB 3.41Å
462	Y	84.3	Confident	78.2	Confident	10 Å²	10	85 Å²	85	4%	0.039	42%	0.415	C	S	.	.	H	α-helix	trans	-88.9	-43.9	174.5	168.5	-94.9	0	0	0	112.2	K388 W392 D438 S439 E442 L458 P459 R460 A465	K388-Y462 VanDerWaalsContact CE-OH 3.29Å; K388-Y462 WeakPolarHBondContact CE-OH 3.44Å; K388-Y462 PolarHBondContact NZ-OH 3.33Å; W392-Y462 AromaticContact CH2-CD2 3.97Å; W392-Y462 HydrophobicContact CH2-CD2 3.97Å; W392-Y462 AromaticContact CH2-CG 3.97Å; W392-Y462 HydrophobicContact CH2-CG 3.97Å; W392-Y462 HydrophobicContact CZ3-CD1 4.41Å; W392-Y462 AromaticContact CZ3-CD2 3.69Å; W392-Y462 HydrophobicContact CZ3-CD2 3.69Å; W392-Y462 HydrophobicContact CZ3-CE2 4.28Å; W392-Y462 AromaticContact CZ3-CG 3.76Å; W392-Y462 HydrophobicContact CZ3-CG 3.76Å; D438-Y462 PolarHBondContact O-OH 3.29Å; D438-Y462 PolarHBondContact OD2-OH 2.87Å; S439-Y462 PolarHBondContact OG-O 3.45Å; E442-Y462 HydrophobicContact CG-CE1 4.48Å; E442-Y462 WeakPolarHBondContact CG-OH 3.39Å; L458-Y462 HydrophobicContact CB-CD1 4.29Å; L458-Y462 HydrophobicContact CD1-CD1 4.11Å; L458-Y462 HydrophobicContact CD1-CE1 3.77Å; P459-Y462 WeakPolarHBondContact O-CB 3.37Å; P459-Y462 PolarHBondContact O-N 3.29Å; P459-Y462 VanDerWaalsContact O-N 3.09Å; R460-Y462 PolarHBondContact O-N 2.98Å; R460-Y462 VanDerWaalsContact O-N 3.14Å; Y462-A465 WeakPolarHBondContact O-CB 3.38Å; Y462-A465 PolarHBondContact O-N 2.91Å
463	L	79.4	Confident	80.1	Confident	48 Å²	48	77.9 Å²	77.9	25%	0.251	38%	0.382	S	S	.	.	H	α-helix	trans	-69.2	-33.9	-179.4	-60	173.9	0	0	0	112.6	K443 M446 L458 P459 R460 A465	K443-L463 WeakPolarHBondContact CE-O 3.48Å; M446-L463 HydrophobicContact CE-CD2 3.73Å; M446-L463 HydrophobicContact SD-CD2 3.92Å; L458-L463 HydrophobicContact CB-CD1 4.37Å; L458-L463 HydrophobicContact CB-CD2 4.19Å; L458-L463 HydrophobicContact CB-CG 4.29Å; L458-L463 WeakPolarHBondContact O-CD1 3.34Å; P459-L463 PolarHBondContact O-N 3.49Å; R460-L463 PolarHBondContact O-N 3.41Å; L463-A465 VanDerWaalsContact C-N 3.34Å
464	E	83	Confident	82.1	Confident	132 Å²	132	74.6 Å²	74.6	62%	0.617	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	2.6	177.5	-59.2	173.9	-158.3	0	0	111.8	R460 N466	R460-E464 VanDerWaalsContact O-CB 3.22Å; R460-E464 WeakPolarHBondContact O-CB 3.31Å; R460-E464 WeakPolarHBondContact O-CG 3.48Å; R460-E464 PolarHBondContact O-N 3.06Å; E464-N466 PolarHBondContact O-N 3.24Å
465	A	83.9	Confident	84	Confident	12 Å²	12	74.6 Å²	74.6	10%	0.099	37%	0.367	C	S	.	.			trans	-67.2	97.8	-174.7	0	0	0	0	0	112.7	K443 E461 Y462 L463 W467	K443-A465 VanDerWaalsContact NZ-C 3.29Å; K443-A465 PolarHBondContact NZ-O 3.02Å; E461-A465 WeakPolarHBondContact O-CB 3.41Å; Y462-A465 WeakPolarHBondContact O-CB 3.38Å; Y462-A465 PolarHBondContact O-N 2.91Å; L463-A465 VanDerWaalsContact C-N 3.34Å; A465-W467 PolarHBondContact O-N 2.94Å; A465-W467 VanDerWaalsContact O-N 3.17Å
466	N	86.1	Confident	85.9	Confident	123 Å²	123	66.4 Å²	66.4	66%	0.658	32%	0.324	S	S	*	.			trans	-77.4	103.8	169.5	-68.2	-15	0	0	0	108.5	K443 E464 K471	K443-N466 PolarHBondContact NZ-OD1 3.19Å; E464-N466 PolarHBondContact O-N 3.24Å; N466-K471 VanDerWaalsContact O-CD 3.27Å; N466-K471 WeakPolarHBondContact O-CD 3.48Å; N466-K471 PolarHBondContact O-NZ 2.85Å; N466-K471 VanDerWaalsContact O-NZ 3.1Å
467	W	90.3	Very high	87.4	Confident	30 Å²	30	66.7 Å²	66.7	11%	0.114	33%	0.325	C	S	.	.			trans	-102.8	138.4	174.3	-73.1	115.1	0	0	0	110.1	Y432 M436 A465 K471 V472 E475	Y432-W467 AromaticContact CD1-CH2 3.93Å; Y432-W467 HydrophobicContact CD1-CH2 3.93Å; Y432-W467 HydrophobicContact CD1-CZ3 4.24Å; Y432-W467 HydrophobicContact CE1-CH2 4.12Å; M436-W467 HydrophobicContact CB-CB 4.08Å; M436-W467 HydrophobicContact CB-CG 4.16Å; M436-W467 HydrophobicContact CG-CB 3.68Å; M436-W467 HydrophobicContact CG-CG 4.31Å; M436-W467 HydrophobicContact SD-CB 4.09Å; A465-W467 PolarHBondContact O-N 2.94Å; A465-W467 VanDerWaalsContact O-N 3.17Å; W467-K471 HydrophobicContact CE3-CD 4.02Å; W467-K471 HydrophobicContact CZ3-CD 4.21Å; W467-K471 HydrophobicContact CZ3-CG 4.48Å; W467-V472 HydrophobicContact CE3-CG2 4.09Å; W467-V472 HydrophobicContact CZ3-CG2 4.38Å; W467-E475 HydrophobicContact CH2-CG 4.47Å; W467-E475 HydrophobicContact CZ3-CG 4.13Å
468	T	93.4	Very high	88.6	Confident	63 Å²	63	64.7 Å²	64.7	39%	0.387	32%	0.32	S	S	.	.			trans	-138.2	165.5	167.4	76	0	0	0	0	107.7	E470 K471 V472	T468-E470 VanDerWaalsContact C-N 3.28Å; T468-E470 WeakPolarHBondContact CB-OE2 3.48Å; T468-E470 PolarHBondContact O-N 3.08Å; T468-E470 PolarHBondContact OG1-OE2 3.24Å; T468-K471 PolarHBondContact O-N 2.96Å; T468-K471 PolarHBondContact OG1-N 3.34Å; T468-V472 PolarHBondContact O-N 3.2Å
469	M	93.8	Very high	89.1	Confident	16 Å²	16	65.3 Å²	65.3	8%	0.079	33%	0.326	C	S	.	.	H	α-helix	trans	-65.4	-35.2	-178.2	-58.7	-164	-158	0	0	111.5	I242 Q245 F433 M436 V472 F473 I500 L501	I242-M469 HydrophobicContact CB-CE 4.43Å; I242-M469 HydrophobicContact CG2-CE 3.92Å; Q245-M469 HydrophobicContact CB-CE 3.98Å; F433-M469 HydrophobicContact CE1-CG 4.06Å; F433-M469 HydrophobicContact CE1-SD 4.24Å; F433-M469 HydrophobicContact CZ-CB 4.25Å; F433-M469 HydrophobicContact CZ-CG 4.25Å; M436-M469 HydrophobicContact CE-CG 4.14Å; M469-V472 PolarHBondContact O-N 3.05Å; M469-F473 WeakPolarHBondContact O-CD2 3.47Å; M469-F473 PolarHBondContact O-N 2.84Å; M469-I500 HydrophobicContact SD-CG2 3.89Å; M469-L501 HydrophobicContact CB-CD2 3.67Å
470	E	95	Very high	89.3	Confident	94 Å²	94	73.2 Å²	73.2	44%	0.439	36%	0.359	S	S	.	.	H	α-helix	trans	-60.8	-50.2	177	-52.7	65.4	-134.6	0	0	109.7	T468 V472 F473 E474 L501	T468-E470 VanDerWaalsContact C-N 3.28Å; T468-E470 WeakPolarHBondContact CB-OE2 3.48Å; T468-E470 PolarHBondContact O-N 3.08Å; T468-E470 PolarHBondContact OG1-OE2 3.24Å; E470-V472 VanDerWaalsContact C-N 3.28Å; E470-V472 PolarHBondContact O-N 3.34Å; E470-F473 CarbonylContact O-C 3.58Å; E470-F473 WeakPolarHBondContact O-CA 3.37Å; E470-F473 PolarHBondContact O-N 3.12Å; E470-E474 PolarHBondContact O-N 3.14Å; E470-L501 HydrophobicContact CB-CD2 4.4Å; E470-L501 HydrophobicContact CG-CD2 3.99Å
471	K	94.4	Very high	89.8	Confident	57 Å²	57	67.1 Å²	67.1	25%	0.248	34%	0.344	C	S	.	.	H	α-helix	trans	-60.4	-35.5	-179.6	-167.9	-168.9	175.5	-156.8	0	112.6	N466 W467 T468 F473 E474 E475	N466-K471 VanDerWaalsContact O-CD 3.27Å; N466-K471 WeakPolarHBondContact O-CD 3.48Å; N466-K471 PolarHBondContact O-NZ 2.85Å; N466-K471 VanDerWaalsContact O-NZ 3.1Å; W467-K471 HydrophobicContact CE3-CD 4.02Å; W467-K471 HydrophobicContact CZ3-CD 4.21Å; W467-K471 HydrophobicContact CZ3-CG 4.48Å; T468-K471 PolarHBondContact O-N 2.96Å; T468-K471 PolarHBondContact OG1-N 3.34Å; K471-F473 VanDerWaalsContact C-N 3.26Å; K471-F473 PolarHBondContact O-N 3.02Å; K471-E474 PolarHBondContact O-N 3.26Å; K471-E475 WeakPolarHBondContact CE-OE1 3.47Å; K471-E475 HydrophobicContact CG-CG 4.31Å; K471-E475 IonicContact NZ-OE1 2.73Å; K471-E475 VanDerWaalsContact O-CG 3.24Å; K471-E475 WeakPolarHBondContact O-CG 3.35Å; K471-E475 PolarHBondContact O-N 3.09Å
472	V	94.9	Very high	90.2	Very high	0 Å²	0	67.1 Å²	67.1	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-58.7	-41.1	173.4	169.3	0	0	0	0	111	Y432 F433 M436 W467 T468 M469 E470 L476	Y432-V472 VanDerWaalsContact CB-CG1 3.44Å; Y432-V472 HydrophobicContact CD2-CG1 4.35Å; Y432-V472 HydrophobicContact CG-CG1 4.12Å; F433-V472 HydrophobicContact CD2-CG1 3.69Å; F433-V472 HydrophobicContact CE2-CB 4.08Å; F433-V472 HydrophobicContact CE2-CG1 3.52Å; F433-V472 HydrophobicContact CE2-CG2 4.5Å; F433-V472 HydrophobicContact CZ-CG1 4.45Å; M436-V472 HydrophobicContact SD-CG2 4.01Å; W467-V472 HydrophobicContact CE3-CG2 4.09Å; W467-V472 HydrophobicContact CZ3-CG2 4.38Å; T468-V472 PolarHBondContact O-N 3.2Å; M469-V472 PolarHBondContact O-N 3.05Å; E470-V472 VanDerWaalsContact C-N 3.28Å; E470-V472 PolarHBondContact O-N 3.34Å; V472-L476 HydrophobicContact CG1-CD1 4.08Å; V472-L476 WeakPolarHBondContact O-CD1 3.44Å; V472-L476 VanDerWaalsContact O-CG 3.28Å; V472-L476 WeakPolarHBondContact O-CG 3.44Å; V472-L476 PolarHBondContact O-N 3.49Å; V472-L476 VanDerWaalsContact O-N 3.1Å
473	F	95.6	Very high	90.6	Very high	5 Å²	5	72.4 Å²	72.4	2%	0.022	36%	0.362	C	S	.	.	H	α-helix	trans	-77	-26.1	176.3	-65.6	-68.4	0	0	0	113.9	W425 V429 F433 M469 E470 K471 L476 Q477 K497 I500 L501	W425-F473 AromaticContact CZ2-CE1 4Å; W425-F473 HydrophobicContact CZ2-CE1 4Å; V429-F473 HydrophobicContact CG2-CE1 4.43Å; F433-F473 HydrophobicContact CE2-CE2 4.16Å; F433-F473 HydrophobicContact CE2-CZ 4.07Å; F433-F473 HydrophobicContact CZ-CE2 4.21Å; F433-F473 HydrophobicContact CZ-CZ 4.46Å; M469-F473 WeakPolarHBondContact O-CD2 3.47Å; M469-F473 PolarHBondContact O-N 2.84Å; E470-F473 CarbonylContact O-C 3.58Å; E470-F473 WeakPolarHBondContact O-CA 3.37Å; E470-F473 PolarHBondContact O-N 3.12Å; K471-F473 VanDerWaalsContact C-N 3.26Å; K471-F473 PolarHBondContact O-N 3.02Å; F473-L476 HydrophobicContact CD1-CD1 3.71Å; F473-L476 HydrophobicContact CE1-CD1 4.08Å; F473-Q477 VanDerWaalsContact O-CG 3.32Å; F473-Q477 WeakPolarHBondContact O-CG 3.33Å; F473-Q477 PolarHBondContact O-N 3.34Å; F473-K497 HydrophobicContact CB-CD 4.11Å; F473-K497 HydrophobicContact CB-CG 4.4Å; F473-K497 HydrophobicContact CD1-CB 4.21Å; F473-K497 HydrophobicContact CD1-CD 4.14Å; F473-K497 HydrophobicContact CD1-CG 3.9Å; F473-K497 HydrophobicContact CD2-CD 4.49Å; F473-K497 HydrophobicContact CD2-CG 3.86Å; F473-K497 HydrophobicContact CE1-CB 4.01Å; F473-K497 HydrophobicContact CE1-CG 4.12Å; F473-K497 HydrophobicContact CE2-CB 4.48Å; F473-K497 HydrophobicContact CE2-CG 4.07Å; F473-K497 HydrophobicContact CG-CD 4Å; F473-K497 HydrophobicContact CG-CG 3.78Å; F473-K497 HydrophobicContact CZ-CB 4.16Å; F473-K497 HydrophobicContact CZ-CG 4.2Å; F473-I500 HydrophobicContact CE2-CB 4.31Å; F473-I500 HydrophobicContact CE2-CG2 3.94Å; F473-I500 HydrophobicContact CZ-CB 4.38Å; F473-I500 HydrophobicContact CZ-CD1 4.01Å; F473-I500 HydrophobicContact CZ-CG2 4.25Å; F473-L501 HydrophobicContact CD2-CD1 4.24Å; F473-L501 HydrophobicContact CD2-CD2 4.02Å; F473-L501 HydrophobicContact CD2-CG 4.14Å; F473-L501 HydrophobicContact CE2-CD2 4.27Å; F473-L501 HydrophobicContact CE2-CG 4.22Å
474	E	94.6	Very high	91.1	Very high	124 Å²	124	70.2 Å²	70.2	58%	0.579	35%	0.35	S	S	*	.	H	α-helix	trans	-64.3	-48	168.8	-66	176.5	162.8	0	0	111.5	E470 K471 L476 Q477 A478	E470-E474 PolarHBondContact O-N 3.14Å; K471-E474 PolarHBondContact O-N 3.26Å; E474-L476 VanDerWaalsContact C-N 3.29Å; E474-L476 PolarHBondContact O-N 3.42Å; E474-Q477 CarbonylContact O-C 3.58Å; E474-Q477 PolarHBondContact O-N 3.49Å; E474-Q477 VanDerWaalsContact O-N 3.12Å; E474-A478 PolarHBondContact O-N 3.06Å
475	E	93.3	Very high	91.6	Very high	72 Å²	72	66.4 Å²	66.4	34%	0.336	33%	0.334	S	S	.	.	H	α-helix	trans	-67.3	-28.8	178.6	-59.3	-85.4	-165	0	0	111.8	Y432 W467 K471 A478 S479	Y432-E475 HydrophobicContact CE1-CB 3.98Å; Y432-E475 HydrophobicContact CE2-CB 4.33Å; W467-E475 HydrophobicContact CH2-CG 4.47Å; W467-E475 HydrophobicContact CZ3-CG 4.13Å; K471-E475 WeakPolarHBondContact CE-OE1 3.47Å; K471-E475 HydrophobicContact CG-CG 4.31Å; K471-E475 IonicContact NZ-OE1 2.73Å; K471-E475 VanDerWaalsContact O-CG 3.24Å; K471-E475 WeakPolarHBondContact O-CG 3.35Å; K471-E475 PolarHBondContact O-N 3.09Å; E475-A478 PolarHBondContact O-N 3.48Å; E475-S479 PolarHBondContact O-N 3.5Å
476	L	92.3	Very high	92	Very high	1 Å²	1	71.5 Å²	71.5	1%	0.005	36%	0.356	C	S	.	.	H	α-helix	trans	-69.1	-40.5	169.2	-76.2	163.1	0	0	0	112.4	C428 V429 Y432 V472 F473 E474 A478 S479 V484	C428-L476 HydrophobicContact CB-CD2 3.44Å; C428-L476 VanDerWaalsContact CB-CD2 3.44Å; V429-L476 HydrophobicContact CB-CD1 4.44Å; V429-L476 HydrophobicContact CG2-CD1 3.59Å; V429-L476 HydrophobicContact CG2-CD2 4.45Å; Y432-L476 HydrophobicContact CD2-CD1 4.46Å; Y432-L476 HydrophobicContact CD2-CD2 3.91Å; Y432-L476 HydrophobicContact CD2-CG 3.85Å; Y432-L476 HydrophobicContact CE2-CD2 3.85Å; Y432-L476 HydrophobicContact CE2-CG 3.89Å; V472-L476 HydrophobicContact CG1-CD1 4.08Å; V472-L476 WeakPolarHBondContact O-CD1 3.44Å; V472-L476 VanDerWaalsContact O-CG 3.28Å; V472-L476 WeakPolarHBondContact O-CG 3.44Å; V472-L476 PolarHBondContact O-N 3.49Å; V472-L476 VanDerWaalsContact O-N 3.1Å; F473-L476 HydrophobicContact CD1-CD1 3.71Å; F473-L476 HydrophobicContact CE1-CD1 4.08Å; E474-L476 VanDerWaalsContact C-N 3.29Å; E474-L476 PolarHBondContact O-N 3.42Å; L476-A478 PolarHBondContact O-N 3.49Å; L476-S479 WeakPolarHBondContact O-CB 3.42Å; L476-S479 PolarHBondContact O-N 3.11Å; L476-S479 VanDerWaalsContact O-N 3.16Å; L476-V484 HydrophobicContact CD2-CG1 4.26Å
477	Q	91.1	Very high	92.3	Very high	109 Å²	109	67.1 Å²	67.1	51%	0.509	33%	0.331	S	S	.	.	H	α-helix	trans	-68.2	-20.2	173.7	-73.8	179	-12.4	0	0	112.9	F473 E474 L485 T488	F473-Q477 VanDerWaalsContact O-CG 3.32Å; F473-Q477 WeakPolarHBondContact O-CG 3.33Å; F473-Q477 PolarHBondContact O-N 3.34Å; E474-Q477 CarbonylContact O-C 3.58Å; E474-Q477 PolarHBondContact O-N 3.49Å; E474-Q477 VanDerWaalsContact O-N 3.12Å; Q477-L485 WeakPolarHBondContact O-CD2 3.21Å; Q477-T488 HydrophobicContact CG-CG2 4.26Å
478	A	91.6	Very high	92.4	Very high	75 Å²	75	66.6 Å²	66.6	62%	0.62	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	1.8	172.3	0	0	0	0	0	114.5	E474 E475 L476	E474-A478 PolarHBondContact O-N 3.06Å; E475-A478 PolarHBondContact O-N 3.48Å; L476-A478 PolarHBondContact O-N 3.49Å
479	S	90.2	Very high	92.3	Very high	27 Å²	27	73 Å²	73	19%	0.189	35%	0.349	C	S	.	.			trans	-60.2	136.8	-175	-177.2	0	0	0	0	113.8	E475 L476 S481 L485	E475-S479 PolarHBondContact O-N 3.5Å; L476-S479 WeakPolarHBondContact O-CB 3.42Å; L476-S479 PolarHBondContact O-N 3.11Å; L476-S479 VanDerWaalsContact O-N 3.16Å; S479-S481 PolarHBondContact O-N 3.07Å; S479-S481 PolarHBondContact OG-N 3.21Å; S479-L485 WeakPolarHBondContact O-CD1 3.45Å
480	E	87.6	Confident	92.1	Very high	202 Å²	202	74.9 Å²	74.9	94%	0.944	36%	0.357	S	S	*	.	S	Bend	trans	-68.9	-17.1	173.6	-60.1	-170.9	164.2	0	0	113	K482	E480-K482 PolarHBondContact O-N 2.86Å
481	S	89.7	Confident	92.1	Very high	52 Å²	52	73.2 Å²	73.2	36%	0.364	35%	0.35	S	S	.	.			trans	-83	104.4	-177.7	-175.6	0	0	0	0	111.4	S479 R483 V484 L485	S479-S481 PolarHBondContact O-N 3.07Å; S479-S481 PolarHBondContact OG-N 3.21Å; S481-R483 PolarHBondContact O-N 3.46Å; S481-V484 PolarHBondContact O-N 3.43Å; S481-L485 PolarHBondContact O-N 3.43Å; S481-L485 VanDerWaalsContact O-N 3.07Å
482	K	90.3	Very high	92.1	Very high	158 Å²	158	71 Å²	71	69%	0.687	34%	0.34	S	S	*	.	H	α-helix	trans	-47.5	-44.7	175.2	-67.8	-172.1	175.9	-170.9	0	113.2	E480 V484 L485 E486	E480-K482 PolarHBondContact O-N 2.86Å; K482-V484 VanDerWaalsContact C-N 3.3Å; K482-V484 PolarHBondContact O-N 3.05Å; K482-L485 CarbonylContact O-C 3.6Å; K482-L485 WeakPolarHBondContact O-CB 3.39Å; K482-L485 PolarHBondContact O-N 2.97Å; K482-L485 VanDerWaalsContact O-N 3.11Å; K482-E486 WeakPolarHBondContact O-CB 3.3Å; K482-E486 WeakPolarHBondContact O-CG 3.26Å; K482-E486 PolarHBondContact O-N 3.49Å
483	R	91.4	Very high	92.1	Very high	121 Å²	121	71.1 Å²	71.1	46%	0.457	34%	0.34	S	S	.	.	H	α-helix	trans	-57.2	-42.9	178	-179.7	-176.1	171	-163.9	-4.7	111.7	E423 S481 E486 E487	E423-R483 VanDerWaalsContact O-CZ 3.3Å; E423-R483 PolarHBondContact O-NH1 3.09Å; S481-R483 PolarHBondContact O-N 3.46Å; R483-E486 PolarHBondContact O-N 3.37Å; R483-E487 HydrophobicContact CG-CG 4.45Å; R483-E487 IonicContact CZ-OE1 2.71Å; R483-E487 IonicContact NE-OE1 3.73Å; R483-E487 PolarHBondContact NE-OE1 3.49Å; R483-E487 IonicContact NE-OE2 2.74Å; R483-E487 IonicContact NH2-OE1 3.81Å; R483-E487 PolarHBondContact NH2-OE1 2.89Å; R483-E487 WeakPolarHBondContact O-CB 3.34Å; R483-E487 WeakPolarHBondContact O-CG 3.45Å; R483-E487 PolarHBondContact O-N 3.35Å
484	V	91.5	Very high	92.1	Very high	1 Å²	1	71.7 Å²	71.7	1%	0.006	34%	0.344	C	S	.	.	H	α-helix	trans	-70.2	-35.8	178.6	177.6	0	0	0	0	110.8	C428 L476 S481 K482 E486 T488	C428-V484 HydrophobicContact CB-CG1 4.45Å; L476-V484 HydrophobicContact CD2-CG1 4.26Å; S481-V484 PolarHBondContact O-N 3.43Å; K482-V484 VanDerWaalsContact C-N 3.3Å; K482-V484 PolarHBondContact O-N 3.05Å; V484-E486 VanDerWaalsContact C-N 3.35Å; V484-T488 VanDerWaalsContact O-CB 3.29Å; V484-T488 WeakPolarHBondContact O-CB 3.37Å; V484-T488 PolarHBondContact O-N 2.89Å; V484-T488 PolarHBondContact O-OG1 3.47Å
485	L	92.9	Very high	92.2	Very high	53 Å²	53	65.8 Å²	65.8	28%	0.277	32%	0.317	S	S	.	.	H	α-helix	trans	-68.5	-31.9	173.9	-61.6	179.9	0	0	0	113.2	Q477 S479 S481 K482	Q477-L485 WeakPolarHBondContact O-CD2 3.21Å; S479-L485 WeakPolarHBondContact O-CD1 3.45Å; S481-L485 PolarHBondContact O-N 3.43Å; S481-L485 VanDerWaalsContact O-N 3.07Å; K482-L485 CarbonylContact O-C 3.6Å; K482-L485 WeakPolarHBondContact O-CB 3.39Å; K482-L485 PolarHBondContact O-N 2.97Å; K482-L485 VanDerWaalsContact O-N 3.11Å
486	E	92.3	Very high	92.4	Very high	118 Å²	118	62.4 Å²	62.4	55%	0.551	30%	0.301	S	S	*	.	H	α-helix	trans	-71.7	-52.1	172.7	-72.8	152.8	-165.1	0	0	110.1	K482 R483 V484 T488 R489	K482-E486 WeakPolarHBondContact O-CB 3.3Å; K482-E486 WeakPolarHBondContact O-CG 3.26Å; K482-E486 PolarHBondContact O-N 3.49Å; R483-E486 PolarHBondContact O-N 3.37Å; V484-E486 VanDerWaalsContact C-N 3.35Å; E486-T488 VanDerWaalsContact C-N 3.26Å; E486-T488 PolarHBondContact O-N 3.31Å; E486-R489 WeakPolarHBondContact O-CB 3.38Å; E486-R489 PolarHBondContact O-N 3.47Å
487	E	91.9	Very high	92.6	Very high	31 Å²	31	64.4 Å²	64.4	15%	0.145	31%	0.309	C	S	.	.	H	α-helix	trans	-59.2	-33.4	175.4	-73.6	172.6	175.1	0	0	112.3	S424 W425 R483 R489 E490 H493	S424-E487 WeakPolarHBondContact CA-OE2 3.38Å; W425-E487 HydrophobicContact CB-CB 3.82Å; W425-E487 PolarHBondContact N-OE2 2.74Å; R483-E487 HydrophobicContact CG-CG 4.45Å; R483-E487 IonicContact CZ-OE1 2.71Å; R483-E487 IonicContact NE-OE1 3.73Å; R483-E487 PolarHBondContact NE-OE1 3.49Å; R483-E487 IonicContact NE-OE2 2.74Å; R483-E487 IonicContact NH2-OE1 3.81Å; R483-E487 PolarHBondContact NH2-OE1 2.89Å; R483-E487 WeakPolarHBondContact O-CB 3.34Å; R483-E487 WeakPolarHBondContact O-CG 3.45Å; R483-E487 PolarHBondContact O-N 3.35Å; E487-R489 PolarHBondContact O-N 2.8Å; E487-R489 VanDerWaalsContact O-N 3.12Å; E487-E490 WeakPolarHBondContact O-CB 3.42Å; E487-E490 PolarHBondContact O-N 2.81Å; E487-E490 VanDerWaalsContact O-N 3.09Å; E487-H493 PolarHBondContact O-ND1 2.93Å
488	T	92.2	Very high	92.9	Very high	20 Å²	20	60.2 Å²	60.2	12%	0.123	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-17.9	175.3	-61.1	0	0	0	0	113.2	W425 Q477 V484 E486	W425-T488 VanDerWaalsContact CD1-OG1 3.24Å; Q477-T488 HydrophobicContact CG-CG2 4.26Å; V484-T488 VanDerWaalsContact O-CB 3.29Å; V484-T488 WeakPolarHBondContact O-CB 3.37Å; V484-T488 PolarHBondContact O-N 2.89Å; V484-T488 PolarHBondContact O-OG1 3.47Å; E486-T488 VanDerWaalsContact C-N 3.26Å; E486-T488 PolarHBondContact O-N 3.31Å
489	R	90.9	Very high	93.1	Very high	198 Å²	198	56.7 Å²	56.7	75%	0.747	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	-3.3	178.4	-62.3	172	-178.3	174.6	0.9	113.4	E486 E487	E486-R489 WeakPolarHBondContact O-CB 3.38Å; E486-R489 PolarHBondContact O-N 3.47Å; E487-R489 PolarHBondContact O-N 2.8Å; E487-R489 VanDerWaalsContact O-N 3.12Å
490	E	91.1	Very high	93.5	Very high	54 Å²	54	55.4 Å²	55.4	25%	0.252	25%	0.251	S	S	.	.	S	Bend	trans	-70.8	134.8	176.6	-79	-63.4	166.1	0	0	111.2	W190 E487 F492 H493 V494	W190-E490 HydrophobicContact CH2-CG 4.24Å; E487-E490 WeakPolarHBondContact O-CB 3.42Å; E487-E490 PolarHBondContact O-N 2.81Å; E487-E490 VanDerWaalsContact O-N 3.09Å; E490-F492 VanDerWaalsContact C-N 3.25Å; E490-F492 PolarHBondContact O-N 2.98Å; E490-F492 VanDerWaalsContact O-N 3.1Å; E490-H493 PolarHBondContact O-N 3.32Å; E490-V494 PolarHBondContact O-N 2.96Å
491	H	93.6	Very high	93.8	Very high	60 Å²	60	47.7 Å²	47.7	28%	0.278	22%	0.216	S	C	.	.	H	α-helix	trans	-50.9	-42.3	-170.7	-53.1	83	0	0	0	113	V494 I495 W514 L525	H491-V494 PolarHBondContact O-N 2.97Å; H491-I495 WeakPolarHBondContact O-CD1 3.2Å; H491-I495 WeakPolarHBondContact O-CG1 3.37Å; H491-I495 PolarHBondContact O-N 3.22Å; H491-W514 HydrophobicContact CB-CH2 3.81Å; H491-W514 HydrophobicContact CB-CZ2 4.44Å; H491-W514 HydrophobicContact CB-CZ3 3.91Å; H491-W514 AromaticContact CD2-CD2 3.88Å; H491-W514 AromaticContact CD2-CE3 3.84Å; H491-W514 AromaticContact CD2-CZ3 3.98Å; H491-W514 WeakPolarHBondContact O-CH2 3.27Å; H491-L525 HydrophobicContact CB-CD1 3.95Å; H491-L525 HydrophobicContact CB-CD2 3.68Å; H491-L525 HydrophobicContact CB-CG 4.49Å; H491-L525 VanDerWaalsContact CD2-CD2 3.48Å; H491-L525 WeakPolarHBondContact CD2-CD2 3.39Å
492	F	94.4	Very high	94	Very high	11 Å²	11	46.8 Å²	46.8	5%	0.048	22%	0.215	C	C	.	.	H	α-helix	trans	-66.9	-39.4	176.9	-77.2	-67.7	0	0	0	113.2	L191 Q194 E195 E490 I495 Q496 F528	L191-F492 HydrophobicContact CD2-CD2 4.37Å; L191-F492 HydrophobicContact CD2-CE2 4.06Å; Q194-F492 HydrophobicContact CB-CB 4.06Å; Q194-F492 HydrophobicContact CB-CD2 3.76Å; Q194-F492 HydrophobicContact CB-CE2 4.35Å; Q194-F492 HydrophobicContact CB-CG 3.9Å; E195-F492 HydrophobicContact CB-CE1 4.02Å; E195-F492 HydrophobicContact CB-CZ 3.87Å; E195-F492 HydrophobicContact CG-CE1 4.41Å; E195-F492 HydrophobicContact CG-CZ 4.46Å; E490-F492 VanDerWaalsContact C-N 3.25Å; E490-F492 PolarHBondContact O-N 2.98Å; E490-F492 VanDerWaalsContact O-N 3.1Å; F492-I495 PolarHBondContact O-N 2.99Å; F492-Q496 WeakPolarHBondContact O-CB 3.33Å; F492-Q496 WeakPolarHBondContact O-CG 3.28Å; F492-Q496 PolarHBondContact O-N 2.84Å; F492-F528 HydrophobicContact CE1-CD1 4.05Å; F492-F528 HydrophobicContact CE1-CD2 4.15Å; F492-F528 HydrophobicContact CE1-CE1 4.33Å; F492-F528 HydrophobicContact CE1-CE2 4.36Å; F492-F528 AromaticContact CE1-CG 3.98Å; F492-F528 HydrophobicContact CE1-CG 3.98Å; F492-F528 HydrophobicContact CE1-CZ 4.47Å
493	H	95.6	Very high	94.2	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.009	20%	0.199	C	C	.	.	H	α-helix	trans	-70.4	-33.5	177.4	-61.1	160.2	0	0	0	111.9	Q194 W425 E487 E490 Q496 K497	Q194-H493 PolarHBondContact NE2-NE2 3.38Å; W425-H493 HydrophobicContact CD2-CB 4.17Å; W425-H493 AromaticContact CD2-CG 3.88Å; W425-H493 AromaticContact CD2-ND1 3.96Å; W425-H493 HydrophobicContact CE3-CB 4.33Å; W425-H493 AromaticContact CE3-CD2 3.65Å; W425-H493 AromaticContact CE3-CG 3.78Å; W425-H493 AromaticContact CE3-NE2 3.91Å; W425-H493 HydrophobicContact CH2-CB 4.09Å; W425-H493 HydrophobicContact CZ2-CB 3.89Å; W425-H493 HydrophobicContact CZ3-CB 4.31Å; W425-H493 AromaticContact CZ3-CD2 3.72Å; E487-H493 PolarHBondContact O-ND1 2.93Å; E490-H493 PolarHBondContact O-N 3.32Å; H493-Q496 PolarHBondContact CD2-OE1 3.36Å; H493-Q496 PolarHBondContact O-N 3.3Å; H493-K497 WeakPolarHBondContact O-CB 3.36Å; H493-K497 PolarHBondContact O-N 2.71Å
494	V	95.9	Very high	94.3	Very high	17 Å²	17	37.7 Å²	37.7	10%	0.103	18%	0.183	C	C	.	.	H	α-helix	trans	-63.2	-48	170.5	179.9	0	0	0	0	110.6	E490 H491 Q496 K497 F498 E510 W514	E490-V494 PolarHBondContact O-N 2.96Å; H491-V494 PolarHBondContact O-N 2.97Å; V494-Q496 PolarHBondContact O-N 2.98Å; V494-K497 WeakPolarHBondContact O-CB 3.41Å; V494-K497 PolarHBondContact O-N 2.82Å; V494-F498 HydrophobicContact CG1-CD2 3.81Å; V494-F498 HydrophobicContact CG1-CE2 3.7Å; V494-F498 VanDerWaalsContact O-CD2 3.29Å; V494-F498 WeakPolarHBondContact O-CD2 3.47Å; V494-F498 PolarHBondContact O-N 3.11Å; V494-F498 VanDerWaalsContact O-N 3.08Å; V494-E510 HydrophobicContact CG1-CG 4.08Å; V494-W514 HydrophobicContact CB-CH2 4.25Å; V494-W514 HydrophobicContact CB-CZ2 3.99Å; V494-W514 HydrophobicContact CG1-CH2 4.34Å; V494-W514 HydrophobicContact CG1-CZ2 3.84Å
495	I	96.9	Very high	94.4	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-58.3	-47.6	174.9	-66.1	160.3	0	0	0	110.9	T198 H491 F492 K497 F498 V499 L507 F511 W514 L525 F528 L532	T198-I495 HydrophobicContact CG2-CG2 4.03Å; H491-I495 WeakPolarHBondContact O-CD1 3.2Å; H491-I495 WeakPolarHBondContact O-CG1 3.37Å; H491-I495 PolarHBondContact O-N 3.22Å; F492-I495 PolarHBondContact O-N 2.99Å; I495-K497 VanDerWaalsContact C-N 3.35Å; I495-K497 PolarHBondContact O-N 3.19Å; I495-F498 PolarHBondContact O-N 2.68Å; I495-V499 HydrophobicContact CG2-CG2 4.12Å; I495-V499 WeakPolarHBondContact O-CB 3.35Å; I495-V499 VanDerWaalsContact O-CG2 3.3Å; I495-V499 WeakPolarHBondContact O-CG2 3.41Å; I495-V499 PolarHBondContact O-N 3.34Å; I495-L507 HydrophobicContact CB-CD1 4.42Å; I495-L507 HydrophobicContact CG1-CD1 4.02Å; I495-F511 HydrophobicContact CD1-CE1 4.17Å; I495-F511 HydrophobicContact CD1-CZ 4.39Å; I495-F511 HydrophobicContact CG1-CE1 3.92Å; I495-F511 HydrophobicContact CG1-CZ 4.29Å; I495-W514 HydrophobicContact CD1-CH2 4.26Å; I495-W514 HydrophobicContact CD1-CZ3 4.12Å; I495-W514 HydrophobicContact CG1-CH2 3.99Å; I495-W514 HydrophobicContact CG1-CZ3 4.25Å; I495-L525 HydrophobicContact CD1-CD1 4.05Å; I495-F528 HydrophobicContact CD1-CD1 4.04Å; I495-F528 HydrophobicContact CD1-CE1 3.78Å; I495-F528 HydrophobicContact CG2-CE1 4.02Å; I495-F528 HydrophobicContact CG2-CZ 4.44Å; I495-L532 HydrophobicContact CG2-CD2 3.9Å
496	Q	97	Very high	94.4	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-59.9	-43.3	179.2	-70.8	162.3	14.5	0	0	111.3	T198 L201 W252 W425 F492 H493 V494 V499 I500	T198-Q496 HydrophobicContact CG2-CG 3.91Å; T198-Q496 PolarHBondContact OG1-NE2 3.33Å; L201-Q496 HydrophobicContact CD2-CB 3.81Å; L201-Q496 HydrophobicContact CD2-CG 3.82Å; W252-Q496 HydrophobicContact CH2-CB 4.34Å; W252-Q496 HydrophobicContact CH2-CG 4.1Å; W252-Q496 HydrophobicContact CZ2-CG 4.27Å; W425-Q496 HydrophobicContact CH2-CB 4.11Å; F492-Q496 WeakPolarHBondContact O-CB 3.33Å; F492-Q496 WeakPolarHBondContact O-CG 3.28Å; F492-Q496 PolarHBondContact O-N 2.84Å; H493-Q496 PolarHBondContact CD2-OE1 3.36Å; H493-Q496 PolarHBondContact O-N 3.3Å; V494-Q496 PolarHBondContact O-N 2.98Å; Q496-V499 PolarHBondContact O-N 3.25Å; Q496-I500 WeakPolarHBondContact O-CB 3.48Å; Q496-I500 WeakPolarHBondContact O-CD1 3.49Å; Q496-I500 WeakPolarHBondContact O-CG1 3.41Å; Q496-I500 PolarHBondContact O-N 3.16Å
497	K	96.9	Very high	94.6	Very high	43 Å²	43	34 Å²	34	19%	0.187	17%	0.17	C	C	.	.	H	α-helix	trans	-54.8	-55.6	173	170.3	-175.8	172.8	-168.8	0	111.4	F473 H493 V494 I495 V499 I500 L501	F473-K497 HydrophobicContact CB-CD 4.11Å; F473-K497 HydrophobicContact CB-CG 4.4Å; F473-K497 HydrophobicContact CD1-CB 4.21Å; F473-K497 HydrophobicContact CD1-CD 4.14Å; F473-K497 HydrophobicContact CD1-CG 3.9Å; F473-K497 HydrophobicContact CD2-CD 4.49Å; F473-K497 HydrophobicContact CD2-CG 3.86Å; F473-K497 HydrophobicContact CE1-CB 4.01Å; F473-K497 HydrophobicContact CE1-CG 4.12Å; F473-K497 HydrophobicContact CE2-CB 4.48Å; F473-K497 HydrophobicContact CE2-CG 4.07Å; F473-K497 HydrophobicContact CG-CD 4Å; F473-K497 HydrophobicContact CG-CG 3.78Å; F473-K497 HydrophobicContact CZ-CB 4.16Å; F473-K497 HydrophobicContact CZ-CG 4.2Å; H493-K497 WeakPolarHBondContact O-CB 3.36Å; H493-K497 PolarHBondContact O-N 2.71Å; V494-K497 WeakPolarHBondContact O-CB 3.41Å; V494-K497 PolarHBondContact O-N 2.82Å; I495-K497 VanDerWaalsContact C-N 3.35Å; I495-K497 PolarHBondContact O-N 3.19Å; K497-V499 PolarHBondContact O-N 3.35Å; K497-I500 PolarHBondContact O-N 2.83Å; K497-L501 HydrophobicContact CD-CD1 4.45Å; K497-L501 HydrophobicContact CG-CD1 3.82Å; K497-L501 HydrophobicContact CG-CG 4.48Å; K497-L501 WeakPolarHBondContact O-CG 3.31Å; K497-L501 PolarHBondContact O-N 3.19Å
498	F	96.9	Very high	94.8	Very high	22 Å²	22	32.5 Å²	32.5	10%	0.096	16%	0.163	C	C	.	.	H	α-helix	trans	-66	-37	-178	-77.9	-74.4	0	0	0	112.6	V494 I495 I500 L501 G502 D503 L507 E510	V494-F498 HydrophobicContact CG1-CD2 3.81Å; V494-F498 HydrophobicContact CG1-CE2 3.7Å; V494-F498 VanDerWaalsContact O-CD2 3.29Å; V494-F498 WeakPolarHBondContact O-CD2 3.47Å; V494-F498 PolarHBondContact O-N 3.11Å; V494-F498 VanDerWaalsContact O-N 3.08Å; I495-F498 PolarHBondContact O-N 2.68Å; F498-I500 VanDerWaalsContact C-N 3.34Å; F498-I500 PolarHBondContact O-N 2.86Å; F498-L501 PolarHBondContact O-N 3.18Å; F498-G502 PolarHBondContact O-N 3.36Å; F498-D503 HydrophobicContact CD1-CB 4.01Å; F498-D503 WeakPolarHBondContact CD1-O 3.41Å; F498-D503 WeakPolarHBondContact CE1-OD2 3.39Å; F498-D503 PolarHBondContact O-N 2.76Å; F498-L507 HydrophobicContact CB-CB 3.86Å; F498-L507 HydrophobicContact CB-CD1 4.15Å; F498-L507 HydrophobicContact CB-CD2 4.47Å; F498-L507 HydrophobicContact CB-CG 4.38Å; F498-L507 HydrophobicContact CD2-CD1 4.36Å; F498-L507 HydrophobicContact CG-CB 4.12Å; F498-E510 HydrophobicContact CD2-CG 4.48Å; F498-E510 HydrophobicContact CE2-CG 3.68Å; F498-E510 HydrophobicContact CZ-CG 4.18Å
499	V	96.4	Very high	94.9	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-59.9	-42.1	172.3	161.6	0	0	0	0	111.7	L201 I202 L205 Y206 R209 I495 Q496 K497 G502 F536	L201-V499 HydrophobicContact CD2-CG1 4.07Å; L201-V499 HydrophobicContact CG-CG1 4.04Å; I202-V499 HydrophobicContact CG1-CG1 3.92Å; I202-V499 HydrophobicContact CG1-CG2 4.11Å; L205-V499 HydrophobicContact CD1-CG1 4.16Å; Y206-V499 HydrophobicContact CE2-CG1 4.32Å; R209-V499 PolarHBondContact NH1-O 2.82Å; I495-V499 HydrophobicContact CG2-CG2 4.12Å; I495-V499 WeakPolarHBondContact O-CB 3.35Å; I495-V499 VanDerWaalsContact O-CG2 3.3Å; I495-V499 WeakPolarHBondContact O-CG2 3.41Å; I495-V499 PolarHBondContact O-N 3.34Å; Q496-V499 PolarHBondContact O-N 3.25Å; K497-V499 PolarHBondContact O-N 3.35Å; V499-G502 PolarHBondContact O-N 2.91Å; V499-F536 HydrophobicContact CG2-CZ 4.47Å
500	I	96.9	Very high	95.1	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.005	16%	0.162	C	C	.	.	H	α-helix	trans	-64.7	-52.5	176.2	-71.8	164.7	0	0	0	110.4	L201 L205 R209 V249 W252 F433 M469 F473 Q496 K497 F498 G502	L201-I500 HydrophobicContact CD1-CD1 4.45Å; L201-I500 HydrophobicContact CD1-CG1 4.09Å; L201-I500 HydrophobicContact CD2-CD1 4.12Å; L201-I500 HydrophobicContact CD2-CG1 4.01Å; L205-I500 HydrophobicContact CD1-CG1 4.04Å; R209-I500 PolarHBondContact NH2-O 3.2Å; V249-I500 HydrophobicContact CG1-CD1 3.97Å; V249-I500 HydrophobicContact CG2-CB 4.49Å; V249-I500 HydrophobicContact CG2-CD1 3.98Å; V249-I500 HydrophobicContact CG2-CG1 3.74Å; V249-I500 HydrophobicContact CG2-CG2 4.01Å; W252-I500 HydrophobicContact CZ3-CD1 4.23Å; F433-I500 HydrophobicContact CE1-CG2 4.21Å; F433-I500 HydrophobicContact CZ-CG2 3.66Å; M469-I500 HydrophobicContact SD-CG2 3.89Å; F473-I500 HydrophobicContact CE2-CB 4.31Å; F473-I500 HydrophobicContact CE2-CG2 3.94Å; F473-I500 HydrophobicContact CZ-CB 4.38Å; F473-I500 HydrophobicContact CZ-CD1 4.01Å; F473-I500 HydrophobicContact CZ-CG2 4.25Å; Q496-I500 WeakPolarHBondContact O-CB 3.48Å; Q496-I500 WeakPolarHBondContact O-CD1 3.49Å; Q496-I500 WeakPolarHBondContact O-CG1 3.41Å; Q496-I500 PolarHBondContact O-N 3.16Å; K497-I500 PolarHBondContact O-N 2.83Å; F498-I500 VanDerWaalsContact C-N 3.34Å; F498-I500 PolarHBondContact O-N 2.86Å; I500-G502 PolarHBondContact O-N 2.91Å
501	L	95.8	Very high	95.3	Very high	39 Å²	39	28.1 Å²	28.1	20%	0.204	15%	0.15	C	C	.	.	H	α-helix	trans	-62.3	-24.5	178.8	-65.7	174.1	0	0	0	113.5	M469 E470 F473 K497 F498 D503	M469-L501 HydrophobicContact CB-CD2 3.67Å; E470-L501 HydrophobicContact CB-CD2 4.4Å; E470-L501 HydrophobicContact CG-CD2 3.99Å; F473-L501 HydrophobicContact CD2-CD1 4.24Å; F473-L501 HydrophobicContact CD2-CD2 4.02Å; F473-L501 HydrophobicContact CD2-CG 4.14Å; F473-L501 HydrophobicContact CE2-CD2 4.27Å; F473-L501 HydrophobicContact CE2-CG 4.22Å; K497-L501 HydrophobicContact CD-CD1 4.45Å; K497-L501 HydrophobicContact CG-CD1 3.82Å; K497-L501 HydrophobicContact CG-CG 4.48Å; K497-L501 WeakPolarHBondContact O-CG 3.31Å; K497-L501 PolarHBondContact O-N 3.19Å; F498-L501 PolarHBondContact O-N 3.18Å; L501-D503 PolarHBondContact O-N 3.33Å
502	G	93.3	Very high	95.3	Very high	33 Å²	33	27.1 Å²	27.1	34%	0.34	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.7	1.7	-174.2	0	0	0	0	0	114	F498 V499 I500 L504	F498-G502 PolarHBondContact O-N 3.36Å; V499-G502 PolarHBondContact O-N 2.91Å; I500-G502 PolarHBondContact O-N 2.91Å; G502-L504 PolarHBondContact O-N 3.08Å
503	D	94.4	Very high	95.2	Very high	67 Å²	67	32 Å²	32	36%	0.358	18%	0.176	S	C	.	.			trans	-76.8	89.8	175.3	176	19.4	0	0	0	110.8	F498 L501 D505 G506 L507	F498-D503 HydrophobicContact CD1-CB 4.01Å; F498-D503 WeakPolarHBondContact CD1-O 3.41Å; F498-D503 WeakPolarHBondContact CE1-OD2 3.39Å; F498-D503 PolarHBondContact O-N 2.76Å; L501-D503 PolarHBondContact O-N 3.33Å; D503-D505 VanDerWaalsContact C-N 3.35Å; D503-D505 PolarHBondContact OD1-N 3.02Å; D503-D505 VanDerWaalsContact OD1-N 3.12Å; D503-G506 PolarHBondContact OD1-N 3.05Å; D503-L507 PolarHBondContact O-N 3.28Å
504	L	93.4	Very high	95.2	Very high	22 Å²	22	33.2 Å²	33.2	12%	0.115	18%	0.18	C	C	.	.	H	α-helix	trans	-76.2	-23.6	174.1	-64.8	179.2	0	0	0	112.7	G502 L507 M508 F536 L541 L543	G502-L504 PolarHBondContact O-N 3.08Å; L504-L507 HydrophobicContact CD2-CD2 4.31Å; L504-L507 PolarHBondContact O-N 2.98Å; L504-M508 WeakPolarHBondContact O-CG 3.46Å; L504-M508 PolarHBondContact O-N 3.45Å; L504-F536 HydrophobicContact CD2-CD1 4.47Å; L504-F536 HydrophobicContact CD2-CD2 4.04Å; L504-F536 HydrophobicContact CD2-CE1 3.97Å; L504-F536 HydrophobicContact CD2-CE2 3.46Å; L504-F536 VanDerWaalsContact CD2-CE2 3.46Å; L504-F536 HydrophobicContact CD2-CZ 3.43Å; L504-F536 VanDerWaalsContact CD2-CZ 3.43Å; L504-L541 HydrophobicContact CD1-CB 4.4Å; L504-L541 HydrophobicContact CD1-CD1 3.98Å; L504-L543 HydrophobicContact CB-CD2 4.05Å; L504-L543 HydrophobicContact CD1-CD2 4.02Å
505	D	92.9	Very high	95	Very high	83 Å²	83	34.8 Å²	34.8	44%	0.444	19%	0.188	S	C	.	.	H	α-helix	trans	-75.2	-40.1	-177.4	-91.8	-28.5	0	0	0	111.3	D503 M508 E509 K544	D503-D505 VanDerWaalsContact C-N 3.35Å; D503-D505 PolarHBondContact OD1-N 3.02Å; D503-D505 VanDerWaalsContact OD1-N 3.12Å; D505-M508 PolarHBondContact O-N 3.41Å; D505-E509 PolarHBondContact O-N 3.12Å; D505-K544 PolarHBondContact O-NZ 3.32Å; D505-K544 WeakPolarHBondContact OD1-CE 3.21Å; D505-K544 WeakPolarHBondContact OD1-CG 3.33Å; D505-K544 IonicContact OD1-NZ 3.76Å
506	G	94.3	Very high	94.7	Very high	11 Å²	11	40.2 Å²	40.2	11%	0.113	22%	0.221	C	C	.	.	H	α-helix	trans	-67.1	-36.4	169.8	0	0	0	0	0	112.7	D503 M508 E509 E510	D503-G506 PolarHBondContact OD1-N 3.05Å; G506-M508 VanDerWaalsContact C-N 3.33Å; G506-M508 PolarHBondContact O-N 2.77Å; G506-E509 PolarHBondContact O-N 2.76Å; G506-E509 VanDerWaalsContact O-N 3.14Å; G506-E510 PolarHBondContact O-N 3.46Å
507	L	95.7	Very high	94.4	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-62.1	-38.9	174.3	-176.4	57.2	0	0	0	112.7	I495 F498 D503 L504 E509 F511 L532 F536	I495-L507 HydrophobicContact CB-CD1 4.42Å; I495-L507 HydrophobicContact CG1-CD1 4.02Å; F498-L507 HydrophobicContact CB-CB 3.86Å; F498-L507 HydrophobicContact CB-CD1 4.15Å; F498-L507 HydrophobicContact CB-CD2 4.47Å; F498-L507 HydrophobicContact CB-CG 4.38Å; F498-L507 HydrophobicContact CD2-CD1 4.36Å; F498-L507 HydrophobicContact CG-CB 4.12Å; D503-L507 PolarHBondContact O-N 3.28Å; L504-L507 HydrophobicContact CD2-CD2 4.31Å; L504-L507 PolarHBondContact O-N 2.98Å; L507-E509 VanDerWaalsContact C-N 3.33Å; L507-F511 HydrophobicContact CD1-CD1 4.14Å; L507-F511 HydrophobicContact CD1-CE1 3.57Å; L507-F511 HydrophobicContact CD1-CZ 3.93Å; L507-F511 HydrophobicContact CG-CE1 4.17Å; L507-F511 HydrophobicContact CG-CZ 4.14Å; L507-F511 WeakPolarHBondContact O-CD1 3.25Å; L507-F511 WeakPolarHBondContact O-CG 3.25Å; L507-F511 PolarHBondContact O-N 3.26Å; L507-F511 VanDerWaalsContact O-N 3.09Å; L507-L532 HydrophobicContact CD2-CD2 4.31Å; L507-F536 HydrophobicContact CD2-CE2 4.08Å; L507-F536 HydrophobicContact CD2-CZ 4.48Å
508	M	95.6	Very high	93.3	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-70	-29.4	175.1	-68.5	-56.2	97.8	0	0	112.5	L504 D505 G506 F511 S512 V533 K544 A547	L504-M508 WeakPolarHBondContact O-CG 3.46Å; L504-M508 PolarHBondContact O-N 3.45Å; D505-M508 PolarHBondContact O-N 3.41Å; G506-M508 VanDerWaalsContact C-N 3.33Å; G506-M508 PolarHBondContact O-N 2.77Å; M508-F511 HydrophobicContact CE-CD2 3.63Å; M508-F511 HydrophobicContact CE-CE2 3.78Å; M508-F511 HydrophobicContact CE-CG 4.44Å; M508-F511 PolarHBondContact O-N 3.37Å; M508-F511 HydrophobicContact SD-CD2 4.36Å; M508-S512 PolarHBondContact O-N 3.18Å; M508-S512 VanDerWaalsContact O-N 3.11Å; M508-S512 PolarHBondContact O-OG 2.85Å; M508-V533 HydrophobicContact CE-CG2 4.23Å; M508-V533 HydrophobicContact SD-CG2 4.21Å; M508-K544 HydrophobicContact CB-CB 4.08Å; M508-K544 HydrophobicContact CB-CD 4.13Å; M508-K544 HydrophobicContact CG-CB 4.31Å; M508-A547 HydrophobicContact CB-CB 4.01Å; M508-A547 HydrophobicContact SD-CB 4.49Å
509	E	94.5	Very high	92.5	Very high	115 Å²	115	51.6 Å²	51.6	54%	0.537	30%	0.297	S	S	.	.	H	α-helix	trans	-69.8	-46.5	174.1	-78.3	173.5	-168.6	0	0	111.7	D505 G506 L507 F511 S512 D513 K544	D505-E509 PolarHBondContact O-N 3.12Å; G506-E509 PolarHBondContact O-N 2.76Å; G506-E509 VanDerWaalsContact O-N 3.14Å; L507-E509 VanDerWaalsContact C-N 3.33Å; E509-F511 VanDerWaalsContact C-N 3.28Å; E509-F511 PolarHBondContact O-N 3.07Å; E509-S512 PolarHBondContact O-N 3.21Å; E509-S512 VanDerWaalsContact O-N 3.08Å; E509-D513 PolarHBondContact O-N 3Å; E509-K544 VanDerWaalsContact CD-NZ 3.28Å; E509-K544 IonicContact OE1-NZ 3.03Å; E509-K544 PolarHBondContact OE1-NZ 2.88Å
510	E	94.9	Very high	91.5	Very high	65 Å²	65	56.9 Å²	56.9	30%	0.304	33%	0.331	S	S	.	.	H	α-helix	trans	-54.4	-44.8	170.5	-72.1	-81.5	178.3	0	0	111	V494 F498 G506 S512 D513 W514	V494-E510 HydrophobicContact CG1-CG 4.08Å; F498-E510 HydrophobicContact CD2-CG 4.48Å; F498-E510 HydrophobicContact CE2-CG 3.68Å; F498-E510 HydrophobicContact CZ-CG 4.18Å; G506-E510 PolarHBondContact O-N 3.46Å; E510-S512 VanDerWaalsContact C-N 3.31Å; E510-S512 PolarHBondContact O-N 3.14Å; E510-D513 PolarHBondContact O-N 3.3Å; E510-W514 HydrophobicContact CB-CZ2 4.06Å; E510-W514 VanDerWaalsContact O-CB 3.3Å; E510-W514 WeakPolarHBondContact O-CB 3.48Å; E510-W514 PolarHBondContact O-N 3.37Å; E510-W514 PolarHBondContact O-NE1 3.32Å; E510-W514 PolarHBondContact OE2-NE1 3.27Å
511	F	95.3	Very high	90.9	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-61	-37.1	177.5	-75.4	8.5	0	0	0	113	I495 L507 M508 E509 W514 L515 M529 L532 V533 V551	I495-F511 HydrophobicContact CD1-CE1 4.17Å; I495-F511 HydrophobicContact CD1-CZ 4.39Å; I495-F511 HydrophobicContact CG1-CE1 3.92Å; I495-F511 HydrophobicContact CG1-CZ 4.29Å; L507-F511 HydrophobicContact CD1-CD1 4.14Å; L507-F511 HydrophobicContact CD1-CE1 3.57Å; L507-F511 HydrophobicContact CD1-CZ 3.93Å; L507-F511 HydrophobicContact CG-CE1 4.17Å; L507-F511 HydrophobicContact CG-CZ 4.14Å; L507-F511 WeakPolarHBondContact O-CD1 3.25Å; L507-F511 WeakPolarHBondContact O-CG 3.25Å; L507-F511 PolarHBondContact O-N 3.26Å; L507-F511 VanDerWaalsContact O-N 3.09Å; M508-F511 HydrophobicContact CE-CD2 3.63Å; M508-F511 HydrophobicContact CE-CE2 3.78Å; M508-F511 HydrophobicContact CE-CG 4.44Å; M508-F511 PolarHBondContact O-N 3.37Å; M508-F511 HydrophobicContact SD-CD2 4.36Å; E509-F511 VanDerWaalsContact C-N 3.28Å; E509-F511 PolarHBondContact O-N 3.07Å; F511-W514 AromaticContact CD1-CE3 3.91Å; F511-W514 HydrophobicContact CD1-CE3 3.91Å; F511-W514 HydrophobicContact CD1-CH2 4.46Å; F511-W514 AromaticContact CD1-CZ3 3.82Å; F511-W514 HydrophobicContact CD1-CZ3 3.82Å; F511-W514 HydrophobicContact CE1-CE3 4.23Å; F511-W514 HydrophobicContact CE1-CH2 4.27Å; F511-W514 AromaticContact CE1-CZ3 3.69Å; F511-W514 HydrophobicContact CE1-CZ3 3.69Å; F511-L515 WeakPolarHBondContact O-CB 3.38Å; F511-L515 WeakPolarHBondContact O-CD1 3.25Å; F511-L515 WeakPolarHBondContact O-CG 3.29Å; F511-L515 PolarHBondContact O-N 3.5Å; F511-L515 VanDerWaalsContact O-N 3.07Å; F511-M529 HydrophobicContact CB-CE 3.86Å; F511-M529 HydrophobicContact CD1-CE 3.82Å; F511-M529 HydrophobicContact CD1-CG 4.37Å; F511-M529 HydrophobicContact CD2-CB 4.35Å; F511-M529 HydrophobicContact CD2-CE 4Å; F511-M529 HydrophobicContact CD2-CG 4.36Å; F511-M529 HydrophobicContact CE1-CE 4.33Å; F511-M529 HydrophobicContact CE1-CG 3.94Å; F511-M529 HydrophobicContact CE2-CB 3.89Å; F511-M529 HydrophobicContact CE2-CE 4.5Å; F511-M529 HydrophobicContact CE2-CG 3.93Å; F511-M529 HydrophobicContact CG-CE 3.62Å; F511-M529 HydrophobicContact CZ-CB 4.13Å; F511-M529 HydrophobicContact CZ-CG 3.7Å; F511-L532 HydrophobicContact CZ-CD2 4.27Å; F511-V533 HydrophobicContact CE2-CG2 4.41Å; F511-V551 HydrophobicContact CB-CG2 4.26Å; F511-V551 HydrophobicContact CD2-CG2 4.08Å
512	S	94	Very high	90.2	Very high	39 Å²	39	57.7 Å²	57.7	27%	0.273	34%	0.337	S	S	.	.	H	α-helix	trans	-69.7	-41.3	174.1	-76.2	0	0	0	0	113.1	M508 E509 E510 L515 T516	M508-S512 PolarHBondContact O-N 3.18Å; M508-S512 VanDerWaalsContact O-N 3.11Å; M508-S512 PolarHBondContact O-OG 2.85Å; E509-S512 PolarHBondContact O-N 3.21Å; E509-S512 VanDerWaalsContact O-N 3.08Å; E510-S512 VanDerWaalsContact C-N 3.31Å; E510-S512 PolarHBondContact O-N 3.14Å; S512-L515 PolarHBondContact O-N 3.4Å; S512-T516 WeakPolarHBondContact O-CG2 3.31Å; S512-T516 PolarHBondContact O-N 3.07Å; S512-T516 PolarHBondContact O-OG1 2.59Å
513	D	93.4	Very high	89.9	Confident	112 Å²	112	59 Å²	59	60%	0.599	34%	0.336	S	S	*	.	H	α-helix	trans	-65.3	-39.7	175.8	-85.2	6	0	0	0	111.3	E509 E510 L515 T516 A517	E509-D513 PolarHBondContact O-N 3Å; E510-D513 PolarHBondContact O-N 3.3Å; D513-L515 VanDerWaalsContact C-N 3.35Å; D513-L515 PolarHBondContact O-N 3.48Å; D513-T516 PolarHBondContact O-N 3.37Å; D513-T516 PolarHBondContact O-OG1 3.4Å; D513-A517 PolarHBondContact O-N 2.79Å
514	W	94.4	Very high	89.5	Confident	29 Å²	29	57.2 Å²	57.2	11%	0.11	33%	0.325	C	S	.	.	H	α-helix	trans	-66.9	-34.2	176.2	-64.5	6.7	0	0	0	112.6	H491 V494 I495 E510 F511 L521 L525 M529	H491-W514 HydrophobicContact CB-CH2 3.81Å; H491-W514 HydrophobicContact CB-CZ2 4.44Å; H491-W514 HydrophobicContact CB-CZ3 3.91Å; H491-W514 AromaticContact CD2-CD2 3.88Å; H491-W514 AromaticContact CD2-CE3 3.84Å; H491-W514 AromaticContact CD2-CZ3 3.98Å; H491-W514 WeakPolarHBondContact O-CH2 3.27Å; V494-W514 HydrophobicContact CB-CH2 4.25Å; V494-W514 HydrophobicContact CB-CZ2 3.99Å; V494-W514 HydrophobicContact CG1-CH2 4.34Å; V494-W514 HydrophobicContact CG1-CZ2 3.84Å; I495-W514 HydrophobicContact CD1-CH2 4.26Å; I495-W514 HydrophobicContact CD1-CZ3 4.12Å; I495-W514 HydrophobicContact CG1-CH2 3.99Å; I495-W514 HydrophobicContact CG1-CZ3 4.25Å; E510-W514 HydrophobicContact CB-CZ2 4.06Å; E510-W514 VanDerWaalsContact O-CB 3.3Å; E510-W514 WeakPolarHBondContact O-CB 3.48Å; E510-W514 PolarHBondContact O-N 3.37Å; E510-W514 PolarHBondContact O-NE1 3.32Å; E510-W514 PolarHBondContact OE2-NE1 3.27Å; F511-W514 AromaticContact CD1-CE3 3.91Å; F511-W514 HydrophobicContact CD1-CE3 3.91Å; F511-W514 HydrophobicContact CD1-CH2 4.46Å; F511-W514 AromaticContact CD1-CZ3 3.82Å; F511-W514 HydrophobicContact CD1-CZ3 3.82Å; F511-W514 HydrophobicContact CE1-CE3 4.23Å; F511-W514 HydrophobicContact CE1-CH2 4.27Å; F511-W514 AromaticContact CE1-CZ3 3.69Å; F511-W514 HydrophobicContact CE1-CZ3 3.69Å; W514-L521 HydrophobicContact CB-CD1 4.19Å; W514-L521 HydrophobicContact CB-CD2 3.88Å; W514-L525 HydrophobicContact CE3-CD2 4.31Å; W514-L525 HydrophobicContact CZ3-CD2 4.35Å; W514-M529 HydrophobicContact CE3-CE 4.29Å; W514-M529 HydrophobicContact CE3-SD 4.36Å
515	L	92.4	Very high	89.3	Confident	49 Å²	49	56.5 Å²	56.5	26%	0.257	32%	0.322	S	S	.	.	H	α-helix	trans	-75	-26.2	175.2	-77.6	169.1	0	0	0	113.5	F511 S512 D513 L521 L526 D550 V551 A554	F511-L515 WeakPolarHBondContact O-CB 3.38Å; F511-L515 WeakPolarHBondContact O-CD1 3.25Å; F511-L515 WeakPolarHBondContact O-CG 3.29Å; F511-L515 PolarHBondContact O-N 3.5Å; F511-L515 VanDerWaalsContact O-N 3.07Å; S512-L515 PolarHBondContact O-N 3.4Å; D513-L515 VanDerWaalsContact C-N 3.35Å; D513-L515 PolarHBondContact O-N 3.48Å; L515-L521 HydrophobicContact CD2-CD1 3.91Å; L515-L521 HydrophobicContact CG-CD1 4.24Å; L515-L526 HydrophobicContact CD2-CD1 4.16Å; L515-D550 HydrophobicContact CD1-CB 4.29Å; L515-V551 HydrophobicContact CD1-CB 4.44Å; L515-V551 HydrophobicContact CD1-CG2 3.75Å; L515-A554 HydrophobicContact CD2-CB 3.48Å; L515-A554 VanDerWaalsContact CD2-CB 3.48Å
516	T	90.7	Very high	89.3	Confident	114 Å²	114	53 Å²	53	70%	0.699	30%	0.303	S	S	*	.	H	α-helix	trans	-94	-7.5	177.9	54.8	0	0	0	0	113.5	S512 D513	S512-T516 WeakPolarHBondContact O-CG2 3.31Å; S512-T516 PolarHBondContact O-N 3.07Å; S512-T516 PolarHBondContact O-OG1 2.59Å; D513-T516 PolarHBondContact O-N 3.37Å; D513-T516 PolarHBondContact O-OG1 3.4Å
517	A	89.4	Confident	89.3	Confident	54 Å²	54	52.5 Å²	52.5	45%	0.446	30%	0.298	S	S	.	.	S	Bend	trans	-60.2	150.8	174.8	0	0	0	0	0	113.1	D513 K519	D513-A517 PolarHBondContact O-N 2.79Å; A517-K519 VanDerWaalsContact C-N 3.28Å; A517-K519 PolarHBondContact O-N 3.48Å
518	S	75.3	Confident	89.3	Confident	130 Å²	130	52.5 Å²	52.5	91%	0.909	30%	0.298	S	S	*	.	S	Bend	trans	-76.5	-10.4	-178.7	58.6	0	0	0	0	114.8
519	K	78.8	Confident	89.3	Confident	121 Å²	121	52.5 Å²	52.5	53%	0.526	30%	0.298	S	S	.	.	S	Bend	trans	-96.1	130.6	170.9	-70.7	-172	175.3	-173.2	0	109	N97 A517	N97-K519 VanDerWaalsContact CG-NZ 3.28Å; N97-K519 PolarHBondContact ND2-NZ 3.4Å; N97-K519 PolarHBondContact OD1-NZ 2.95Å; A517-K519 VanDerWaalsContact C-N 3.28Å; A517-K519 PolarHBondContact O-N 3.48Å
520	P	76.6	Confident	89.3	Confident	111 Å²	111	47 Å²	47	72%	0.721	27%	0.272	S	S	*	.	P	Polyproline II helix	trans	-66.8	140	175.7	29.3	-34.6	0	0	0	110.9
521	L	83.7	Confident	89.4	Confident	30 Å²	30	44 Å²	44	16%	0.157	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-68.8	146.3	-179.4	-67.4	171.5	0	0	0	112.6	W514 L515 L523 L525 L526 M529	W514-L521 HydrophobicContact CB-CD1 4.19Å; W514-L521 HydrophobicContact CB-CD2 3.88Å; L515-L521 HydrophobicContact CD2-CD1 3.91Å; L515-L521 HydrophobicContact CG-CD1 4.24Å; L521-L523 PolarHBondContact O-N 3.47Å; L521-L525 HydrophobicContact CD2-CD2 4.2Å; L521-L526 HydrophobicContact CD1-CD1 4.48Å; L521-M529 HydrophobicContact CD1-CE 4.07Å; L521-M529 HydrophobicContact CD1-SD 4.07Å
522	P	82.4	Confident	89.4	Confident	27 Å²	27	44 Å²	44	18%	0.175	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-57.1	135.9	172.3	-23.3	33	0	0	0	111.8	H524 L525 L526	P522-H524 PolarHBondContact O-N 3.42Å; P522-H524 VanDerWaalsContact O-N 3.17Å; P522-L525 HydrophobicContact CB-CB 4.09Å; P522-L525 HydrophobicContact CG-CB 4.41Å; P522-L525 WeakPolarHBondContact O-CB 3.21Å; P522-L525 PolarHBondContact O-N 3.46Å; P522-L526 PolarHBondContact O-N 3.45Å
523	L	86.1	Confident	89.5	Confident	60 Å²	60	42.1 Å²	42.1	31%	0.314	25%	0.245	S	C	.	.	H	α-helix	trans	-58.1	-37.8	-172.2	-46.1	-179.3	0	0	0	112.5	F139 L521 R527 L558 R561	F139-L523 HydrophobicContact CZ-CB 3.95Å; L521-L523 PolarHBondContact O-N 3.47Å; L523-R527 PolarHBondContact O-N 3.32Å; L523-L558 HydrophobicContact CB-CD1 4.07Å; L523-L558 HydrophobicContact CD2-CD1 3.6Å; L523-L558 HydrophobicContact CD2-CG 4.01Å; L523-L558 HydrophobicContact CG-CD1 4.43Å; L523-R561 VanDerWaalsContact CD2-NH2 3.29Å
524	H	85.3	Confident	89.5	Confident	29 Å²	29	37 Å²	37	13%	0.134	22%	0.218	C	C	.	.	H	α-helix	trans	-74.7	-32.3	179	-43.3	-46.9	0	0	0	112.6	A135 F139 P522 R527 F528	A135-H524 WeakPolarHBondContact CB-CE1 3.4Å; A135-H524 WeakPolarHBondContact CB-NE2 3.3Å; F139-H524 AromaticContact CE2-CE1 3.98Å; F139-H524 AromaticContact CE2-ND1 3.59Å; F139-H524 AromaticContact CZ-ND1 3.99Å; P522-H524 PolarHBondContact O-N 3.42Å; P522-H524 VanDerWaalsContact O-N 3.17Å; H524-R527 PolarHBondContact ND1-NH1 2.86Å; H524-R527 PolarHBondContact O-N 2.89Å; H524-F528 WeakPolarHBondContact O-CB 3.48Å; H524-F528 PolarHBondContact O-N 3.4Å
525	L	90.5	Very high	89.4	Confident	8 Å²	8	35.8 Å²	35.8	4%	0.042	21%	0.213	C	C	.	.	H	α-helix	trans	-65.1	-44.6	172.8	-178.3	65.2	0	0	0	109.8	H491 I495 W514 L521 P522 R527 F528 M529	H491-L525 HydrophobicContact CB-CD1 3.95Å; H491-L525 HydrophobicContact CB-CD2 3.68Å; H491-L525 HydrophobicContact CB-CG 4.49Å; H491-L525 VanDerWaalsContact CD2-CD2 3.48Å; H491-L525 WeakPolarHBondContact CD2-CD2 3.39Å; I495-L525 HydrophobicContact CD1-CD1 4.05Å; W514-L525 HydrophobicContact CE3-CD2 4.31Å; W514-L525 HydrophobicContact CZ3-CD2 4.35Å; L521-L525 HydrophobicContact CD2-CD2 4.2Å; P522-L525 HydrophobicContact CB-CB 4.09Å; P522-L525 HydrophobicContact CG-CB 4.41Å; P522-L525 WeakPolarHBondContact O-CB 3.21Å; P522-L525 PolarHBondContact O-N 3.46Å; L525-R527 PolarHBondContact O-N 3.08Å; L525-F528 WeakPolarHBondContact O-CB 3.28Å; L525-F528 PolarHBondContact O-N 3.3Å; L525-F528 VanDerWaalsContact O-N 3.12Å; L525-M529 HydrophobicContact CD1-CG 4.42Å; L525-M529 HydrophobicContact CD2-SD 4.38Å; L525-M529 HydrophobicContact CG-CG 4.31Å; L525-M529 HydrophobicContact CG-SD 3.87Å; L525-M529 WeakPolarHBondContact O-CB 3.22Å; L525-M529 WeakPolarHBondContact O-CG 3.39Å; L525-M529 PolarHBondContact O-N 3.22Å
526	L	92.5	Very high	89.4	Confident	10 Å²	10	33.4 Å²	33.4	5%	0.052	20%	0.201	C	C	.	.	H	α-helix	trans	-68.4	-33	178.3	-167.7	57.7	0	0	0	112.7	L515 L521 P522 M529 T530 V551 A554 Y555 L558	L515-L526 HydrophobicContact CD2-CD1 4.16Å; L521-L526 HydrophobicContact CD1-CD1 4.48Å; P522-L526 PolarHBondContact O-N 3.45Å; L526-M529 HydrophobicContact CD1-CE 4.37Å; L526-M529 HydrophobicContact CD1-SD 4.13Å; L526-T530 WeakPolarHBondContact O-CB 3.46Å; L526-T530 PolarHBondContact O-N 3.07Å; L526-T530 VanDerWaalsContact O-N 3.09Å; L526-T530 PolarHBondContact O-OG1 3.04Å; L526-V551 HydrophobicContact CD1-CG1 4.33Å; L526-A554 HydrophobicContact CD1-CB 4.34Å; L526-A554 HydrophobicContact CD2-CB 4Å; L526-Y555 HydrophobicContact CG-CD2 4.13Å; L526-L558 HydrophobicContact CB-CD1 4.35Å; L526-L558 HydrophobicContact CD2-CB 4.5Å; L526-L558 HydrophobicContact CD2-CD1 3.88Å
527	R	93.8	Very high	89.5	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-59.2	-49.1	166.5	-173.1	-170.9	76.3	-120.3	-7.3	111	F139 E195 L523 H524 L525 T530 H531 Y555	F139-R527 HydrophobicContact CD1-CG 4.46Å; F139-R527 HydrophobicContact CE1-CB 4.14Å; F139-R527 HydrophobicContact CE1-CG 4.48Å; F139-R527 HydrophobicContact CZ-CB 4.34Å; E195-R527 IonicContact OE1-CZ 2.64Å; E195-R527 IonicContact OE1-NE 3.56Å; E195-R527 IonicContact OE1-NH2 2.62Å; E195-R527 PolarHBondContact OE1-NH2 2.95Å; E195-R527 IonicContact OE2-CZ 3.01Å; E195-R527 IonicContact OE2-NH2 3.73Å; E195-R527 PolarHBondContact OE2-NH2 3.27Å; L523-R527 PolarHBondContact O-N 3.32Å; H524-R527 PolarHBondContact ND1-NH1 2.86Å; H524-R527 PolarHBondContact O-N 2.89Å; L525-R527 PolarHBondContact O-N 3.08Å; R527-T530 PolarHBondContact O-N 2.98Å; R527-H531 PolarHBondContact O-N 2.89Å; R527-H531 VanDerWaalsContact O-N 3.07Å; R527-H531 PolarHBondContact O-ND1 3.2Å; R527-Y555 VanDerWaalsContact CA-CE2 3.48Å; R527-Y555 HydrophobicContact CB-CE2 3.79Å; R527-Y555 HydrophobicContact CG-CE2 4.17Å
528	F	95.1	Very high	89.5	Confident	0 Å²	0	30 Å²	30	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-63.2	-50	-179.3	175.7	-88.3	0	0	0	111.9	E195 T198 W199 I202 F492 I495 H524 L525 T530 H531 L532	E195-F528 HydrophobicContact CG-CD2 3.67Å; E195-F528 HydrophobicContact CG-CE2 4.2Å; T198-F528 HydrophobicContact CG2-CE1 4.4Å; T198-F528 HydrophobicContact CG2-CE2 4.28Å; T198-F528 HydrophobicContact CG2-CZ 3.6Å; W199-F528 HydrophobicContact CD2-CD2 4.32Å; W199-F528 AromaticContact CD2-CE2 3.7Å; W199-F528 HydrophobicContact CD2-CE2 3.7Å; W199-F528 AromaticContact CE2-CD2 3.49Å; W199-F528 VanDerWaalsContact CE2-CD2 3.49Å; W199-F528 AromaticContact CE2-CE2 3.34Å; W199-F528 HydrophobicContact CE3-CE2 4.15Å; W199-F528 HydrophobicContact CG-CE2 4.22Å; W199-F528 HydrophobicContact CH2-CD2 4.21Å; W199-F528 AromaticContact CH2-CE2 3.99Å; W199-F528 HydrophobicContact CH2-CE2 3.99Å; W199-F528 AromaticContact CZ2-CD2 3.43Å; W199-F528 HydrophobicContact CZ2-CD2 3.43Å; W199-F528 VanDerWaalsContact CZ2-CD2 3.43Å; W199-F528 AromaticContact CZ2-CE2 3.51Å; W199-F528 HydrophobicContact CZ2-CE2 3.51Å; W199-F528 HydrophobicContact CZ2-CG 4.38Å; W199-F528 HydrophobicContact CZ2-CZ 4.46Å; W199-F528 HydrophobicContact CZ3-CE2 4.29Å; W199-F528 AromaticContact NE1-CD2 3.57Å; W199-F528 AromaticContact NE1-CE2 3.63Å; I202-F528 HydrophobicContact CD1-CZ 4.03Å; F492-F528 HydrophobicContact CE1-CD1 4.05Å; F492-F528 HydrophobicContact CE1-CD2 4.15Å; F492-F528 HydrophobicContact CE1-CE1 4.33Å; F492-F528 HydrophobicContact CE1-CE2 4.36Å; F492-F528 AromaticContact CE1-CG 3.98Å; F492-F528 HydrophobicContact CE1-CG 3.98Å; F492-F528 HydrophobicContact CE1-CZ 4.47Å; I495-F528 HydrophobicContact CD1-CD1 4.04Å; I495-F528 HydrophobicContact CD1-CE1 3.78Å; I495-F528 HydrophobicContact CG2-CE1 4.02Å; I495-F528 HydrophobicContact CG2-CZ 4.44Å; H524-F528 WeakPolarHBondContact O-CB 3.48Å; H524-F528 PolarHBondContact O-N 3.4Å; L525-F528 WeakPolarHBondContact O-CB 3.28Å; L525-F528 PolarHBondContact O-N 3.3Å; L525-F528 VanDerWaalsContact O-N 3.12Å; F528-T530 VanDerWaalsContact C-N 3.27Å; F528-T530 PolarHBondContact O-N 3.02Å; F528-H531 PolarHBondContact O-N 3.42Å; F528-H531 VanDerWaalsContact O-N 3.17Å; F528-L532 HydrophobicContact CE1-CB 4.33Å; F528-L532 HydrophobicContact CE1-CD2 3.74Å; F528-L532 HydrophobicContact CZ-CD2 4.16Å; F528-L532 WeakPolarHBondContact O-CB 3.44Å; F528-L532 PolarHBondContact O-N 2.85Å
529	M	95.8	Very high	90.1	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-52.2	-45.7	175.3	-68.3	162	74	0	0	111.3	F511 W514 L521 L525 L526 L532 V533 V551	F511-M529 HydrophobicContact CB-CE 3.86Å; F511-M529 HydrophobicContact CD1-CE 3.82Å; F511-M529 HydrophobicContact CD1-CG 4.37Å; F511-M529 HydrophobicContact CD2-CB 4.35Å; F511-M529 HydrophobicContact CD2-CE 4Å; F511-M529 HydrophobicContact CD2-CG 4.36Å; F511-M529 HydrophobicContact CE1-CE 4.33Å; F511-M529 HydrophobicContact CE1-CG 3.94Å; F511-M529 HydrophobicContact CE2-CB 3.89Å; F511-M529 HydrophobicContact CE2-CE 4.5Å; F511-M529 HydrophobicContact CE2-CG 3.93Å; F511-M529 HydrophobicContact CG-CE 3.62Å; F511-M529 HydrophobicContact CZ-CB 4.13Å; F511-M529 HydrophobicContact CZ-CG 3.7Å; W514-M529 HydrophobicContact CE3-CE 4.29Å; W514-M529 HydrophobicContact CE3-SD 4.36Å; L521-M529 HydrophobicContact CD1-CE 4.07Å; L521-M529 HydrophobicContact CD1-SD 4.07Å; L525-M529 HydrophobicContact CD1-CG 4.42Å; L525-M529 HydrophobicContact CD2-SD 4.38Å; L525-M529 HydrophobicContact CG-CG 4.31Å; L525-M529 HydrophobicContact CG-SD 3.87Å; L525-M529 WeakPolarHBondContact O-CB 3.22Å; L525-M529 WeakPolarHBondContact O-CG 3.39Å; L525-M529 PolarHBondContact O-N 3.22Å; L526-M529 HydrophobicContact CD1-CE 4.37Å; L526-M529 HydrophobicContact CD1-SD 4.13Å; M529-L532 PolarHBondContact O-N 3.35Å; M529-V533 WeakPolarHBondContact O-CG2 3.45Å; M529-V533 PolarHBondContact O-N 3.07Å; M529-V551 HydrophobicContact CB-CG1 3.99Å; M529-V551 HydrophobicContact CE-CG2 4.19Å
530	T	95.9	Very high	90.5	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-61.3	-50.9	178	-59.6	0	0	0	0	111.7	L526 R527 F528 L532 V533 L534 L552 Y555 Y571	L526-T530 WeakPolarHBondContact O-CB 3.46Å; L526-T530 PolarHBondContact O-N 3.07Å; L526-T530 VanDerWaalsContact O-N 3.09Å; L526-T530 PolarHBondContact O-OG1 3.04Å; R527-T530 PolarHBondContact O-N 2.98Å; F528-T530 VanDerWaalsContact C-N 3.27Å; F528-T530 PolarHBondContact O-N 3.02Å; T530-L532 VanDerWaalsContact C-N 3.28Å; T530-L532 PolarHBondContact O-N 2.89Å; T530-V533 PolarHBondContact O-N 2.78Å; T530-L534 HydrophobicContact CG2-CD1 4.14Å; T530-L534 VanDerWaalsContact O-CG 3.31Å; T530-L534 WeakPolarHBondContact O-CG 3.36Å; T530-L534 PolarHBondContact O-N 2.83Å; T530-L552 HydrophobicContact CG2-CD2 3.72Å; T530-Y555 HydrophobicContact CG2-CD1 3.76Å; T530-Y555 HydrophobicContact CG2-CE1 4.18Å; T530-Y555 HydrophobicContact CG2-CG 4.23Å; T530-Y555 VanDerWaalsContact OG1-CB 3.25Å; T530-Y555 WeakPolarHBondContact OG1-CB 3.35Å; T530-Y555 VanDerWaalsContact OG1-CG 3.3Å; T530-Y571 HydrophobicContact CG2-CD1 4.05Å; T530-Y571 HydrophobicContact CG2-CE1 4.27Å
531	H	95.6	Very high	91	Very high	1 Å²	1	21 Å²	21	1%	0.005	13%	0.125	C	C	.	.	H	α-helix	trans	-69.1	-26.8	-179.5	-68.8	92.6	0	0	0	112.8	F142 Y161 W199 R527 F528 F535 Y571	F142-H531 HydrophobicContact CD1-CB 4.43Å; F142-H531 AromaticContact CD1-CG 3.89Å; F142-H531 AromaticContact CD1-ND1 3.86Å; Y161-H531 HydrophobicContact CE2-CB 4.13Å; Y161-H531 AromaticContact CZ-CD2 3.92Å; Y161-H531 PolarHBondContact OH-CD2 3.42Å; W199-H531 HydrophobicContact CH2-CB 3.96Å; W199-H531 HydrophobicContact CZ2-CB 4.06Å; R527-H531 PolarHBondContact O-N 2.89Å; R527-H531 VanDerWaalsContact O-N 3.07Å; R527-H531 PolarHBondContact O-ND1 3.2Å; F528-H531 PolarHBondContact O-N 3.42Å; F528-H531 VanDerWaalsContact O-N 3.17Å; H531-F535 VanDerWaalsContact O-CB 3.29Å; H531-F535 WeakPolarHBondContact O-CB 3.01Å; H531-F535 PolarHBondContact O-N 2.78Å; H531-Y571 AromaticContact CE1-CE1 3.83Å; H531-Y571 AromaticContact CE1-CZ 3.95Å; H531-Y571 PolarHBondContact CE1-OH 3.41Å; H531-Y571 AromaticContact NE2-CE1 3.59Å; H531-Y571 AromaticContact NE2-CZ 3.82Å; H531-Y571 PolarHBondContact NE2-OH 2.81Å; H531-Y571 VanDerWaalsContact NE2-OH 3.15Å
532	L	95.8	Very high	91.1	Very high	0 Å²	0	24 Å²	24	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-69.9	-43.7	173.6	-175.7	57.6	0	0	0	111.7	W199 I202 I495 L507 F511 F528 M529 T530 L534 F535 F536	W199-L532 HydrophobicContact CH2-CB 4.32Å; W199-L532 HydrophobicContact CZ3-CD1 4.21Å; I202-L532 HydrophobicContact CD1-CD1 3.61Å; I202-L532 HydrophobicContact CG1-CD1 4.46Å; I495-L532 HydrophobicContact CG2-CD2 3.9Å; L507-L532 HydrophobicContact CD2-CD2 4.31Å; F511-L532 HydrophobicContact CZ-CD2 4.27Å; F528-L532 HydrophobicContact CE1-CB 4.33Å; F528-L532 HydrophobicContact CE1-CD2 3.74Å; F528-L532 HydrophobicContact CZ-CD2 4.16Å; F528-L532 WeakPolarHBondContact O-CB 3.44Å; F528-L532 PolarHBondContact O-N 2.85Å; M529-L532 PolarHBondContact O-N 3.35Å; T530-L532 VanDerWaalsContact C-N 3.28Å; T530-L532 PolarHBondContact O-N 2.89Å; L532-L534 VanDerWaalsContact C-N 3.35Å; L532-F535 HydrophobicContact CD1-CD1 4.15Å; L532-F535 WeakPolarHBondContact O-CB 3.47Å; L532-F535 PolarHBondContact O-N 3.17Å; L532-F536 HydrophobicContact CD1-CD2 4.32Å; L532-F536 HydrophobicContact CD1-CE1 3.89Å; L532-F536 HydrophobicContact CD1-CE2 3.68Å; L532-F536 HydrophobicContact CD1-CZ 3.43Å; L532-F536 VanDerWaalsContact CD1-CZ 3.43Å; L532-F536 HydrophobicContact CD2-CE2 4.02Å; L532-F536 HydrophobicContact CD2-CZ 4.22Å; L532-F536 HydrophobicContact CG-CD2 4.12Å; L532-F536 HydrophobicContact CG-CE2 3.5Å; L532-F536 HydrophobicContact CG-CZ 3.79Å; L532-F536 WeakPolarHBondContact O-CD2 3.36Å; L532-F536 WeakPolarHBondContact O-CG 3.29Å; L532-F536 PolarHBondContact O-N 3.29Å
533	V	95.4	Very high	91.3	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-60.5	-43.8	171.7	166	0	0	0	0	111	M508 F511 M529 T530 F536 R537 C548	M508-V533 HydrophobicContact CE-CG2 4.23Å; M508-V533 HydrophobicContact SD-CG2 4.21Å; F511-V533 HydrophobicContact CE2-CG2 4.41Å; M529-V533 WeakPolarHBondContact O-CG2 3.45Å; M529-V533 PolarHBondContact O-N 3.07Å; T530-V533 PolarHBondContact O-N 2.78Å; V533-F536 PolarHBondContact O-N 3.41Å; V533-R537 WeakPolarHBondContact O-CB 3.26Å; V533-R537 VanDerWaalsContact O-CG 3.31Å; V533-R537 WeakPolarHBondContact O-CG 3.3Å; V533-R537 PolarHBondContact O-N 3.09Å; V533-C548 HydrophobicContact CG1-CB 3.69Å
534	L	93.4	Very high	91.5	Very high	5 Å²	5	24.4 Å²	24.4	3%	0.026	15%	0.152	C	C	.	.	H	α-helix	trans	-65.8	-37.8	176.4	-65.7	175.3	0	0	0	112.4	F146 T530 L532 S538 Y571 Q574	F146-L534 HydrophobicContact CE1-CD1 4.28Å; F146-L534 HydrophobicContact CE2-CB 3.87Å; F146-L534 HydrophobicContact CE2-CD1 4.19Å; F146-L534 HydrophobicContact CZ-CB 4.17Å; F146-L534 HydrophobicContact CZ-CD1 3.98Å; F146-L534 HydrophobicContact CZ-CD2 4.43Å; F146-L534 HydrophobicContact CZ-CG 4.42Å; T530-L534 HydrophobicContact CG2-CD1 4.14Å; T530-L534 VanDerWaalsContact O-CG 3.31Å; T530-L534 WeakPolarHBondContact O-CG 3.36Å; T530-L534 PolarHBondContact O-N 2.83Å; L532-L534 VanDerWaalsContact C-N 3.35Å; L534-S538 WeakPolarHBondContact O-CB 3.5Å; L534-S538 PolarHBondContact O-N 3.22Å; L534-S538 PolarHBondContact O-OG 2.9Å; L534-Y571 HydrophobicContact CD1-CD1 4.23Å; L534-Y571 HydrophobicContact CD1-CE1 4.34Å; L534-Q574 HydrophobicContact CD1-CG 4.47Å; L534-Q574 HydrophobicContact CD2-CB 3.8Å; L534-Q574 HydrophobicContact CD2-CG 3.64Å
535	F	93.6	Very high	91.6	Very high	2 Å²	2	27 Å²	27	1%	0.009	17%	0.165	C	C	.	.	H	α-helix	trans	-60.1	-53.1	172.6	165.1	-98.7	0	0	0	111.6	V154 L158 I202 Y206 H531 L532 R537 S538 L539	V154-F535 HydrophobicContact CG1-CD2 3.36Å; V154-F535 HydrophobicContact CG1-CE2 3.49Å; V154-F535 VanDerWaalsContact CG1-CE2 3.49Å; L158-F535 HydrophobicContact CD1-CD2 3.99Å; L158-F535 HydrophobicContact CD1-CE2 3.4Å; L158-F535 HydrophobicContact CD1-CZ 3.74Å; L158-F535 HydrophobicContact CD2-CD2 3.73Å; L158-F535 HydrophobicContact CD2-CE2 4.04Å; L158-F535 HydrophobicContact CD2-CG 4.29Å; L158-F535 HydrophobicContact CG-CD2 3.91Å; L158-F535 HydrophobicContact CG-CE2 3.74Å; I202-F535 HydrophobicContact CG2-CD1 4Å; I202-F535 HydrophobicContact CG2-CE1 3.37Å; I202-F535 HydrophobicContact CG2-CZ 3.69Å; Y206-F535 HydrophobicContact CD2-CE1 4.17Å; Y206-F535 HydrophobicContact CD2-CZ 4.49Å; Y206-F535 HydrophobicContact CG-CE1 4.07Å; Y206-F535 HydrophobicContact CG-CZ 4.11Å; H531-F535 VanDerWaalsContact O-CB 3.29Å; H531-F535 WeakPolarHBondContact O-CB 3.01Å; H531-F535 PolarHBondContact O-N 2.78Å; L532-F535 HydrophobicContact CD1-CD1 4.15Å; L532-F535 WeakPolarHBondContact O-CB 3.47Å; L532-F535 PolarHBondContact O-N 3.17Å; F535-R537 VanDerWaalsContact C-N 3.35Å; F535-R537 PolarHBondContact O-N 3.14Å; F535-S538 PolarHBondContact O-N 3.37Å; F535-S538 PolarHBondContact O-OG 3.44Å; F535-L539 HydrophobicContact CE1-CD1 3.8Å; F535-L539 HydrophobicContact CE2-CD1 4Å; F535-L539 HydrophobicContact CE2-CG 4.28Å; F535-L539 HydrophobicContact CZ-CD1 3.46Å; F535-L539 VanDerWaalsContact CZ-CD1 3.46Å; F535-L539 HydrophobicContact CZ-CG 4.22Å; F535-L539 PolarHBondContact O-N 3.04Å; F535-L539 VanDerWaalsContact O-N 3.11Å
536	F	92.8	Very high	91.6	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-61.2	-41.4	178.9	-66.7	-34.4	0	0	0	112.4	Y206 V499 L504 L507 L532 V533 S538 L539 G540 L541 L543	Y206-F536 HydrophobicContact CD2-CE1 4.41Å; Y206-F536 HydrophobicContact CE1-CD1 4.47Å; Y206-F536 HydrophobicContact CE1-CE1 4.2Å; Y206-F536 AromaticContact CE2-CE1 3.74Å; Y206-F536 HydrophobicContact CE2-CE1 3.74Å; Y206-F536 HydrophobicContact CE2-CZ 4.45Å; Y206-F536 AromaticContact CZ-CE1 3.63Å; V499-F536 HydrophobicContact CG2-CZ 4.47Å; L504-F536 HydrophobicContact CD2-CD1 4.47Å; L504-F536 HydrophobicContact CD2-CD2 4.04Å; L504-F536 HydrophobicContact CD2-CE1 3.97Å; L504-F536 HydrophobicContact CD2-CE2 3.46Å; L504-F536 VanDerWaalsContact CD2-CE2 3.46Å; L504-F536 HydrophobicContact CD2-CZ 3.43Å; L504-F536 VanDerWaalsContact CD2-CZ 3.43Å; L507-F536 HydrophobicContact CD2-CE2 4.08Å; L507-F536 HydrophobicContact CD2-CZ 4.48Å; L532-F536 HydrophobicContact CD1-CD2 4.32Å; L532-F536 HydrophobicContact CD1-CE1 3.89Å; L532-F536 HydrophobicContact CD1-CE2 3.68Å; L532-F536 HydrophobicContact CD1-CZ 3.43Å; L532-F536 VanDerWaalsContact CD1-CZ 3.43Å; L532-F536 HydrophobicContact CD2-CE2 4.02Å; L532-F536 HydrophobicContact CD2-CZ 4.22Å; L532-F536 HydrophobicContact CG-CD2 4.12Å; L532-F536 HydrophobicContact CG-CE2 3.5Å; L532-F536 HydrophobicContact CG-CZ 3.79Å; L532-F536 WeakPolarHBondContact O-CD2 3.36Å; L532-F536 WeakPolarHBondContact O-CG 3.29Å; L532-F536 PolarHBondContact O-N 3.29Å; V533-F536 PolarHBondContact O-N 3.41Å; F536-S538 VanDerWaalsContact C-N 3.33Å; F536-S538 PolarHBondContact O-N 2.95Å; F536-L539 PolarHBondContact O-N 2.86Å; F536-G540 PolarHBondContact O-N 2.98Å; F536-L541 HydrophobicContact CB-CB 4.47Å; F536-L541 HydrophobicContact CB-CD1 4.22Å; F536-L541 HydrophobicContact CD1-CD1 3.83Å; F536-L541 HydrophobicContact CG-CD1 4.34Å; F536-L541 WeakPolarHBondContact O-CB 3.3Å; F536-L541 PolarHBondContact O-N 2.74Å; F536-L541 VanDerWaalsContact O-N 3.13Å; F536-L543 HydrophobicContact CB-CD1 3.82Å; F536-L543 HydrophobicContact CB-CD2 4.23Å; F536-L543 HydrophobicContact CB-CG 4.41Å; F536-L543 HydrophobicContact CD2-CD1 4.49Å; F536-L543 HydrophobicContact CD2-CD2 4.18Å
537	R	90.9	Very high	91.6	Very high	61 Å²	61	34.3 Å²	34.3	23%	0.23	20%	0.199	C	C	.	.	H	α-helix	trans	-59.8	-40.2	171.8	-76.5	173	164.6	-159.6	-3.2	112.4	V533 F535 L539 G540 L543 E545 Q574	V533-R537 WeakPolarHBondContact O-CB 3.26Å; V533-R537 VanDerWaalsContact O-CG 3.31Å; V533-R537 WeakPolarHBondContact O-CG 3.3Å; V533-R537 PolarHBondContact O-N 3.09Å; F535-R537 VanDerWaalsContact C-N 3.35Å; F535-R537 PolarHBondContact O-N 3.14Å; R537-L539 VanDerWaalsContact C-N 3.28Å; R537-L539 PolarHBondContact O-N 3.26Å; R537-G540 PolarHBondContact O-N 2.88Å; R537-L543 HydrophobicContact CG-CD1 4.21Å; R537-E545 IonicContact CZ-OE1 2.67Å; R537-E545 IonicContact CZ-OE2 2.79Å; R537-E545 IonicContact NE-OE2 2.72Å; R537-E545 IonicContact NH2-OE1 2.75Å; R537-E545 PolarHBondContact NH2-OE1 2.97Å; R537-E545 IonicContact NH2-OE2 3.89Å; R537-E545 PolarHBondContact NH2-OE2 3.46Å; R537-Q574 PolarHBondContact NH1-O 3.22Å
538	S	89.6	Confident	91.6	Very high	35 Å²	35	34.3 Å²	34.3	25%	0.245	20%	0.199	C	C	.	.	H	α-helix	trans	-68.6	-24.7	178.8	75.6	0	0	0	0	113.7	V154 L534 F535 F536 G540	V154-S538 WeakPolarHBondContact CG1-OG 3.33Å; L534-S538 WeakPolarHBondContact O-CB 3.5Å; L534-S538 PolarHBondContact O-N 3.22Å; L534-S538 PolarHBondContact O-OG 2.9Å; F535-S538 PolarHBondContact O-N 3.37Å; F535-S538 PolarHBondContact O-OG 3.44Å; F536-S538 VanDerWaalsContact C-N 3.33Å; F536-S538 PolarHBondContact O-N 2.95Å; S538-G540 VanDerWaalsContact C-N 3.29Å
539	L	88.8	Confident	91.5	Very high	45 Å²	45	34.7 Å²	34.7	24%	0.236	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-4.2	169	-67.4	-175.6	0	0	0	113.5	V154 Y206 V210 F535 F536 R537 L541	V154-L539 HydrophobicContact CB-CD2 4.17Å; V154-L539 HydrophobicContact CG1-CD2 4.08Å; V154-L539 HydrophobicContact CG1-CG 4.39Å; V154-L539 HydrophobicContact CG2-CD2 4.26Å; Y206-L539 HydrophobicContact CD1-CD1 3.88Å; Y206-L539 HydrophobicContact CG-CD1 4.3Å; V210-L539 HydrophobicContact CG2-CD1 4.36Å; V210-L539 HydrophobicContact CG2-CD2 4.3Å; F535-L539 HydrophobicContact CE1-CD1 3.8Å; F535-L539 HydrophobicContact CE2-CD1 4Å; F535-L539 HydrophobicContact CE2-CG 4.28Å; F535-L539 HydrophobicContact CZ-CD1 3.46Å; F535-L539 VanDerWaalsContact CZ-CD1 3.46Å; F535-L539 HydrophobicContact CZ-CG 4.22Å; F535-L539 PolarHBondContact O-N 3.04Å; F535-L539 VanDerWaalsContact O-N 3.11Å; F536-L539 PolarHBondContact O-N 2.86Å; R537-L539 VanDerWaalsContact C-N 3.28Å; R537-L539 PolarHBondContact O-N 3.26Å; L539-L541 VanDerWaalsContact C-N 3.31Å; L539-L541 HydrophobicContact CB-CD1 4.18Å; L539-L541 HydrophobicContact CB-CG 3.97Å; L539-L541 HydrophobicContact CD1-CD1 4.14Å
540	G	87	Confident	91.4	Very high	66 Å²	66	37.9 Å²	37.9	68%	0.68	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.9	17.7	-176.8	0	0	0	0	0	114.5	F536 R537 S538	F536-G540 PolarHBondContact O-N 2.98Å; R537-G540 PolarHBondContact O-N 2.88Å; S538-G540 VanDerWaalsContact C-N 3.29Å
541	L	87.5	Confident	91.4	Very high	61 Å²	61	37.9 Å²	37.9	32%	0.319	22%	0.218	S	C	.	.			trans	-71.9	137.2	179.1	-60	172.9	0	0	0	110.6	Y206 L504 F536 L539	Y206-L541 HydrophobicContact CD1-CD1 4.17Å; Y206-L541 HydrophobicContact CE1-CD1 3.68Å; L504-L541 HydrophobicContact CD1-CB 4.4Å; L504-L541 HydrophobicContact CD1-CD1 3.98Å; F536-L541 HydrophobicContact CB-CB 4.47Å; F536-L541 HydrophobicContact CB-CD1 4.22Å; F536-L541 HydrophobicContact CD1-CD1 3.83Å; F536-L541 HydrophobicContact CG-CD1 4.34Å; F536-L541 WeakPolarHBondContact O-CB 3.3Å; F536-L541 PolarHBondContact O-N 2.74Å; F536-L541 VanDerWaalsContact O-N 3.13Å; L539-L541 VanDerWaalsContact C-N 3.31Å; L539-L541 HydrophobicContact CB-CD1 4.18Å; L539-L541 HydrophobicContact CB-CG 3.97Å; L539-L541 HydrophobicContact CD1-CD1 4.14Å
542	A	84.6	Confident	91.3	Very high	95 Å²	95	37.8 Å²	37.8	79%	0.785	22%	0.218	S	C	*	.			trans	-71.2	133.8	172.8	0	0	0	0	0	110.1
543	L	88	Confident	91.2	Very high	28 Å²	28	40.6 Å²	40.6	15%	0.147	23%	0.23	C	C	.	.			trans	-137.2	161.6	178.8	-59.5	172.3	0	0	0	109.5	L504 F536 R537 E545 C548	L504-L543 HydrophobicContact CB-CD2 4.05Å; L504-L543 HydrophobicContact CD1-CD2 4.02Å; F536-L543 HydrophobicContact CB-CD1 3.82Å; F536-L543 HydrophobicContact CB-CD2 4.23Å; F536-L543 HydrophobicContact CB-CG 4.41Å; F536-L543 HydrophobicContact CD2-CD1 4.49Å; F536-L543 HydrophobicContact CD2-CD2 4.18Å; R537-L543 HydrophobicContact CG-CD1 4.21Å; L543-E545 PolarHBondContact O-N 3.42Å; L543-C548 VanDerWaalsContact CB-SG 3.52Å; L543-C548 VanDerWaalsContact CD1-SG 3.55Å
544	K	89.1	Confident	91.2	Very high	66 Å²	66	41.9 Å²	41.9	29%	0.287	24%	0.241	S	C	.	.			trans	-64.7	97.1	165.5	-70.3	168.3	-174.8	162.1	0	109.7	D505 M508 E509 E546 A547 C548	D505-K544 PolarHBondContact O-NZ 3.32Å; D505-K544 WeakPolarHBondContact OD1-CE 3.21Å; D505-K544 WeakPolarHBondContact OD1-CG 3.33Å; D505-K544 IonicContact OD1-NZ 3.76Å; M508-K544 HydrophobicContact CB-CB 4.08Å; M508-K544 HydrophobicContact CB-CD 4.13Å; M508-K544 HydrophobicContact CG-CB 4.31Å; E509-K544 VanDerWaalsContact CD-NZ 3.28Å; E509-K544 IonicContact OE1-NZ 3.03Å; E509-K544 PolarHBondContact OE1-NZ 2.88Å; K544-E546 PolarHBondContact O-N 3.46Å; K544-A547 HydrophobicContact CB-CB 4.31Å; K544-A547 PolarHBondContact O-N 3.43Å; K544-C548 PolarHBondContact O-N 3.21Å; K544-C548 VanDerWaalsContact O-N 3.09Å; K544-C548 PolarHBondContact O-SG 3.4Å
545	E	88.5	Confident	91.2	Very high	85 Å²	85	41.7 Å²	41.7	40%	0.397	24%	0.24	S	C	.	.	H	α-helix	trans	-59.7	-32.4	-173.9	178.9	58.9	-169.5	0	0	112.9	R537 L543 C548 V549	R537-E545 IonicContact CZ-OE1 2.67Å; R537-E545 IonicContact CZ-OE2 2.79Å; R537-E545 IonicContact NE-OE2 2.72Å; R537-E545 IonicContact NH2-OE1 2.75Å; R537-E545 PolarHBondContact NH2-OE1 2.97Å; R537-E545 IonicContact NH2-OE2 3.89Å; R537-E545 PolarHBondContact NH2-OE2 3.46Å; L543-E545 PolarHBondContact O-N 3.42Å; E545-C548 PolarHBondContact O-N 3.3Å; E545-V549 HydrophobicContact CG-CG2 4.3Å; E545-V549 VanDerWaalsContact O-CB 3.27Å; E545-V549 WeakPolarHBondContact O-CB 3.49Å; E545-V549 VanDerWaalsContact O-CG2 3.29Å; E545-V549 WeakPolarHBondContact O-CG2 3.38Å; E545-V549 PolarHBondContact O-N 3.17Å; E545-V549 WeakPolarHBondContact OE1-CG2 3.47Å
546	E	90.8	Very high	91.2	Very high	166 Å²	166	41.6 Å²	41.6	78%	0.776	24%	0.239	S	C	*	.	H	α-helix	trans	-60.7	-49.5	175.8	-61.3	-175	161.1	0	0	111.6	K544 C548 V549 D550	K544-E546 PolarHBondContact O-N 3.46Å; E546-C548 PolarHBondContact O-N 3Å; E546-V549 PolarHBondContact O-N 2.94Å; E546-D550 PolarHBondContact O-N 2.98Å
547	A	92.6	Very high	91.2	Very high	4 Å²	4	44.5 Å²	44.5	3%	0.033	26%	0.26	C	S	.	.	H	α-helix	trans	-63.1	-41.4	175.4	0	0	0	0	0	112	M508 K544 V549 D550 V551	M508-A547 HydrophobicContact CB-CB 4.01Å; M508-A547 HydrophobicContact SD-CB 4.49Å; K544-A547 HydrophobicContact CB-CB 4.31Å; K544-A547 PolarHBondContact O-N 3.43Å; A547-V549 VanDerWaalsContact C-N 3.32Å; A547-V549 PolarHBondContact O-N 3.39Å; A547-D550 PolarHBondContact O-N 3.2Å; A547-V551 WeakPolarHBondContact O-CG2 3.4Å; A547-V551 PolarHBondContact O-N 3.15Å
548	C	92.4	Very high	91.2	Very high	0 Å²	0	42 Å²	42	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-60	-42.9	176.1	-63.7	0	0	0	0	112.2	V533 L543 K544 E545 E546 L552	V533-C548 HydrophobicContact CG1-CB 3.69Å; L543-C548 VanDerWaalsContact CB-SG 3.52Å; L543-C548 VanDerWaalsContact CD1-SG 3.55Å; K544-C548 PolarHBondContact O-N 3.21Å; K544-C548 VanDerWaalsContact O-N 3.09Å; K544-C548 PolarHBondContact O-SG 3.4Å; E545-C548 PolarHBondContact O-N 3.3Å; E546-C548 PolarHBondContact O-N 3Å; C548-L552 WeakPolarHBondContact O-CG 3.4Å; C548-L552 PolarHBondContact O-N 3.14Å; C548-L552 VanDerWaalsContact O-N 3.16Å
549	V	94.2	Very high	91.2	Very high	8 Å²	8	40.4 Å²	40.4	5%	0.048	24%	0.239	C	C	.	.	H	α-helix	trans	-67.2	-38.1	176.8	159.2	0	0	0	0	111.4	E545 E546 A547 L552 K553 L575 P576 L579	E545-V549 HydrophobicContact CG-CG2 4.3Å; E545-V549 VanDerWaalsContact O-CB 3.27Å; E545-V549 WeakPolarHBondContact O-CB 3.49Å; E545-V549 VanDerWaalsContact O-CG2 3.29Å; E545-V549 WeakPolarHBondContact O-CG2 3.38Å; E545-V549 PolarHBondContact O-N 3.17Å; E545-V549 WeakPolarHBondContact OE1-CG2 3.47Å; E546-V549 PolarHBondContact O-N 2.94Å; A547-V549 VanDerWaalsContact C-N 3.32Å; A547-V549 PolarHBondContact O-N 3.39Å; V549-L552 PolarHBondContact O-N 3Å; V549-K553 HydrophobicContact CG1-CD 4.27Å; V549-K553 HydrophobicContact CG1-CG 4.49Å; V549-K553 VanDerWaalsContact O-CG 3.31Å; V549-K553 WeakPolarHBondContact O-CG 3.38Å; V549-K553 PolarHBondContact O-N 3.33Å; V549-L575 HydrophobicContact CB-CD2 4.38Å; V549-L575 HydrophobicContact CG1-CD2 4.13Å; V549-L575 HydrophobicContact CG2-CD2 4.24Å; V549-P576 HydrophobicContact CG2-CG 4Å; V549-L579 HydrophobicContact CG1-CD1 3.77Å
550	D	93.7	Very high	91.3	Very high	67 Å²	67	39.8 Å²	39.8	36%	0.358	24%	0.236	S	C	.	.	H	α-helix	trans	-74.4	-36	179.6	-74.5	-12.3	0	0	0	113	L515 E546 A547 L552 K553 A554	L515-D550 HydrophobicContact CD1-CB 4.29Å; E546-D550 PolarHBondContact O-N 2.98Å; A547-D550 PolarHBondContact O-N 3.2Å; D550-L552 VanDerWaalsContact C-N 3.34Å; D550-L552 PolarHBondContact O-N 2.91Å; D550-K553 PolarHBondContact O-N 3.33Å; D550-K553 WeakPolarHBondContact OD1-CD 3.27Å; D550-K553 WeakPolarHBondContact OD1-CE 3.35Å; D550-K553 IonicContact OD1-NZ 3.36Å; D550-K553 PolarHBondContact OD1-NZ 3.26Å; D550-A554 WeakPolarHBondContact O-CB 3.39Å; D550-A554 PolarHBondContact O-N 3.25Å
551	V	95.1	Very high	91.4	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-56.4	-48.7	166.7	171.8	0	0	0	0	110.4	F511 L515 L526 M529 A547 A554 Y555	F511-V551 HydrophobicContact CB-CG2 4.26Å; F511-V551 HydrophobicContact CD2-CG2 4.08Å; L515-V551 HydrophobicContact CD1-CB 4.44Å; L515-V551 HydrophobicContact CD1-CG2 3.75Å; L526-V551 HydrophobicContact CD1-CG1 4.33Å; M529-V551 HydrophobicContact CB-CG1 3.99Å; M529-V551 HydrophobicContact CE-CG2 4.19Å; A547-V551 WeakPolarHBondContact O-CG2 3.4Å; A547-V551 PolarHBondContact O-N 3.15Å; V551-A554 PolarHBondContact O-N 3.47Å; V551-Y555 WeakPolarHBondContact O-CB 3.46Å; V551-Y555 PolarHBondContact O-N 3.1Å
552	L	94.8	Very high	91.3	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-63.8	-43.7	178.4	-80.2	164.6	0	0	0	112.6	T530 C548 V549 D550 A554 Y555 V556 Q574 L575	T530-L552 HydrophobicContact CG2-CD2 3.72Å; C548-L552 WeakPolarHBondContact O-CG 3.4Å; C548-L552 PolarHBondContact O-N 3.14Å; C548-L552 VanDerWaalsContact O-N 3.16Å; V549-L552 PolarHBondContact O-N 3Å; D550-L552 VanDerWaalsContact C-N 3.34Å; D550-L552 PolarHBondContact O-N 2.91Å; L552-A554 PolarHBondContact O-N 2.98Å; L552-Y555 PolarHBondContact O-N 2.69Å; L552-V556 WeakPolarHBondContact O-CB 3.44Å; L552-V556 VanDerWaalsContact O-CG2 3.28Å; L552-V556 WeakPolarHBondContact O-CG2 3.36Å; L552-V556 PolarHBondContact O-N 2.89Å; L552-Q574 HydrophobicContact CD1-CB 4.02Å; L552-Q574 HydrophobicContact CD2-CB 4.22Å; L552-L575 HydrophobicContact CB-CD2 3.6Å; L552-L575 HydrophobicContact CB-CG 4.32Å; L552-L575 HydrophobicContact CD1-CD2 4.12Å; L552-L575 HydrophobicContact CG-CD2 4.5Å
553	K	93.7	Very high	91.4	Very high	59 Å²	59	44.7 Å²	44.7	26%	0.257	22%	0.219	S	C	.	.	H	α-helix	trans	-59.1	-45.6	174.6	-74.6	171.5	-165	154.1	0	111.7	V549 D550 V556 S557	V549-K553 HydrophobicContact CG1-CD 4.27Å; V549-K553 HydrophobicContact CG1-CG 4.49Å; V549-K553 VanDerWaalsContact O-CG 3.31Å; V549-K553 WeakPolarHBondContact O-CG 3.38Å; V549-K553 PolarHBondContact O-N 3.33Å; D550-K553 PolarHBondContact O-N 3.33Å; D550-K553 WeakPolarHBondContact OD1-CD 3.27Å; D550-K553 WeakPolarHBondContact OD1-CE 3.35Å; D550-K553 IonicContact OD1-NZ 3.36Å; D550-K553 PolarHBondContact OD1-NZ 3.26Å; K553-V556 PolarHBondContact O-N 2.89Å; K553-S557 WeakPolarHBondContact O-CB 3.47Å; K553-S557 PolarHBondContact O-N 3.31Å; K553-S557 PolarHBondContact O-OG 3.36Å
554	A	93.9	Very high	91.3	Very high	27 Å²	27	47.4 Å²	47.4	22%	0.223	23%	0.231	C	C	.	.	H	α-helix	trans	-65.6	-42.4	-178.8	0	0	0	0	0	111.3	L515 L526 D550 V551 L552 S557 L558	L515-A554 HydrophobicContact CD2-CB 3.48Å; L515-A554 VanDerWaalsContact CD2-CB 3.48Å; L526-A554 HydrophobicContact CD1-CB 4.34Å; L526-A554 HydrophobicContact CD2-CB 4Å; D550-A554 WeakPolarHBondContact O-CB 3.39Å; D550-A554 PolarHBondContact O-N 3.25Å; V551-A554 PolarHBondContact O-N 3.47Å; L552-A554 PolarHBondContact O-N 2.98Å; A554-S557 WeakPolarHBondContact O-CB 3.43Å; A554-S557 PolarHBondContact O-N 3.4Å; A554-L558 PolarHBondContact O-N 2.9Å
555	Y	94.6	Very high	91.2	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-67.9	-40.6	176.7	-175.5	-110.7	0	0	0	112.7	F139 L526 R527 T530 V551 L552 S557 L558 L559 Y571	F139-Y555 HydrophobicContact CD1-CE2 4.07Å; F139-Y555 WeakPolarHBondContact CD1-OH 3.36Å; F139-Y555 AromaticContact CE1-CE2 3.79Å; F139-Y555 HydrophobicContact CE1-CE2 3.79Å; L526-Y555 HydrophobicContact CG-CD2 4.13Å; R527-Y555 VanDerWaalsContact CA-CE2 3.48Å; R527-Y555 HydrophobicContact CB-CE2 3.79Å; R527-Y555 HydrophobicContact CG-CE2 4.17Å; T530-Y555 HydrophobicContact CG2-CD1 3.76Å; T530-Y555 HydrophobicContact CG2-CE1 4.18Å; T530-Y555 HydrophobicContact CG2-CG 4.23Å; T530-Y555 VanDerWaalsContact OG1-CB 3.25Å; T530-Y555 WeakPolarHBondContact OG1-CB 3.35Å; T530-Y555 VanDerWaalsContact OG1-CG 3.3Å; V551-Y555 WeakPolarHBondContact O-CB 3.46Å; V551-Y555 PolarHBondContact O-N 3.1Å; L552-Y555 PolarHBondContact O-N 2.69Å; Y555-S557 VanDerWaalsContact C-N 3.33Å; Y555-S557 PolarHBondContact O-N 3.48Å; Y555-L558 WeakPolarHBondContact O-CB 3.28Å; Y555-L558 PolarHBondContact O-N 3.26Å; Y555-L559 HydrophobicContact CD1-CD1 4.03Å; Y555-L559 HydrophobicContact CD1-CG 4.46Å; Y555-L559 HydrophobicContact CE1-CD1 3.67Å; Y555-L559 HydrophobicContact CE1-CG 4.18Å; Y555-L559 WeakPolarHBondContact O-CG 3.39Å; Y555-L559 PolarHBondContact O-N 3.43Å; Y555-Y571 HydrophobicContact CD1-CD1 4.11Å; Y555-Y571 HydrophobicContact CD1-CD2 4.41Å; Y555-Y571 HydrophobicContact CD1-CE1 4.36Å; Y555-Y571 HydrophobicContact CD1-CG 4.13Å; Y555-Y571 AromaticContact CE1-CD1 3.76Å; Y555-Y571 HydrophobicContact CE1-CD1 3.76Å; Y555-Y571 AromaticContact CE1-CD2 3.82Å; Y555-Y571 HydrophobicContact CE1-CD2 3.82Å; Y555-Y571 AromaticContact CE1-CE1 3.6Å; Y555-Y571 HydrophobicContact CE1-CE1 3.6Å; Y555-Y571 AromaticContact CE1-CE2 3.68Å; Y555-Y571 HydrophobicContact CE1-CE2 3.68Å; Y555-Y571 AromaticContact CE1-CG 3.85Å; Y555-Y571 HydrophobicContact CE1-CG 3.85Å; Y555-Y571 AromaticContact CE1-CZ 3.55Å; Y555-Y571 PolarHBondContact OH-OH 3.38Å
556	V	93.8	Very high	91.2	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-59.5	-44.1	170.7	163.5	0	0	0	0	111	L552 K553 L558 L559 I560 V568 V572	L552-V556 WeakPolarHBondContact O-CB 3.44Å; L552-V556 VanDerWaalsContact O-CG2 3.28Å; L552-V556 WeakPolarHBondContact O-CG2 3.36Å; L552-V556 PolarHBondContact O-N 2.89Å; K553-V556 PolarHBondContact O-N 2.89Å; V556-L558 VanDerWaalsContact C-N 3.31Å; V556-L558 PolarHBondContact O-N 3.33Å; V556-L559 PolarHBondContact O-N 3.21Å; V556-I560 HydrophobicContact CG1-CD1 3.72Å; V556-I560 HydrophobicContact CG1-CG1 4.46Å; V556-I560 VanDerWaalsContact O-CG1 3.25Å; V556-I560 WeakPolarHBondContact O-CG1 3.38Å; V556-I560 PolarHBondContact O-N 3.41Å; V556-V568 HydrophobicContact CG1-CG1 4.28Å; V556-V572 HydrophobicContact CB-CG2 4.3Å; V556-V572 HydrophobicContact CG1-CG2 3.67Å; V556-V572 HydrophobicContact CG2-CG2 3.6Å
557	S	91.8	Very high	91.3	Very high	62 Å²	62	37.4 Å²	37.4	43%	0.434	19%	0.19	S	C	.	.	H	α-helix	trans	-62.3	-37.5	177.4	-57.4	0	0	0	0	112.5	K553 A554 Y555 R561	K553-S557 WeakPolarHBondContact O-CB 3.47Å; K553-S557 PolarHBondContact O-N 3.31Å; K553-S557 PolarHBondContact O-OG 3.36Å; A554-S557 WeakPolarHBondContact O-CB 3.43Å; A554-S557 PolarHBondContact O-N 3.4Å; Y555-S557 VanDerWaalsContact C-N 3.33Å; Y555-S557 PolarHBondContact O-N 3.48Å; S557-R561 WeakPolarHBondContact O-CB 3.33Å; S557-R561 PolarHBondContact O-N 2.95Å
558	L	90.7	Very high	91.3	Very high	9 Å²	9	37.2 Å²	37.2	5%	0.047	19%	0.188	C	C	.	.	H	α-helix	trans	-62.2	-51.2	171.9	178.3	168.1	0	0	0	111	F139 L523 L526 A554 Y555 V556 I560 R561 D562	F139-L558 HydrophobicContact CE1-CD2 4.05Å; L523-L558 HydrophobicContact CB-CD1 4.07Å; L523-L558 HydrophobicContact CD2-CD1 3.6Å; L523-L558 HydrophobicContact CD2-CG 4.01Å; L523-L558 HydrophobicContact CG-CD1 4.43Å; L526-L558 HydrophobicContact CB-CD1 4.35Å; L526-L558 HydrophobicContact CD2-CB 4.5Å; L526-L558 HydrophobicContact CD2-CD1 3.88Å; A554-L558 PolarHBondContact O-N 2.9Å; Y555-L558 WeakPolarHBondContact O-CB 3.28Å; Y555-L558 PolarHBondContact O-N 3.26Å; V556-L558 VanDerWaalsContact C-N 3.31Å; V556-L558 PolarHBondContact O-N 3.33Å; L558-I560 VanDerWaalsContact C-N 3.28Å; L558-I560 PolarHBondContact O-N 3.47Å; L558-R561 PolarHBondContact O-N 2.88Å; L558-D562 WeakPolarHBondContact CD2-OD2 3.25Å; L558-D562 WeakPolarHBondContact O-CB 3.3Å; L558-D562 PolarHBondContact O-N 3.35Å
559	L	90.9	Very high	91.4	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-58.8	-38.8	179.3	-68.6	175.5	0	0	0	112.4	F139 Y555 V556 Q563 Q564 L567 V568 Y571	F139-L559 HydrophobicContact CD1-CD2 4.06Å; Y555-L559 HydrophobicContact CD1-CD1 4.03Å; Y555-L559 HydrophobicContact CD1-CG 4.46Å; Y555-L559 HydrophobicContact CE1-CD1 3.67Å; Y555-L559 HydrophobicContact CE1-CG 4.18Å; Y555-L559 WeakPolarHBondContact O-CG 3.39Å; Y555-L559 PolarHBondContact O-N 3.43Å; V556-L559 PolarHBondContact O-N 3.21Å; L559-Q563 PolarHBondContact O-N 3.28Å; L559-Q564 HydrophobicContact CB-CB 4.26Å; L559-Q564 HydrophobicContact CD2-CB 3.78Å; L559-Q564 HydrophobicContact CD2-CG 4.16Å; L559-Q564 PolarHBondContact O-N 3.02Å; L559-L567 HydrophobicContact CD1-CB 4.1Å; L559-L567 HydrophobicContact CD2-CB 4.28Å; L559-L567 HydrophobicContact CD2-CD1 4.01Å; L559-V568 HydrophobicContact CB-CG2 4.01Å; L559-Y571 HydrophobicContact CD1-CD2 3.54Å; L559-Y571 HydrophobicContact CD1-CE2 3.87Å; L559-Y571 HydrophobicContact CD1-CG 4.4Å
560	I	90.3	Very high	91.3	Very high	33 Å²	33	37.6 Å²	37.6	17%	0.169	19%	0.191	C	C	.	.	H	α-helix	trans	-67.5	-46.7	176.7	-64.7	166	0	0	0	110.9	V556 L558 D562 Q563 V568 F587	V556-I560 HydrophobicContact CG1-CD1 3.72Å; V556-I560 HydrophobicContact CG1-CG1 4.46Å; V556-I560 VanDerWaalsContact O-CG1 3.25Å; V556-I560 WeakPolarHBondContact O-CG1 3.38Å; V556-I560 PolarHBondContact O-N 3.41Å; L558-I560 VanDerWaalsContact C-N 3.28Å; L558-I560 PolarHBondContact O-N 3.47Å; I560-D562 VanDerWaalsContact C-N 3.31Å; I560-D562 PolarHBondContact O-N 3.42Å; I560-Q563 PolarHBondContact O-N 3.2Å; I560-V568 HydrophobicContact CD1-CG1 4.47Å; I560-V568 HydrophobicContact CG1-CG1 4.27Å; I560-V568 HydrophobicContact CG1-CG2 3.97Å; I560-F587 HydrophobicContact CB-CD2 4.47Å; I560-F587 HydrophobicContact CD1-CB 3.84Å; I560-F587 HydrophobicContact CD1-CD2 4.11Å; I560-F587 HydrophobicContact CD1-CG 4.27Å; I560-F587 HydrophobicContact CG1-CB 4.36Å; I560-F587 HydrophobicContact CG1-CD2 3.68Å; I560-F587 HydrophobicContact CG1-CE2 4.36Å; I560-F587 HydrophobicContact CG1-CG 4.25Å; I560-F587 HydrophobicContact CG2-CD2 4.15Å
561	R	88.4	Confident	91.3	Very high	145 Å²	145	34.4 Å²	34.4	55%	0.547	17%	0.174	S	C	.	.	H	α-helix	trans	-59.2	-43	177.2	-174.1	-164.2	68.8	-155.4	-6.7	111.5	L523 S557 L558 Q563	L523-R561 VanDerWaalsContact CD2-NH2 3.29Å; S557-R561 WeakPolarHBondContact O-CB 3.33Å; S557-R561 PolarHBondContact O-N 2.95Å; L558-R561 PolarHBondContact O-N 2.88Å; R561-Q563 PolarHBondContact O-N 2.9Å
562	D	85.4	Confident	91.3	Very high	51 Å²	51	34.4 Å²	34.4	27%	0.273	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	16	-175.6	-57.8	-11.5	0	0	0	112.4	L558 I560 Q564	L558-D562 WeakPolarHBondContact CD2-OD2 3.25Å; L558-D562 WeakPolarHBondContact O-CB 3.3Å; L558-D562 PolarHBondContact O-N 3.35Å; I560-D562 VanDerWaalsContact C-N 3.31Å; I560-D562 PolarHBondContact O-N 3.42Å; D562-Q564 HydrophobicContact CB-CG 4.45Å; D562-Q564 PolarHBondContact O-N 2.73Å; D562-Q564 VanDerWaalsContact O-N 3.14Å; D562-Q564 PolarHBondContact O-NE2 2.7Å
563	Q	86	Confident	91.2	Very high	129 Å²	129	35.8 Å²	35.8	60%	0.603	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.8	24.7	174	-61.2	-66.8	-39.5	0	0	115.4	L559 I560 R561 T565	L559-Q563 PolarHBondContact O-N 3.28Å; I560-Q563 PolarHBondContact O-N 3.2Å; R561-Q563 PolarHBondContact O-N 2.9Å; Q563-T565 PolarHBondContact O-N 3.47Å
564	Q	86.7	Confident	91.1	Very high	84 Å²	84	36.2 Å²	36.2	39%	0.393	19%	0.191	S	C	.	.			trans	-80.9	52.5	178.6	-59.4	-55.3	-57.3	0	0	112	L559 D562 D566 L567	L559-Q564 HydrophobicContact CB-CB 4.26Å; L559-Q564 HydrophobicContact CD2-CB 3.78Å; L559-Q564 HydrophobicContact CD2-CG 4.16Å; L559-Q564 PolarHBondContact O-N 3.02Å; D562-Q564 HydrophobicContact CB-CG 4.45Å; D562-Q564 PolarHBondContact O-N 2.73Å; D562-Q564 VanDerWaalsContact O-N 3.14Å; D562-Q564 PolarHBondContact O-NE2 2.7Å; Q564-D566 VanDerWaalsContact C-N 3.29Å; Q564-D566 PolarHBondContact O-N 2.93Å; Q564-L567 HydrophobicContact CB-CB 4.48Å; Q564-L567 HydrophobicContact CB-CD1 4.09Å; Q564-L567 HydrophobicContact CB-CG 4.3Å; Q564-L567 WeakPolarHBondContact O-CB 3.49Å; Q564-L567 PolarHBondContact O-N 2.8Å
565	T	87.3	Confident	91	Very high	24 Å²	24	35.5 Å²	35.5	15%	0.147	18%	0.183	C	C	.	.	H	α-helix	trans	-52.1	-42.2	-171.2	54	0	0	0	0	113.6	Q563 L567 V568 F587	Q563-T565 PolarHBondContact O-N 3.47Å; T565-L567 PolarHBondContact O-N 3.14Å; T565-V568 PolarHBondContact O-N 2.66Å; T565-F587 HydrophobicContact CG2-CE2 4.07Å; T565-F587 HydrophobicContact CG2-CZ 3.97Å
566	D	88.9	Confident	90.9	Very high	71 Å²	71	38.1 Å²	38.1	38%	0.38	20%	0.2	S	C	.	.	H	α-helix	trans	-61.4	-24.1	-179.6	-111.3	26.7	0	0	0	113.5	Q564 R599 L603	Q564-D566 VanDerWaalsContact C-N 3.29Å; Q564-D566 PolarHBondContact O-N 2.93Å; D566-R599 IonicContact OD1-CZ 3.79Å; D566-R599 IonicContact OD1-NE 2.71Å; D566-R599 PolarHBondContact OD1-NE 3.39Å; D566-R599 IonicContact OD1-NH2 2.66Å; D566-R599 PolarHBondContact OD1-NH2 2.83Å; D566-R599 IonicContact OD2-CZ 2.69Å; D566-R599 IonicContact OD2-NE 2.79Å; D566-R599 IonicContact OD2-NH2 2.72Å; D566-R599 PolarHBondContact OD2-NH2 3.28Å; D566-L603 HydrophobicContact CB-CD1 4.44Å; D566-L603 WeakPolarHBondContact OD1-CD1 3.45Å
567	L	91.4	Very high	90.8	Very high	13 Å²	13	41.9 Å²	41.9	7%	0.068	23%	0.231	C	C	.	.	H	α-helix	trans	-90.2	-29	-176.9	-55.9	-173	0	0	0	113.1	F139 P140 L143 L559 Q564 T565 A569 S570 Y571	F139-L567 HydrophobicContact CB-CD1 3.82Å; P140-L567 HydrophobicContact CB-CD2 4.11Å; L143-L567 HydrophobicContact CB-CD2 4.47Å; L143-L567 HydrophobicContact CD2-CB 4.3Å; L143-L567 HydrophobicContact CD2-CD2 3.65Å; L559-L567 HydrophobicContact CD1-CB 4.1Å; L559-L567 HydrophobicContact CD2-CB 4.28Å; L559-L567 HydrophobicContact CD2-CD1 4.01Å; Q564-L567 HydrophobicContact CB-CB 4.48Å; Q564-L567 HydrophobicContact CB-CD1 4.09Å; Q564-L567 HydrophobicContact CB-CG 4.3Å; Q564-L567 WeakPolarHBondContact O-CB 3.49Å; Q564-L567 PolarHBondContact O-N 2.8Å; T565-L567 PolarHBondContact O-N 3.14Å; L567-A569 PolarHBondContact O-N 3.03Å; L567-S570 PolarHBondContact O-N 2.95Å; L567-Y571 HydrophobicContact CB-CE2 4.22Å; L567-Y571 VanDerWaalsContact O-CD2 3.25Å; L567-Y571 WeakPolarHBondContact O-CD2 3.37Å
568	V	93.7	Very high	90.7	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-55.5	-45.8	-166.6	176.7	0	0	0	0	113	V556 L559 I560 T565 S570 Y571 V572 Y584 F587	V556-V568 HydrophobicContact CG1-CG1 4.28Å; L559-V568 HydrophobicContact CB-CG2 4.01Å; I560-V568 HydrophobicContact CD1-CG1 4.47Å; I560-V568 HydrophobicContact CG1-CG1 4.27Å; I560-V568 HydrophobicContact CG1-CG2 3.97Å; T565-V568 PolarHBondContact O-N 2.66Å; V568-S570 VanDerWaalsContact C-N 3.34Å; V568-S570 PolarHBondContact O-N 2.78Å; V568-Y571 PolarHBondContact O-N 3.1Å; V568-V572 HydrophobicContact CG1-CG2 3.84Å; V568-V572 WeakPolarHBondContact O-CG2 3.18Å; V568-V572 PolarHBondContact O-N 2.95Å; V568-Y584 HydrophobicContact CG1-CD2 4.21Å; V568-Y584 HydrophobicContact CG1-CE2 4.03Å; V568-F587 HydrophobicContact CB-CD1 4.41Å; V568-F587 HydrophobicContact CB-CE1 4.24Å; V568-F587 HydrophobicContact CB-CZ 4.4Å; V568-F587 HydrophobicContact CG1-CD1 3.92Å; V568-F587 HydrophobicContact CG1-CD2 4.5Å; V568-F587 HydrophobicContact CG1-CE1 4.25Å; V568-F587 HydrophobicContact CG1-CG 4.04Å; V568-F587 HydrophobicContact CG2-CE2 4.23Å; V568-F587 HydrophobicContact CG2-CZ 4.26Å
569	A	93.3	Very high	90.7	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-58.6	-42.5	-171.7	0	0	0	0	0	113.4	L567 Y571 V572 G573 Y584 L603 A607	L567-A569 PolarHBondContact O-N 3.03Å; A569-Y571 VanDerWaalsContact C-N 3.35Å; A569-Y571 PolarHBondContact O-N 3.26Å; A569-V572 PolarHBondContact O-N 3.44Å; A569-G573 PolarHBondContact O-N 3.35Å; A569-Y584 HydrophobicContact CB-CE2 3.72Å; A569-L603 HydrophobicContact CB-CB 3.78Å; A569-A607 HydrophobicContact CB-CB 4.07Å; A569-A607 WeakPolarHBondContact O-CB 3.48Å
570	S	92.4	Very high	90.8	Very high	16 Å²	16	45.1 Å²	45.1	11%	0.112	25%	0.254	C	S	.	.	H	α-helix	trans	-68.3	-33.1	-174.2	-58.5	0	0	0	0	113	L567 V568 Q574	L567-S570 PolarHBondContact O-N 2.95Å; V568-S570 VanDerWaalsContact C-N 3.34Å; V568-S570 PolarHBondContact O-N 2.78Å; S570-Q574 WeakPolarHBondContact O-CG 3.09Å; S570-Q574 PolarHBondContact O-NE2 3.34Å
571	Y	94.5	Very high	91	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-81.5	-35.3	175.6	-60.2	-77.2	0	0	0	112	L143 T530 H531 L534 Y555 L559 L567 V568 A569 G573 Q574	L143-Y571 HydrophobicContact CB-CE2 4.45Å; L143-Y571 HydrophobicContact CD1-CE1 4.35Å; L143-Y571 HydrophobicContact CD1-CE2 4.04Å; L143-Y571 HydrophobicContact CD2-CE2 4.07Å; L143-Y571 HydrophobicContact CG-CE2 4.41Å; T530-Y571 HydrophobicContact CG2-CD1 4.05Å; T530-Y571 HydrophobicContact CG2-CE1 4.27Å; H531-Y571 AromaticContact CE1-CE1 3.83Å; H531-Y571 AromaticContact CE1-CZ 3.95Å; H531-Y571 PolarHBondContact CE1-OH 3.41Å; H531-Y571 AromaticContact NE2-CE1 3.59Å; H531-Y571 AromaticContact NE2-CZ 3.82Å; H531-Y571 PolarHBondContact NE2-OH 2.81Å; H531-Y571 VanDerWaalsContact NE2-OH 3.15Å; L534-Y571 HydrophobicContact CD1-CD1 4.23Å; L534-Y571 HydrophobicContact CD1-CE1 4.34Å; Y555-Y571 HydrophobicContact CD1-CD1 4.11Å; Y555-Y571 HydrophobicContact CD1-CD2 4.41Å; Y555-Y571 HydrophobicContact CD1-CE1 4.36Å; Y555-Y571 HydrophobicContact CD1-CG 4.13Å; Y555-Y571 AromaticContact CE1-CD1 3.76Å; Y555-Y571 HydrophobicContact CE1-CD1 3.76Å; Y555-Y571 AromaticContact CE1-CD2 3.82Å; Y555-Y571 HydrophobicContact CE1-CD2 3.82Å; Y555-Y571 AromaticContact CE1-CE1 3.6Å; Y555-Y571 HydrophobicContact CE1-CE1 3.6Å; Y555-Y571 AromaticContact CE1-CE2 3.68Å; Y555-Y571 HydrophobicContact CE1-CE2 3.68Å; Y555-Y571 AromaticContact CE1-CG 3.85Å; Y555-Y571 HydrophobicContact CE1-CG 3.85Å; Y555-Y571 AromaticContact CE1-CZ 3.55Å; Y555-Y571 PolarHBondContact OH-OH 3.38Å; L559-Y571 HydrophobicContact CD1-CD2 3.54Å; L559-Y571 HydrophobicContact CD1-CE2 3.87Å; L559-Y571 HydrophobicContact CD1-CG 4.4Å; L567-Y571 HydrophobicContact CB-CE2 4.22Å; L567-Y571 VanDerWaalsContact O-CD2 3.25Å; L567-Y571 WeakPolarHBondContact O-CD2 3.37Å; V568-Y571 PolarHBondContact O-N 3.1Å; A569-Y571 VanDerWaalsContact C-N 3.35Å; A569-Y571 PolarHBondContact O-N 3.26Å; Y571-G573 VanDerWaalsContact C-N 3.25Å; Y571-G573 PolarHBondContact O-N 3.21Å; Y571-Q574 WeakPolarHBondContact O-CB 3.4Å; Y571-Q574 PolarHBondContact O-N 2.95Å
572	V	94.2	Very high	91.1	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-65.1	-31.4	173	177.5	0	0	0	0	111.5	V556 V568 A569 Q574 L575 A580 Q583 Y584 L609	V556-V572 HydrophobicContact CB-CG2 4.3Å; V556-V572 HydrophobicContact CG1-CG2 3.67Å; V556-V572 HydrophobicContact CG2-CG2 3.6Å; V568-V572 HydrophobicContact CG1-CG2 3.84Å; V568-V572 WeakPolarHBondContact O-CG2 3.18Å; V568-V572 PolarHBondContact O-N 2.95Å; A569-V572 PolarHBondContact O-N 3.44Å; V572-Q574 PolarHBondContact O-N 3.29Å; V572-Q574 VanDerWaalsContact O-N 3.14Å; V572-L575 WeakPolarHBondContact O-CB 3.39Å; V572-L575 PolarHBondContact O-N 3.47Å; V572-L575 VanDerWaalsContact O-N 3.09Å; V572-A580 HydrophobicContact CG1-CB 3.95Å; V572-A580 WeakPolarHBondContact CG1-O 3.28Å; V572-A580 WeakPolarHBondContact O-CB 3.26Å; V572-Q583 HydrophobicContact CG1-CB 4.36Å; V572-Y584 HydrophobicContact CB-CD2 4.18Å; V572-Y584 HydrophobicContact CG1-CD2 4.19Å; V572-Y584 HydrophobicContact CG2-CD2 4.26Å; V572-L609 HydrophobicContact CB-CD1 4.42Å; V572-L609 HydrophobicContact CG1-CD1 4.23Å; V572-L609 HydrophobicContact CG1-CD2 4.32Å
573	G	92.4	Very high	91.4	Very high	28 Å²	28	42 Å²	42	29%	0.289	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-11.4	169.3	0	0	0	0	0	115.4	A569 Y571	A569-G573 PolarHBondContact O-N 3.35Å; Y571-G573 VanDerWaalsContact C-N 3.25Å; Y571-G573 PolarHBondContact O-N 3.21Å
574	Q	92.1	Very high	91.8	Very high	68 Å²	68	35.8 Å²	35.8	32%	0.318	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	1	175	-48.5	-58.9	-46.9	0	0	113	L534 R537 L552 S570 Y571 V572	L534-Q574 HydrophobicContact CD1-CG 4.47Å; L534-Q574 HydrophobicContact CD2-CB 3.8Å; L534-Q574 HydrophobicContact CD2-CG 3.64Å; R537-Q574 PolarHBondContact NH1-O 3.22Å; L552-Q574 HydrophobicContact CD1-CB 4.02Å; L552-Q574 HydrophobicContact CD2-CB 4.22Å; S570-Q574 WeakPolarHBondContact O-CG 3.09Å; S570-Q574 PolarHBondContact O-NE2 3.34Å; Y571-Q574 WeakPolarHBondContact O-CB 3.4Å; Y571-Q574 PolarHBondContact O-N 2.95Å; V572-Q574 PolarHBondContact O-N 3.29Å; V572-Q574 VanDerWaalsContact O-N 3.14Å
575	L	92.9	Very high	92.1	Very high	12 Å²	12	31.9 Å²	31.9	6%	0.063	20%	0.201	C	C	.	.	S	Bend	trans	-91.8	153.5	174.6	-68.6	173.4	0	0	0	111.1	V549 L552 V572 A577 A580 Q583	V549-L575 HydrophobicContact CB-CD2 4.38Å; V549-L575 HydrophobicContact CG1-CD2 4.13Å; V549-L575 HydrophobicContact CG2-CD2 4.24Å; L552-L575 HydrophobicContact CB-CD2 3.6Å; L552-L575 HydrophobicContact CB-CG 4.32Å; L552-L575 HydrophobicContact CD1-CD2 4.12Å; L552-L575 HydrophobicContact CG-CD2 4.5Å; V572-L575 WeakPolarHBondContact O-CB 3.39Å; V572-L575 PolarHBondContact O-N 3.47Å; V572-L575 VanDerWaalsContact O-N 3.09Å; L575-A577 PolarHBondContact O-N 3.17Å; L575-A580 HydrophobicContact CB-CB 4.13Å; L575-Q583 HydrophobicContact CD1-CB 4.41Å; L575-Q583 HydrophobicContact CD1-CG 4.12Å
576	P	92.6	Very high	92.2	Very high	56 Å²	56	33.3 Å²	33.3	36%	0.364	22%	0.215	S	C	.	.			trans	-52.7	133.8	169.7	-26.6	34.6	0	0	0	111.5	V549 A578 L579 A580	V549-P576 HydrophobicContact CG2-CG 4Å; P576-A578 VanDerWaalsContact C-N 3.31Å; P576-A578 PolarHBondContact O-N 3.28Å; P576-L579 HydrophobicContact CG-CD1 4.38Å; P576-L579 WeakPolarHBondContact O-CA 3.48Å; P576-L579 WeakPolarHBondContact O-CB 3.3Å; P576-L579 PolarHBondContact O-N 3.45Å; P576-A580 PolarHBondContact O-N 2.72Å
577	A	90.3	Very high	92.4	Very high	78 Å²	78	30 Å²	30	65%	0.645	20%	0.197	S	C	*	.	H	α-helix	trans	-48.6	-43.5	-164.5	0	0	0	0	0	115.3	L575 L579 A580 T581	L575-A577 PolarHBondContact O-N 3.17Å; A577-L579 VanDerWaalsContact C-N 3.34Å; A577-L579 PolarHBondContact O-N 3.44Å; A577-A580 WeakPolarHBondContact O-CB 3.49Å; A577-A580 PolarHBondContact O-N 3.37Å; A577-T581 PolarHBondContact O-N 2.9Å; A577-T581 PolarHBondContact O-OG1 2.99Å
578	A	90.4	Very high	92.3	Very high	75 Å²	75	29.5 Å²	29.5	62%	0.62	19%	0.194	S	C	*	.	H	α-helix	trans	-64.2	-35.8	177.6	0	0	0	0	0	113.2	P576 N582	P576-A578 VanDerWaalsContact C-N 3.31Å; P576-A578 PolarHBondContact O-N 3.28Å; A578-N582 VanDerWaalsContact O-CG 3.3Å; A578-N582 PolarHBondContact O-N 2.91Å; A578-N582 PolarHBondContact O-ND2 2.8Å
579	L	91.7	Very high	92.1	Very high	61 Å²	61	31.9 Å²	31.9	32%	0.319	21%	0.205	S	C	.	.	H	α-helix	trans	-74.2	-37.6	172.9	-64.4	178.8	0	0	0	111.3	V549 P576 A577 N582 Q583	V549-L579 HydrophobicContact CG1-CD1 3.77Å; P576-L579 HydrophobicContact CG-CD1 4.38Å; P576-L579 WeakPolarHBondContact O-CA 3.48Å; P576-L579 WeakPolarHBondContact O-CB 3.3Å; P576-L579 PolarHBondContact O-N 3.45Å; A577-L579 VanDerWaalsContact C-N 3.34Å; A577-L579 PolarHBondContact O-N 3.44Å; L579-N582 PolarHBondContact O-N 2.85Å; L579-Q583 WeakPolarHBondContact O-CB 3.42Å; L579-Q583 VanDerWaalsContact O-CG 3.29Å; L579-Q583 WeakPolarHBondContact O-CG 3.47Å; L579-Q583 PolarHBondContact O-N 3.12Å
580	A	92.9	Very high	91.7	Very high	3 Å²	3	35.3 Å²	35.3	3%	0.025	23%	0.227	C	C	.	.	H	α-helix	trans	-60.5	-47.7	177.1	0	0	0	0	0	111.8	V572 L575 P576 A577 N582 Q583 Y584 L609	V572-A580 HydrophobicContact CG1-CB 3.95Å; V572-A580 WeakPolarHBondContact CG1-O 3.28Å; V572-A580 WeakPolarHBondContact O-CB 3.26Å; L575-A580 HydrophobicContact CB-CB 4.13Å; P576-A580 PolarHBondContact O-N 2.72Å; A577-A580 WeakPolarHBondContact O-CB 3.49Å; A577-A580 PolarHBondContact O-N 3.37Å; A580-N582 PolarHBondContact O-N 3.45Å; A580-Q583 PolarHBondContact O-N 3.46Å; A580-Y584 WeakPolarHBondContact O-CB 3.46Å; A580-Y584 PolarHBondContact O-N 3.35Å; A580-L609 HydrophobicContact CB-CD2 3.82Å
581	T	93	Very high	91.4	Very high	23 Å²	23	34.9 Å²	34.9	14%	0.141	22%	0.223	C	C	.	.	H	α-helix	trans	-58.4	-47.2	175.2	-60.3	0	0	0	0	111.8	A577 A585 A613 I614 L617	A577-T581 PolarHBondContact O-N 2.9Å; A577-T581 PolarHBondContact O-OG1 2.99Å; T581-A585 VanDerWaalsContact O-CB 3.22Å; T581-A585 WeakPolarHBondContact O-CB 3.42Å; T581-A585 PolarHBondContact O-N 3.45Å; T581-A613 HydrophobicContact CG2-CB 3.89Å; T581-I614 HydrophobicContact CG2-CG1 3.99Å; T581-L617 HydrophobicContact CG2-CD2 3.97Å
582	N	91.9	Very high	90.6	Very high	88 Å²	88	39.9 Å²	39.9	47%	0.471	26%	0.258	S	S	.	.	H	α-helix	trans	-63.6	-46	179	-73.7	-32.1	0	0	0	112.6	A578 L579 A580 A586 L617	A578-N582 VanDerWaalsContact O-CG 3.3Å; A578-N582 PolarHBondContact O-N 2.91Å; A578-N582 PolarHBondContact O-ND2 2.8Å; L579-N582 PolarHBondContact O-N 2.85Å; A580-N582 PolarHBondContact O-N 3.45Å; N582-A586 WeakPolarHBondContact O-CB 3.49Å; N582-A586 PolarHBondContact O-N 3.06Å; N582-L617 VanDerWaalsContact OD1-CD2 3.24Å; N582-L617 WeakPolarHBondContact OD1-CD2 3.46Å
583	Q	91.7	Very high	90	Very high	52 Å²	52	45 Å²	45	24%	0.243	28%	0.282	C	S	.	.	H	α-helix	trans	-68.5	-42.5	-179.3	-71.6	-69.2	-16.9	0	0	112	V572 L575 L579 A580 A586 F587	V572-Q583 HydrophobicContact CG1-CB 4.36Å; L575-Q583 HydrophobicContact CD1-CB 4.41Å; L575-Q583 HydrophobicContact CD1-CG 4.12Å; L579-Q583 WeakPolarHBondContact O-CB 3.42Å; L579-Q583 VanDerWaalsContact O-CG 3.29Å; L579-Q583 WeakPolarHBondContact O-CG 3.47Å; L579-Q583 PolarHBondContact O-N 3.12Å; A580-Q583 PolarHBondContact O-N 3.46Å; Q583-A586 PolarHBondContact O-N 3.36Å; Q583-F587 PolarHBondContact O-N 3.1Å
584	Y	93.9	Very high	89.4	Confident	0 Å²	0	48 Å²	48	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-70.7	-35.1	178.1	-151.6	-99.3	0	0	0	112.2	V568 A569 V572 A580 F587 L588 C600 A604 L609 I614	V568-Y584 HydrophobicContact CG1-CD2 4.21Å; V568-Y584 HydrophobicContact CG1-CE2 4.03Å; A569-Y584 HydrophobicContact CB-CE2 3.72Å; V572-Y584 HydrophobicContact CB-CD2 4.18Å; V572-Y584 HydrophobicContact CG1-CD2 4.19Å; V572-Y584 HydrophobicContact CG2-CD2 4.26Å; A580-Y584 WeakPolarHBondContact O-CB 3.46Å; A580-Y584 PolarHBondContact O-N 3.35Å; Y584-F587 AromaticContact CD2-CD1 4Å; Y584-F587 HydrophobicContact CD2-CD1 4Å; Y584-F587 HydrophobicContact CE1-CD1 4.3Å; Y584-F587 AromaticContact CE2-CD1 3.59Å; Y584-F587 HydrophobicContact CE2-CD1 3.59Å; Y584-F587 AromaticContact CE2-CE1 3.91Å; Y584-F587 HydrophobicContact CE2-CE1 3.91Å; Y584-F587 HydrophobicContact CG-CD1 4.48Å; Y584-F587 AromaticContact CZ-CD1 3.77Å; Y584-F587 AromaticContact CZ-CE1 3.84Å; Y584-F587 WeakPolarHBondContact O-CB 3.21Å; Y584-F587 PolarHBondContact O-N 3.38Å; Y584-L588 HydrophobicContact CD1-CD1 3.98Å; Y584-L588 HydrophobicContact CD1-CD2 4.18Å; Y584-L588 HydrophobicContact CD1-CG 3.83Å; Y584-L588 HydrophobicContact CE1-CD1 3.95Å; Y584-L588 HydrophobicContact CE1-CD2 3.59Å; Y584-L588 HydrophobicContact CE1-CG 3.76Å; Y584-L588 WeakPolarHBondContact O-CG 3.38Å; Y584-L588 PolarHBondContact O-N 3Å; Y584-C600 PolarHBondContact OH-O 3.17Å; Y584-A604 HydrophobicContact CD1-CB 4.34Å; Y584-A604 HydrophobicContact CE1-CB 3.73Å; Y584-L609 HydrophobicContact CD1-CD1 4.39Å; Y584-L609 HydrophobicContact CD2-CD1 3.82Å; Y584-L609 HydrophobicContact CE2-CD1 4.29Å; Y584-L609 HydrophobicContact CG-CD1 3.89Å; Y584-I614 HydrophobicContact CD1-CD1 3.9Å; Y584-I614 HydrophobicContact CD1-CG2 3.89Å; Y584-I614 HydrophobicContact CG-CD1 4.16Å
585	A	91.7	Very high	89	Confident	2 Å²	2	52.9 Å²	52.9	2%	0.017	32%	0.319	C	S	.	.	H	α-helix	trans	-61.6	-47.8	172.3	0	0	0	0	0	111.7	T581 F587 L588 E589 L617 V618	T581-A585 VanDerWaalsContact O-CB 3.22Å; T581-A585 WeakPolarHBondContact O-CB 3.42Å; T581-A585 PolarHBondContact O-N 3.45Å; A585-F587 VanDerWaalsContact C-N 3.25Å; A585-F587 PolarHBondContact O-N 3.33Å; A585-L588 PolarHBondContact O-N 3.48Å; A585-L588 VanDerWaalsContact O-N 3.14Å; A585-E589 PolarHBondContact O-N 3.11Å; A585-E589 VanDerWaalsContact O-N 3.12Å; A585-L617 HydrophobicContact CB-CB 4.19Å; A585-L617 HydrophobicContact CB-CD2 3.72Å; A585-L617 HydrophobicContact CB-CG 3.92Å; A585-V618 VanDerWaalsContact CA-CG2 3.49Å; A585-V618 HydrophobicContact CB-CG2 3.62Å
586	A	91	Very high	88.7	Confident	53 Å²	53	54.9 Å²	54.9	44%	0.438	33%	0.328	S	S	.	.	H	α-helix	trans	-60	-34.6	175.4	0	0	0	0	0	112.7	N582 Q583	N582-A586 WeakPolarHBondContact O-CB 3.49Å; N582-A586 PolarHBondContact O-N 3.06Å; Q583-A586 PolarHBondContact O-N 3.36Å
587	F	92.4	Very high	88.5	Confident	3 Å²	3	53.6 Å²	53.6	1%	0.013	32%	0.316	C	S	.	.	H	α-helix	trans	-64.5	-51.3	170.4	166.2	-120.4	0	0	0	112.3	I560 T565 V568 Q583 Y584 A585 E589 T590 V591	I560-F587 HydrophobicContact CB-CD2 4.47Å; I560-F587 HydrophobicContact CD1-CB 3.84Å; I560-F587 HydrophobicContact CD1-CD2 4.11Å; I560-F587 HydrophobicContact CD1-CG 4.27Å; I560-F587 HydrophobicContact CG1-CB 4.36Å; I560-F587 HydrophobicContact CG1-CD2 3.68Å; I560-F587 HydrophobicContact CG1-CE2 4.36Å; I560-F587 HydrophobicContact CG1-CG 4.25Å; I560-F587 HydrophobicContact CG2-CD2 4.15Å; T565-F587 HydrophobicContact CG2-CE2 4.07Å; T565-F587 HydrophobicContact CG2-CZ 3.97Å; V568-F587 HydrophobicContact CB-CD1 4.41Å; V568-F587 HydrophobicContact CB-CE1 4.24Å; V568-F587 HydrophobicContact CB-CZ 4.4Å; V568-F587 HydrophobicContact CG1-CD1 3.92Å; V568-F587 HydrophobicContact CG1-CD2 4.5Å; V568-F587 HydrophobicContact CG1-CE1 4.25Å; V568-F587 HydrophobicContact CG1-CG 4.04Å; V568-F587 HydrophobicContact CG2-CE2 4.23Å; V568-F587 HydrophobicContact CG2-CZ 4.26Å; Q583-F587 PolarHBondContact O-N 3.1Å; Y584-F587 AromaticContact CD2-CD1 4Å; Y584-F587 HydrophobicContact CD2-CD1 4Å; Y584-F587 HydrophobicContact CE1-CD1 4.3Å; Y584-F587 AromaticContact CE2-CD1 3.59Å; Y584-F587 HydrophobicContact CE2-CD1 3.59Å; Y584-F587 AromaticContact CE2-CE1 3.91Å; Y584-F587 HydrophobicContact CE2-CE1 3.91Å; Y584-F587 HydrophobicContact CG-CD1 4.48Å; Y584-F587 AromaticContact CZ-CD1 3.77Å; Y584-F587 AromaticContact CZ-CE1 3.84Å; Y584-F587 WeakPolarHBondContact O-CB 3.21Å; Y584-F587 PolarHBondContact O-N 3.38Å; A585-F587 VanDerWaalsContact C-N 3.25Å; A585-F587 PolarHBondContact O-N 3.33Å; F587-E589 PolarHBondContact O-N 2.9Å; F587-T590 WeakPolarHBondContact O-CB 3.39Å; F587-T590 PolarHBondContact O-N 3.27Å; F587-T590 PolarHBondContact O-OG1 3.1Å; F587-V591 HydrophobicContact CD2-CG2 4.48Å; F587-V591 HydrophobicContact CE1-CG2 4.28Å; F587-V591 HydrophobicContact CE2-CG2 3.99Å; F587-V591 HydrophobicContact CZ-CG2 3.87Å
588	L	90	Very high	88.4	Confident	1 Å²	1	52 Å²	52	1%	0.005	30%	0.3	C	S	.	.	H	α-helix	trans	-60.7	-29.1	-177.6	-68.9	-170.8	0	0	0	113.2	Y584 A585 T590 V591 C600 L601 I614 V618 W654	Y584-L588 HydrophobicContact CD1-CD1 3.98Å; Y584-L588 HydrophobicContact CD1-CD2 4.18Å; Y584-L588 HydrophobicContact CD1-CG 3.83Å; Y584-L588 HydrophobicContact CE1-CD1 3.95Å; Y584-L588 HydrophobicContact CE1-CD2 3.59Å; Y584-L588 HydrophobicContact CE1-CG 3.76Å; Y584-L588 WeakPolarHBondContact O-CG 3.38Å; Y584-L588 PolarHBondContact O-N 3Å; A585-L588 PolarHBondContact O-N 3.48Å; A585-L588 VanDerWaalsContact O-N 3.14Å; L588-T590 PolarHBondContact O-N 2.97Å; L588-V591 HydrophobicContact CD2-CG2 4.35Å; L588-V591 WeakPolarHBondContact O-CB 3.11Å; L588-V591 PolarHBondContact O-N 2.89Å; L588-V591 VanDerWaalsContact O-N 3.12Å; L588-C600 HydrophobicContact CD2-CB 3.62Å; L588-L601 HydrophobicContact CD1-CD2 3.93Å; L588-I614 HydrophobicContact CD1-CG2 3.58Å; L588-V618 HydrophobicContact CB-CG2 3.9Å; L588-V618 HydrophobicContact CD1-CG2 4.28Å; L588-W654 HydrophobicContact CB-CH2 4.07Å; L588-W654 HydrophobicContact CB-CZ2 3.98Å; L588-W654 HydrophobicContact CD1-CE3 4.18Å; L588-W654 HydrophobicContact CD1-CH2 4.29Å; L588-W654 HydrophobicContact CD1-CZ3 3.99Å; L588-W654 HydrophobicContact CD2-CH2 3.66Å; L588-W654 HydrophobicContact CD2-CZ2 4.42Å; L588-W654 HydrophobicContact CD2-CZ3 3.91Å; L588-W654 HydrophobicContact CG-CH2 4.21Å; L588-W654 HydrophobicContact CG-CZ3 4.38Å; L588-W654 WeakPolarHBondContact O-CZ2 3.32Å
589	E	87.9	Confident	88.3	Confident	50 Å²	50	53.8 Å²	53.8	23%	0.234	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-26.4	171.4	-72.7	-172.9	-153.5	0	0	113.9	A585 F587 V618 T621 V622 R625	A585-E589 PolarHBondContact O-N 3.11Å; A585-E589 VanDerWaalsContact O-N 3.12Å; F587-E589 PolarHBondContact O-N 2.9Å; E589-V618 HydrophobicContact CG-CG1 4.16Å; E589-T621 WeakPolarHBondContact OE1-CB 3.26Å; E589-T621 WeakPolarHBondContact OE1-CG2 3.49Å; E589-V622 HydrophobicContact CG-CG2 4.24Å; E589-R625 IonicContact OE2-CZ 2.86Å; E589-R625 IonicContact OE2-NH1 3.96Å; E589-R625 PolarHBondContact OE2-NH1 2.75Å; E589-R625 IonicContact OE2-NH2 2.74Å; E589-R625 PolarHBondContact OE2-NH2 3.18Å
590	T	86.7	Confident	88.3	Confident	73 Å²	73	51 Å²	51	45%	0.448	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-20.6	175.5	71.8	0	0	0	0	112.8	F587 L588 S592	F587-T590 WeakPolarHBondContact O-CB 3.39Å; F587-T590 PolarHBondContact O-N 3.27Å; F587-T590 PolarHBondContact O-OG1 3.1Å; L588-T590 PolarHBondContact O-N 2.97Å; T590-S592 VanDerWaalsContact C-N 3.33Å; T590-S592 PolarHBondContact O-N 3.43Å; T590-S592 PolarHBondContact O-OG 3.34Å
591	V	85.9	Confident	88.2	Confident	6 Å²	6	51.5 Å²	51.5	4%	0.036	28%	0.278	C	S	.	.			trans	-74.2	84.3	-175.1	-175	0	0	0	0	110.7	F587 L588 Q596 R597 W654	F587-V591 HydrophobicContact CD2-CG2 4.48Å; F587-V591 HydrophobicContact CE1-CG2 4.28Å; F587-V591 HydrophobicContact CE2-CG2 3.99Å; F587-V591 HydrophobicContact CZ-CG2 3.87Å; L588-V591 HydrophobicContact CD2-CG2 4.35Å; L588-V591 WeakPolarHBondContact O-CB 3.11Å; L588-V591 PolarHBondContact O-N 2.89Å; L588-V591 VanDerWaalsContact O-N 3.12Å; V591-Q596 HydrophobicContact CG1-CB 3.78Å; V591-R597 HydrophobicContact CG1-CG 4.14Å; V591-W654 HydrophobicContact CB-CH2 4.12Å; V591-W654 HydrophobicContact CB-CZ2 4.15Å; V591-W654 HydrophobicContact CG1-CH2 4.2Å
592	S	77.4	Confident	88.1	Confident	105 Å²	105	56.2 Å²	56.2	73%	0.734	30%	0.298	S	S	*	.			trans	-78	-21.9	-176.1	-61.1	0	0	0	0	113.3	T590	T590-S592 VanDerWaalsContact C-N 3.33Å; T590-S592 PolarHBondContact O-N 3.43Å; T590-S592 PolarHBondContact O-OG 3.34Å
593	Q	82.3	Confident	88.1	Confident	109 Å²	109	53.1 Å²	53.1	51%	0.509	28%	0.282	S	S	.	.			trans	-86.5	125.2	-179.5	-62.9	-173.3	7.3	0	0	111	E595 Q596	Q593-E595 VanDerWaalsContact C-N 3.31Å; Q593-E595 PolarHBondContact O-N 3.48Å; Q593-Q596 HydrophobicContact CB-CB 4.34Å; Q593-Q596 HydrophobicContact CB-CG 3.99Å; Q593-Q596 PolarHBondContact O-N 2.89Å
594	P	79.8	Confident	88.1	Confident	89 Å²	89	50.7 Å²	50.7	58%	0.578	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-33.8	-177.2	26	-34	0	0	0	112.7	Q596 R597 P598	P594-Q596 VanDerWaalsContact C-N 3.29Å; P594-Q596 PolarHBondContact O-N 2.66Å; P594-R597 WeakPolarHBondContact O-CB 3.22Å; P594-R597 PolarHBondContact O-N 3.03Å; P594-P598 WeakPolarHBondContact O-CD 3.41Å
595	E	83.8	Confident	87.9	Confident	172 Å²	172	55.1 Å²	55.1	80%	0.804	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-28.3	-179	-63.2	177	-159.5	0	0	113	Q593	Q593-E595 VanDerWaalsContact C-N 3.31Å; Q593-E595 PolarHBondContact O-N 3.48Å
596	Q	85.3	Confident	87.9	Confident	53 Å²	53	59.3 Å²	59.3	25%	0.248	33%	0.332	C	S	.	.	H	α-helix	trans	-78	-19.7	176.8	-66.3	-177.7	-18.2	0	0	112.7	V591 Q593 P594 R599 C600	V591-Q596 HydrophobicContact CG1-CB 3.78Å; Q593-Q596 HydrophobicContact CB-CB 4.34Å; Q593-Q596 HydrophobicContact CB-CG 3.99Å; Q593-Q596 PolarHBondContact O-N 2.89Å; P594-Q596 VanDerWaalsContact C-N 3.29Å; P594-Q596 PolarHBondContact O-N 2.66Å; Q596-R599 WeakPolarHBondContact O-CB 3.18Å; Q596-R599 PolarHBondContact O-N 3.44Å; Q596-C600 PolarHBondContact O-N 3.06Å; Q596-C600 PolarHBondContact O-SG 3.3Å
597	R	87.8	Confident	87.8	Confident	29 Å²	29	58 Å²	58	11%	0.109	32%	0.321	C	S	.	.	H	α-helix	trans	-63.8	-49.6	-173.7	-57.9	-171.7	175.1	173.2	-9.8	113.4	V591 P594 R599 C600 L601 D650 D653 W654 F657	V591-R597 HydrophobicContact CG1-CG 4.14Å; P594-R597 WeakPolarHBondContact O-CB 3.22Å; P594-R597 PolarHBondContact O-N 3.03Å; R597-R599 VanDerWaalsContact C-N 3.27Å; R597-R599 PolarHBondContact O-N 3.4Å; R597-C600 PolarHBondContact O-N 3.04Å; R597-L601 PolarHBondContact O-N 2.99Å; R597-L601 VanDerWaalsContact O-N 3.16Å; R597-D650 PolarHBondContact NH1-O 3.35Å; R597-D650 PolarHBondContact NH2-O 3.43Å; R597-D653 IonicContact NH1-OD2 3.98Å; R597-D653 PolarHBondContact NH1-OD2 2.97Å; R597-D653 VanDerWaalsContact NH1-OD2 3.13Å; R597-W654 HydrophobicContact CB-CE3 4.08Å; R597-W654 HydrophobicContact CB-CH2 3.54Å; R597-W654 HydrophobicContact CB-CZ2 4.22Å; R597-W654 HydrophobicContact CB-CZ3 3.46Å; R597-W654 VanDerWaalsContact CB-CZ3 3.46Å; R597-W654 HydrophobicContact CG-CE3 4.47Å; R597-W654 HydrophobicContact CG-CH2 3.38Å; R597-W654 HydrophobicContact CG-CZ2 3.63Å; R597-W654 HydrophobicContact CG-CZ3 3.85Å; R597-F657 HydrophobicContact CB-CE2 3.67Å; R597-F657 HydrophobicContact CB-CZ 3.71Å
598	P	88.8	Confident	87.6	Confident	46 Å²	46	61.1 Å²	61.1	30%	0.299	35%	0.354	S	S	.	.	H	α-helix	trans	-61.1	-36.3	175.5	-20.8	32.3	0	0	0	112.6	P594 L601 Q602 F657	P594-P598 WeakPolarHBondContact O-CD 3.41Å; P598-L601 PolarHBondContact O-N 3.5Å; P598-Q602 VanDerWaalsContact O-CG 3.26Å; P598-Q602 WeakPolarHBondContact O-CG 3.27Å; P598-Q602 PolarHBondContact O-N 3.43Å; P598-F657 HydrophobicContact CG-CD1 4.13Å; P598-F657 HydrophobicContact CG-CE1 3.71Å; P598-F657 HydrophobicContact CG-CZ 4.18Å
599	R	89.5	Confident	87.7	Confident	111 Å²	111	62 Å²	62	42%	0.419	36%	0.359	S	S	.	.	H	α-helix	trans	-63.5	-45.9	178.3	176	56.9	173.4	178	-2.6	111.3	D566 Q596 R597 L601 Q602 L603	D566-R599 IonicContact OD1-CZ 3.79Å; D566-R599 IonicContact OD1-NE 2.71Å; D566-R599 PolarHBondContact OD1-NE 3.39Å; D566-R599 IonicContact OD1-NH2 2.66Å; D566-R599 PolarHBondContact OD1-NH2 2.83Å; D566-R599 IonicContact OD2-CZ 2.69Å; D566-R599 IonicContact OD2-NE 2.79Å; D566-R599 IonicContact OD2-NH2 2.72Å; D566-R599 PolarHBondContact OD2-NH2 3.28Å; Q596-R599 WeakPolarHBondContact O-CB 3.18Å; Q596-R599 PolarHBondContact O-N 3.44Å; R597-R599 VanDerWaalsContact C-N 3.27Å; R597-R599 PolarHBondContact O-N 3.4Å; R599-L601 PolarHBondContact O-N 3.13Å; R599-Q602 PolarHBondContact O-N 3.09Å; R599-L603 HydrophobicContact CG-CD1 4.11Å; R599-L603 VanDerWaalsContact O-CG 3.3Å; R599-L603 WeakPolarHBondContact O-CG 3.24Å; R599-L603 PolarHBondContact O-N 3.27Å
600	C	91.1	Very high	87.9	Confident	2 Å²	2	63.8 Å²	63.8	1%	0.014	37%	0.37	C	S	.	.	H	α-helix	trans	-60.5	-45.6	176.1	-63.1	0	0	0	0	111.6	Y584 L588 Q596 R597 Q602 L603 A604	Y584-C600 PolarHBondContact OH-O 3.17Å; L588-C600 HydrophobicContact CD2-CB 3.62Å; Q596-C600 PolarHBondContact O-N 3.06Å; Q596-C600 PolarHBondContact O-SG 3.3Å; R597-C600 PolarHBondContact O-N 3.04Å; C600-Q602 PolarHBondContact O-N 3.48Å; C600-L603 PolarHBondContact O-N 3.01Å; C600-A604 PolarHBondContact O-N 2.99Å
601	L	90.4	Very high	88.1	Confident	15 Å²	15	61.2 Å²	61.2	8%	0.079	35%	0.354	C	S	.	.	H	α-helix	trans	-63.4	-40.7	177.6	-61.4	-172	0	0	0	112.8	L588 R597 P598 R599 L603 A604 T605 V611 T615 W654 F657	L588-L601 HydrophobicContact CD1-CD2 3.93Å; R597-L601 PolarHBondContact O-N 2.99Å; R597-L601 VanDerWaalsContact O-N 3.16Å; P598-L601 PolarHBondContact O-N 3.5Å; R599-L601 PolarHBondContact O-N 3.13Å; L601-L603 VanDerWaalsContact C-N 3.32Å; L601-L603 PolarHBondContact O-N 3.16Å; L601-A604 PolarHBondContact O-N 3.35Å; L601-T605 PolarHBondContact O-N 3.06Å; L601-T605 PolarHBondContact O-OG1 3.35Å; L601-V611 HydrophobicContact CD2-CG1 4.14Å; L601-T615 HydrophobicContact CD1-CG2 4.44Å; L601-T615 HydrophobicContact CD2-CG2 3.85Å; L601-W654 HydrophobicContact CD1-CE3 4.16Å; L601-W654 HydrophobicContact CD2-CE3 3.93Å; L601-W654 HydrophobicContact CD2-CZ3 4Å; L601-W654 HydrophobicContact CG-CE3 4.09Å; L601-W654 HydrophobicContact CG-CZ3 4.06Å; L601-F657 HydrophobicContact CD1-CB 3.87Å; L601-F657 HydrophobicContact CD1-CD2 3.59Å; L601-F657 HydrophobicContact CD1-CG 4.07Å
602	Q	91.1	Very high	88.2	Confident	122 Å²	122	62.6 Å²	62.6	57%	0.57	36%	0.364	S	S	*	.	H	α-helix	trans	-60.3	-40.7	174.5	-73.5	169.1	11.3	0	0	112.4	P598 R599 C600 A606	P598-Q602 VanDerWaalsContact O-CG 3.26Å; P598-Q602 WeakPolarHBondContact O-CG 3.27Å; P598-Q602 PolarHBondContact O-N 3.43Å; R599-Q602 PolarHBondContact O-N 3.09Å; C600-Q602 PolarHBondContact O-N 3.48Å; Q602-A606 WeakPolarHBondContact O-CB 3.48Å; Q602-A606 PolarHBondContact O-N 3.35Å
603	L	91.1	Very high	88.8	Confident	23 Å²	23	58.8 Å²	58.8	12%	0.12	34%	0.339	C	S	.	.	H	α-helix	trans	-69	-37.7	176.8	-69	165.7	0	0	0	112	D566 A569 R599 C600 L601 A606 A607	D566-L603 HydrophobicContact CB-CD1 4.44Å; D566-L603 WeakPolarHBondContact OD1-CD1 3.45Å; A569-L603 HydrophobicContact CB-CB 3.78Å; R599-L603 HydrophobicContact CG-CD1 4.11Å; R599-L603 VanDerWaalsContact O-CG 3.3Å; R599-L603 WeakPolarHBondContact O-CG 3.24Å; R599-L603 PolarHBondContact O-N 3.27Å; C600-L603 PolarHBondContact O-N 3.01Å; L601-L603 VanDerWaalsContact C-N 3.32Å; L601-L603 PolarHBondContact O-N 3.16Å; L603-A606 PolarHBondContact O-N 3.01Å; L603-A607 WeakPolarHBondContact O-CB 3.48Å; L603-A607 PolarHBondContact O-N 2.95Å
604	A	92	Very high	89.3	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-61.5	-46.9	174	0	0	0	0	0	111.6	Y584 C600 L601 A606 A607 G608 L609 V611	Y584-A604 HydrophobicContact CD1-CB 4.34Å; Y584-A604 HydrophobicContact CE1-CB 3.73Å; C600-A604 PolarHBondContact O-N 2.99Å; L601-A604 PolarHBondContact O-N 3.35Å; A604-A606 VanDerWaalsContact C-N 3.35Å; A604-A606 PolarHBondContact O-N 3.3Å; A604-A607 PolarHBondContact O-N 3.45Å; A604-G608 PolarHBondContact O-N 3.37Å; A604-L609 HydrophobicContact CB-CB 4.19Å; A604-L609 HydrophobicContact CB-CD1 4.16Å; A604-L609 WeakPolarHBondContact O-CB 2.92Å; A604-L609 PolarHBondContact O-N 3.41Å; A604-V611 HydrophobicContact CB-CG2 3.88Å
605	T	91.2	Very high	89.8	Confident	94 Å²	94	49.4 Å²	49.4	58%	0.577	29%	0.287	S	S	*	.	H	α-helix	trans	-60	-43.2	173.3	-53.9	0	0	0	0	111.8	L601 A607 G608	L601-T605 PolarHBondContact O-N 3.06Å; L601-T605 PolarHBondContact O-OG1 3.35Å; T605-A607 VanDerWaalsContact C-N 3.3Å; T605-A607 PolarHBondContact O-N 3.25Å; T605-G608 PolarHBondContact O-N 2.93Å; T605-G608 VanDerWaalsContact O-N 3.14Å
606	A	89.9	Confident	90.1	Very high	89 Å²	89	45.1 Å²	45.1	74%	0.736	26%	0.264	S	S	*	.	H	α-helix	trans	-66.4	-29.6	178.4	0	0	0	0	0	113.3	Q602 L603 A604 G608	Q602-A606 WeakPolarHBondContact O-CB 3.48Å; Q602-A606 PolarHBondContact O-N 3.35Å; L603-A606 PolarHBondContact O-N 3.01Å; A604-A606 VanDerWaalsContact C-N 3.35Å; A604-A606 PolarHBondContact O-N 3.3Å; A606-G608 VanDerWaalsContact C-N 3.31Å
607	A	89.3	Confident	90.4	Very high	26 Å²	26	44.3 Å²	44.3	22%	0.215	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-0.8	174.1	0	0	0	0	0	113.9	A569 L603 A604 T605 L609	A569-A607 HydrophobicContact CB-CB 4.07Å; A569-A607 WeakPolarHBondContact O-CB 3.48Å; L603-A607 WeakPolarHBondContact O-CB 3.48Å; L603-A607 PolarHBondContact O-N 2.95Å; A604-A607 PolarHBondContact O-N 3.45Å; T605-A607 VanDerWaalsContact C-N 3.3Å; T605-A607 PolarHBondContact O-N 3.25Å; A607-L609 HydrophobicContact CB-CG 4.37Å
608	G	89.5	Confident	90.5	Very high	69 Å²	69	43 Å²	43	71%	0.711	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.4	18.6	-179.2	0	0	0	0	0	115	A604 T605 A606	A604-G608 PolarHBondContact O-N 3.37Å; T605-G608 PolarHBondContact O-N 2.93Å; T605-G608 VanDerWaalsContact O-N 3.14Å; A606-G608 VanDerWaalsContact C-N 3.31Å
609	L	92	Very high	90.5	Very high	19 Å²	19	40.8 Å²	40.8	10%	0.099	24%	0.242	C	C	.	.			trans	-76.7	147	177.2	-66.5	176.5	0	0	0	111.9	V572 A580 Y584 A604 A607 V611 I614	V572-L609 HydrophobicContact CB-CD1 4.42Å; V572-L609 HydrophobicContact CG1-CD1 4.23Å; V572-L609 HydrophobicContact CG1-CD2 4.32Å; A580-L609 HydrophobicContact CB-CD2 3.82Å; Y584-L609 HydrophobicContact CD1-CD1 4.39Å; Y584-L609 HydrophobicContact CD2-CD1 3.82Å; Y584-L609 HydrophobicContact CE2-CD1 4.29Å; Y584-L609 HydrophobicContact CG-CD1 3.89Å; A604-L609 HydrophobicContact CB-CB 4.19Å; A604-L609 HydrophobicContact CB-CD1 4.16Å; A604-L609 WeakPolarHBondContact O-CB 2.92Å; A604-L609 PolarHBondContact O-N 3.41Å; A607-L609 HydrophobicContact CB-CG 4.37Å; L609-V611 PolarHBondContact O-N 2.73Å; L609-I614 HydrophobicContact CB-CD1 3.76Å; L609-I614 HydrophobicContact CD1-CD1 4.2Å; L609-I614 HydrophobicContact CG-CD1 4.47Å
610	D	91.1	Very high	90.5	Very high	88 Å²	88	37.3 Å²	37.3	47%	0.471	23%	0.231	S	C	.	.			trans	-74.6	89.8	173.3	-176.2	-9.6	0	0	0	110.8	S612 A613 I614	D610-S612 PolarHBondContact O-N 2.68Å; D610-S612 WeakPolarHBondContact OD1-CA 3.36Å; D610-S612 WeakPolarHBondContact OD1-CB 3.46Å; D610-S612 PolarHBondContact OD1-N 3.41Å; D610-A613 HydrophobicContact CB-CB 4.12Å; D610-A613 PolarHBondContact O-N 3.4Å; D610-A613 PolarHBondContact OD1-N 3.06Å; D610-A613 VanDerWaalsContact OD2-CB 3.31Å; D610-A613 WeakPolarHBondContact OD2-CB 3.2Å; D610-I614 WeakPolarHBondContact O-CB 3.28Å; D610-I614 WeakPolarHBondContact O-CD1 3.47Å; D610-I614 VanDerWaalsContact O-CG1 3.22Å; D610-I614 WeakPolarHBondContact O-CG1 3.11Å; D610-I614 PolarHBondContact O-N 3.25Å
611	V	90.8	Very high	90.4	Very high	18 Å²	18	39.3 Å²	39.3	11%	0.109	24%	0.243	C	C	.	.	H	α-helix	trans	-58.6	-27.6	176.1	178.3	0	0	0	0	112.3	L601 A604 L609 T615	L601-V611 HydrophobicContact CD2-CG1 4.14Å; A604-V611 HydrophobicContact CB-CG2 3.88Å; L609-V611 PolarHBondContact O-N 2.73Å; V611-T615 HydrophobicContact CG1-CG2 4.05Å; V611-T615 WeakPolarHBondContact O-CB 3.39Å; V611-T615 VanDerWaalsContact O-CG2 3.31Å; V611-T615 WeakPolarHBondContact O-CG2 3.18Å; V611-T615 PolarHBondContact O-N 3.11Å; V611-T615 PolarHBondContact O-OG1 2.85Å
612	S	88.7	Confident	90.2	Very high	36 Å²	36	39.5 Å²	39.5	25%	0.252	24%	0.244	S	C	.	.	H	α-helix	trans	-71.4	-51.3	179.1	-154.5	0	0	0	0	111.4	D610 I614 T615 R616 H661	D610-S612 PolarHBondContact O-N 2.68Å; D610-S612 WeakPolarHBondContact OD1-CA 3.36Å; D610-S612 WeakPolarHBondContact OD1-CB 3.46Å; D610-S612 PolarHBondContact OD1-N 3.41Å; S612-I614 VanDerWaalsContact C-N 3.34Å; S612-I614 PolarHBondContact O-N 3.18Å; S612-T615 PolarHBondContact O-OG1 3.45Å; S612-R616 WeakPolarHBondContact O-CB 3.43Å; S612-R616 PolarHBondContact O-N 3.34Å; S612-R616 VanDerWaalsContact O-N 3.09Å; S612-H661 WeakPolarHBondContact CA-NE2 3.42Å; S612-H661 WeakPolarHBondContact CB-NE2 3.44Å; S612-H661 PolarHBondContact OG-CD2 3.14Å; S612-H661 PolarHBondContact OG-NE2 2.92Å
613	A	90.1	Very high	89.9	Confident	25 Å²	25	36 Å²	36	21%	0.207	23%	0.226	C	C	.	.	H	α-helix	trans	-63.5	-40.4	175.7	0	0	0	0	0	111.9	T581 D610 L617	T581-A613 HydrophobicContact CG2-CB 3.89Å; D610-A613 HydrophobicContact CB-CB 4.12Å; D610-A613 PolarHBondContact O-N 3.4Å; D610-A613 PolarHBondContact OD1-N 3.06Å; D610-A613 VanDerWaalsContact OD2-CB 3.31Å; D610-A613 WeakPolarHBondContact OD2-CB 3.2Å; A613-L617 VanDerWaalsContact O-CB 3.26Å; A613-L617 WeakPolarHBondContact O-CB 3.43Å; A613-L617 PolarHBondContact O-N 2.92Å
614	I	91.9	Very high	89.4	Confident	0 Å²	0	41 Å²	41	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-61.1	-55.4	176.9	-75.7	167	0	0	0	111.2	T581 Y584 L588 L609 D610 S612 R616 L617 V618	T581-I614 HydrophobicContact CG2-CG1 3.99Å; Y584-I614 HydrophobicContact CD1-CD1 3.9Å; Y584-I614 HydrophobicContact CD1-CG2 3.89Å; Y584-I614 HydrophobicContact CG-CD1 4.16Å; L588-I614 HydrophobicContact CD1-CG2 3.58Å; L609-I614 HydrophobicContact CB-CD1 3.76Å; L609-I614 HydrophobicContact CD1-CD1 4.2Å; L609-I614 HydrophobicContact CG-CD1 4.47Å; D610-I614 WeakPolarHBondContact O-CB 3.28Å; D610-I614 WeakPolarHBondContact O-CD1 3.47Å; D610-I614 VanDerWaalsContact O-CG1 3.22Å; D610-I614 WeakPolarHBondContact O-CG1 3.11Å; D610-I614 PolarHBondContact O-N 3.25Å; S612-I614 VanDerWaalsContact C-N 3.34Å; S612-I614 PolarHBondContact O-N 3.18Å; I614-R616 PolarHBondContact O-N 3.09Å; I614-L617 PolarHBondContact O-N 3.41Å; I614-L617 VanDerWaalsContact O-N 3.16Å; I614-V618 WeakPolarHBondContact O-CG2 3.21Å; I614-V618 PolarHBondContact O-N 2.97Å
615	T	90.6	Very high	88.5	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-68.5	-35	-174.4	52.6	0	0	0	0	112.2	L601 V611 S612 V619 W654 L655	L601-T615 HydrophobicContact CD1-CG2 4.44Å; L601-T615 HydrophobicContact CD2-CG2 3.85Å; V611-T615 HydrophobicContact CG1-CG2 4.05Å; V611-T615 WeakPolarHBondContact O-CB 3.39Å; V611-T615 VanDerWaalsContact O-CG2 3.31Å; V611-T615 WeakPolarHBondContact O-CG2 3.18Å; V611-T615 PolarHBondContact O-N 3.11Å; V611-T615 PolarHBondContact O-OG1 2.85Å; S612-T615 PolarHBondContact O-OG1 3.45Å; T615-V619 WeakPolarHBondContact O-CG2 3.38Å; T615-V619 PolarHBondContact O-N 3.37Å; T615-W654 HydrophobicContact CG2-CB 4.22Å; T615-L655 WeakPolarHBondContact OG1-CD2 3.46Å
616	R	90.3	Very high	87.1	Confident	82 Å²	82	48.3 Å²	48.3	31%	0.309	27%	0.267	S	S	.	.	H	α-helix	trans	-57.7	-51.9	167.8	-178.1	-174.8	-68.5	105.2	4.3	111.1	S612 I614 V618 V619 E620 E664	S612-R616 WeakPolarHBondContact O-CB 3.43Å; S612-R616 PolarHBondContact O-N 3.34Å; S612-R616 VanDerWaalsContact O-N 3.09Å; I614-R616 PolarHBondContact O-N 3.09Å; R616-V618 PolarHBondContact O-N 3.43Å; R616-V619 PolarHBondContact O-N 3.08Å; R616-E620 HydrophobicContact CG-CG 4.24Å; R616-E620 WeakPolarHBondContact CG-OE1 3.44Å; R616-E620 WeakPolarHBondContact O-CG 3.49Å; R616-E620 PolarHBondContact O-N 3.02Å; R616-E664 HydrophobicContact CB-CG 4.47Å; R616-E664 HydrophobicContact CG-CG 4.42Å; R616-E664 IonicContact CZ-OE2 2.82Å; R616-E664 VanDerWaalsContact NE-CD 3.28Å; R616-E664 IonicContact NE-OE1 3.64Å; R616-E664 IonicContact NE-OE2 2.73Å; R616-E664 PolarHBondContact NE-OE2 3.07Å; R616-E664 IonicContact NH2-OE2 2.81Å; R616-E664 PolarHBondContact NH2-OE2 2.83Å
617	L	90.8	Very high	85.6	Confident	37 Å²	37	49.2 Å²	49.2	19%	0.194	26%	0.26	C	S	.	.	H	α-helix	trans	-62.7	-39.4	-175.9	-179.1	61.8	0	0	0	112.9	T581 N582 A585 A613 I614 T621	T581-L617 HydrophobicContact CG2-CD2 3.97Å; N582-L617 VanDerWaalsContact OD1-CD2 3.24Å; N582-L617 WeakPolarHBondContact OD1-CD2 3.46Å; A585-L617 HydrophobicContact CB-CB 4.19Å; A585-L617 HydrophobicContact CB-CD2 3.72Å; A585-L617 HydrophobicContact CB-CG 3.92Å; A613-L617 VanDerWaalsContact O-CB 3.26Å; A613-L617 WeakPolarHBondContact O-CB 3.43Å; A613-L617 PolarHBondContact O-N 2.92Å; I614-L617 PolarHBondContact O-N 3.41Å; I614-L617 VanDerWaalsContact O-N 3.16Å; L617-T621 VanDerWaalsContact O-CB 3.3Å; L617-T621 WeakPolarHBondContact O-CB 3.39Å; L617-T621 PolarHBondContact O-N 3.46Å; L617-T621 PolarHBondContact O-OG1 3.44Å
618	V	90.9	Very high	83.7	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.006	29%	0.285	C	S	.	.	H	α-helix	trans	-59.2	-49.9	174.2	173.9	0	0	0	0	110.7	A585 L588 E589 I614 R616 T621 V622 V651 W654	A585-V618 VanDerWaalsContact CA-CG2 3.49Å; A585-V618 HydrophobicContact CB-CG2 3.62Å; L588-V618 HydrophobicContact CB-CG2 3.9Å; L588-V618 HydrophobicContact CD1-CG2 4.28Å; E589-V618 HydrophobicContact CG-CG1 4.16Å; I614-V618 WeakPolarHBondContact O-CG2 3.21Å; I614-V618 PolarHBondContact O-N 2.97Å; R616-V618 PolarHBondContact O-N 3.43Å; V618-T621 PolarHBondContact O-N 3.3Å; V618-V622 WeakPolarHBondContact O-CG2 3.35Å; V618-V622 PolarHBondContact O-N 3.42Å; V618-V622 VanDerWaalsContact O-N 3.11Å; V618-V651 HydrophobicContact CG1-CG2 3.71Å; V618-W654 HydrophobicContact CG1-CG 4.46Å
619	V	89.3	Confident	81.8	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-64	-45.3	-179.5	172.6	0	0	0	0	111.3	T615 R616 T621 R623 V651 L655 Q668	T615-V619 WeakPolarHBondContact O-CG2 3.38Å; T615-V619 PolarHBondContact O-N 3.37Å; R616-V619 PolarHBondContact O-N 3.08Å; V619-T621 PolarHBondContact O-N 3.23Å; V619-R623 VanDerWaalsContact O-CB 3.23Å; V619-R623 WeakPolarHBondContact O-CB 3.31Å; V619-R623 PolarHBondContact O-N 3.45Å; V619-V651 HydrophobicContact CB-CG1 4.41Å; V619-V651 HydrophobicContact CB-CG2 4.47Å; V619-V651 HydrophobicContact CG1-CG1 4.19Å; V619-V651 HydrophobicContact CG2-CG1 4.18Å; V619-V651 HydrophobicContact CG2-CG2 3.95Å; V619-V651 WeakPolarHBondContact CG2-O 3.42Å; V619-L655 HydrophobicContact CB-CD1 4.11Å; V619-L655 HydrophobicContact CG1-CD1 4.13Å; V619-L655 HydrophobicContact CG2-CD1 3.71Å; V619-L655 HydrophobicContact CG2-CG 3.93Å; V619-Q668 HydrophobicContact CG1-CB 3.61Å; V619-Q668 HydrophobicContact CG1-CG 3.76Å
620	E	88.9	Confident	79.8	Confident	38 Å²	38	52.1 Å²	52.1	18%	0.178	27%	0.273	C	S	.	.	H	α-helix	trans	-63.4	-39.3	177.1	-72	-174.9	-178	0	0	113.3	R616 R623 R624	R616-E620 HydrophobicContact CG-CG 4.24Å; R616-E620 WeakPolarHBondContact CG-OE1 3.44Å; R616-E620 WeakPolarHBondContact O-CG 3.49Å; R616-E620 PolarHBondContact O-N 3.02Å; E620-R623 WeakPolarHBondContact O-CB 3.41Å; E620-R623 PolarHBondContact O-N 2.81Å; E620-R624 WeakPolarHBondContact O-CB 3.42Å; E620-R624 VanDerWaalsContact O-CG 3.3Å; E620-R624 WeakPolarHBondContact O-CG 3.43Å; E620-R624 PolarHBondContact O-N 2.89Å; E620-R624 IonicContact OE2-CZ 2.61Å; E620-R624 IonicContact OE2-NH1 4Å; E620-R624 PolarHBondContact OE2-NH1 3.05Å; E620-R624 IonicContact OE2-NH2 2.71Å; E620-R624 PolarHBondContact OE2-NH2 3.16Å
621	T	88.4	Confident	77.7	Confident	43 Å²	43	53.1 Å²	53.1	26%	0.264	28%	0.282	S	S	.	.	H	α-helix	trans	-69.5	-41.9	-177.8	-56.7	0	0	0	0	111	E589 L617 V618 V619 R623 R624 R625	E589-T621 WeakPolarHBondContact OE1-CB 3.26Å; E589-T621 WeakPolarHBondContact OE1-CG2 3.49Å; L617-T621 VanDerWaalsContact O-CB 3.3Å; L617-T621 WeakPolarHBondContact O-CB 3.39Å; L617-T621 PolarHBondContact O-N 3.46Å; L617-T621 PolarHBondContact O-OG1 3.44Å; V618-T621 PolarHBondContact O-N 3.3Å; V619-T621 PolarHBondContact O-N 3.23Å; T621-R623 VanDerWaalsContact C-N 3.34Å; T621-R624 PolarHBondContact O-N 2.85Å; T621-R625 PolarHBondContact O-N 3.04Å
622	V	86.1	Confident	75.7	Confident	19 Å²	19	56.8 Å²	56.8	12%	0.115	30%	0.298	C	S	.	.	H	α-helix	trans	-66.7	-34.8	171.6	175.9	0	0	0	0	111.7	E589 V618 K648 V651	E589-V622 HydrophobicContact CG-CG2 4.24Å; V618-V622 WeakPolarHBondContact O-CG2 3.35Å; V618-V622 PolarHBondContact O-N 3.42Å; V618-V622 VanDerWaalsContact O-N 3.11Å; V622-K648 HydrophobicContact CG1-CG 4.13Å; V622-V651 HydrophobicContact CB-CB 4.22Å; V622-V651 HydrophobicContact CB-CG1 4.19Å; V622-V651 HydrophobicContact CB-CG2 3.94Å; V622-V651 HydrophobicContact CG1-CB 4.07Å; V622-V651 HydrophobicContact CG1-CG1 4.03Å; V622-V651 HydrophobicContact CG1-CG2 4.31Å; V622-V651 HydrophobicContact CG2-CB 4.46Å; V622-V651 HydrophobicContact CG2-CG2 3.84Å
623	R	84.6	Confident	73.5	Confident	48 Å²	48	63 Å²	63	18%	0.181	32%	0.323	C	S	.	.	H	α-helix	trans	-64.5	-44.3	175.6	-168.7	-172.7	96.1	-164.4	10.7	112.5	V619 E620 T621 I672	V619-R623 VanDerWaalsContact O-CB 3.23Å; V619-R623 WeakPolarHBondContact O-CB 3.31Å; V619-R623 PolarHBondContact O-N 3.45Å; E620-R623 WeakPolarHBondContact O-CB 3.41Å; E620-R623 PolarHBondContact O-N 2.81Å; T621-R623 VanDerWaalsContact C-N 3.34Å; R623-I672 HydrophobicContact CG-CG1 4.09Å
624	R	81.5	Confident	70.9	Confident	129 Å²	129	66.4 Å²	66.4	49%	0.487	35%	0.345	S	S	.	.	H	α-helix	trans	-77.3	-18.5	-175.9	-71.5	177.5	-172.7	119	6.2	114.7	E620 T621 D626 D627	E620-R624 WeakPolarHBondContact O-CB 3.42Å; E620-R624 VanDerWaalsContact O-CG 3.3Å; E620-R624 WeakPolarHBondContact O-CG 3.43Å; E620-R624 PolarHBondContact O-N 2.89Å; E620-R624 IonicContact OE2-CZ 2.61Å; E620-R624 IonicContact OE2-NH1 4Å; E620-R624 PolarHBondContact OE2-NH1 3.05Å; E620-R624 IonicContact OE2-NH2 2.71Å; E620-R624 PolarHBondContact OE2-NH2 3.16Å; T621-R624 PolarHBondContact O-N 2.85Å; R624-D626 VanDerWaalsContact C-N 3.25Å; R624-D626 PolarHBondContact O-N 3.18Å; R624-D626 VanDerWaalsContact O-N 3.16Å; R624-D627 PolarHBondContact O-N 2.79Å
625	R	73.4	Confident	68.4	Low	159 Å²	159	75 Å²	75	60%	0.6	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-35.9	-171.9	-100.4	-172	178.9	125.1	13	115.2	E589 T621	E589-R625 IonicContact OE2-CZ 2.86Å; E589-R625 IonicContact OE2-NH1 3.96Å; E589-R625 PolarHBondContact OE2-NH1 2.75Å; E589-R625 IonicContact OE2-NH2 2.74Å; E589-R625 PolarHBondContact OE2-NH2 3.18Å; T621-R625 PolarHBondContact O-N 3.04Å
626	D	61.1	Low	66.2	Low	88 Å²	88	80.1 Å²	80.1	47%	0.471	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111	36.5	-175.6	-55.2	-32.3	0	0	0	112	R624 A628 K648	R624-D626 VanDerWaalsContact C-N 3.25Å; R624-D626 PolarHBondContact O-N 3.18Å; R624-D626 VanDerWaalsContact O-N 3.16Å; D626-A628 PolarHBondContact O-N 2.93Å; D626-K648 WeakPolarHBondContact OD2-CE 3.25Å; D626-K648 IonicContact OD2-NZ 3.91Å; D626-K648 PolarHBondContact OD2-NZ 3.46Å
627	D	57.8	Low	64.3	Low	109 Å²	109	83.2 Å²	83.2	58%	0.583	44%	0.438	S	S	*	.			trans	-75	57	176.4	-163.8	27.5	0	0	0	112.4	R624 G629	R624-D627 PolarHBondContact O-N 2.79Å; D627-G629 PolarHBondContact O-N 3.37Å; D627-G629 VanDerWaalsContact OD1-CA 3.3Å; D627-G629 WeakPolarHBondContact OD1-CA 3.44Å
628	A	50.6	Low	62.5	Low	91 Å²	91	88.2 Å²	88.2	75%	0.752	46%	0.461	S	S	*	.			trans	-66.3	76.9	151.5	0	0	0	0	0	107.2	D626	D626-A628 PolarHBondContact O-N 2.93Å
629	G	49	Very low	61.2	Low	31 Å²	31	91.9 Å²	91.9	32%	0.32	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	158.9	-159.5	0	0	0	0	0	115.4	D627 T631	D627-G629 PolarHBondContact O-N 3.37Å; D627-G629 VanDerWaalsContact OD1-CA 3.3Å; D627-G629 WeakPolarHBondContact OD1-CA 3.44Å; G629-T631 WeakPolarHBondContact O-CA 3.37Å; G629-T631 VanDerWaalsContact O-CB 3.29Å; G629-T631 WeakPolarHBondContact O-CB 3.37Å; G629-T631 VanDerWaalsContact O-CG2 3.27Å; G629-T631 WeakPolarHBondContact O-CG2 3.36Å; G629-T631 PolarHBondContact O-N 3.43Å; G629-T631 PolarHBondContact O-OG1 2.94Å
630	F	49.2	Very low	60.4	Low	52 Å²	52	94 Å²	94	23%	0.228	51%	0.505	C	S	.	.	T	Hydrogen-bonded Turn	trans	-40.6	62.5	-163.1	-143.5	-84.9	0	0	0	117.3	H632 A678 Q822 A825 L826	F630-H632 AromaticContact CE1-NE2 3.79Å; F630-A678 HydrophobicContact CD2-CB 4.38Å; F630-A678 HydrophobicContact CE1-CB 3.96Å; F630-A678 HydrophobicContact CE2-CB 3.53Å; F630-A678 HydrophobicContact CZ-CB 3.29Å; F630-Q822 HydrophobicContact CD2-CG 3.79Å; F630-Q822 HydrophobicContact CE2-CB 4.12Å; F630-Q822 HydrophobicContact CE2-CG 3.79Å; F630-A825 HydrophobicContact CD1-CB 3.98Å; F630-A825 HydrophobicContact CE1-CB 3.41Å; F630-A825 VanDerWaalsContact CE1-CB 3.41Å; F630-A825 HydrophobicContact CZ-CB 4.16Å; F630-L826 HydrophobicContact CZ-CD2 4.37Å; F630-L826 HydrophobicContact CZ-CG 4.17Å
631	T	48.8	Very low	60.1	Low	110 Å²	110	95.1 Å²	95.1	68%	0.675	51%	0.514	S	S	*	.			trans	-101.8	104.1	-168.8	37.6	0	0	0	0	110.9	G629 H633	G629-T631 WeakPolarHBondContact O-CA 3.37Å; G629-T631 VanDerWaalsContact O-CB 3.29Å; G629-T631 WeakPolarHBondContact O-CB 3.37Å; G629-T631 VanDerWaalsContact O-CG2 3.27Å; G629-T631 WeakPolarHBondContact O-CG2 3.36Å; G629-T631 PolarHBondContact O-N 3.43Å; G629-T631 PolarHBondContact O-OG1 2.94Å; T631-H633 PolarHBondContact O-N 3.39Å
632	H	47.2	Very low	59.9	Low	95 Å²	95	95.2 Å²	95.2	44%	0.44	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	8.9	-171.2	-98.5	-82.9	0	0	0	117.6	F630	F630-H632 AromaticContact CE1-NE2 3.79Å
633	H	42.1	Very low	59.8	Low	166 Å²	166	102 Å²	102	77%	0.769	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.9	7.6	-160.9	-75.2	6.1	0	0	0	116.4	T631 Q635	T631-H633 PolarHBondContact O-N 3.39Å; H633-Q635 PolarHBondContact O-N 2.98Å
634	S	36.7	Very low	59.7	Low	96 Å²	96	103.2 Å²	103.2	67%	0.671	56%	0.556	S	S	*	*			trans	-69.8	117.1	172	-164.7	0	0	0	0	110.9	T636	S634-T636 VanDerWaalsContact C-N 3.3Å; S634-T636 PolarHBondContact O-N 3.02Å; S634-T636 PolarHBondContact OG-OG1 3.12Å
635	Q	40	Very low	59.9	Low	182 Å²	182	97.3 Å²	97.3	85%	0.85	53%	0.534	S	S	*	.			trans	-86.5	6.6	-173.2	-65.1	-176.2	-10.4	0	0	114.1	H633 L637	H633-Q635 PolarHBondContact O-N 2.98Å; Q635-L637 PolarHBondContact O-N 3.37Å
636	T	43.3	Very low	60.6	Low	107 Å²	107	93.4 Å²	93.4	66%	0.656	52%	0.522	S	S	*	.			trans	-87.3	97.9	175.5	45.8	0	0	0	0	110.9	S634 E638	S634-T636 VanDerWaalsContact C-N 3.3Å; S634-T636 PolarHBondContact O-N 3.02Å; S634-T636 PolarHBondContact OG-OG1 3.12Å; T636-E638 VanDerWaalsContact C-N 3.28Å; T636-E638 PolarHBondContact O-N 3.16Å
637	L	50.2	Low	61.9	Low	147 Å²	147	94.8 Å²	94.8	77%	0.77	52%	0.524	S	S	*	.			trans	-74.3	75.1	175	-75.5	89.9	0	0	0	112	Q635 T639	Q635-L637 PolarHBondContact O-N 3.37Å; L637-T639 HydrophobicContact CB-CG2 4.32Å; L637-T639 HydrophobicContact CD2-CG2 4.4Å; L637-T639 PolarHBondContact O-N 3.03Å
638	E	53.4	Low	63.3	Low	141 Å²	141	91 Å²	91	66%	0.659	50%	0.503	S	S	*	.			trans	-88	78.8	158.3	-69.1	-166.4	171.3	0	0	109.2	T636 G640 K681	T636-E638 VanDerWaalsContact C-N 3.28Å; T636-E638 PolarHBondContact O-N 3.16Å; E638-G640 VanDerWaalsContact C-N 3.25Å; E638-G640 PolarHBondContact O-N 2.75Å; E638-K681 WeakPolarHBondContact O-CE 3.4Å
639	T	63.3	Low	65.2	Low	78 Å²	78	86.8 Å²	86.8	48%	0.479	47%	0.467	S	S	.	.			trans	-79.5	-3.9	-179.5	54.2	0	0	0	0	113.9	L637	L637-T639 HydrophobicContact CB-CG2 4.32Å; L637-T639 HydrophobicContact CD2-CG2 4.4Å; L637-T639 PolarHBondContact O-N 3.03Å
640	G	72.6	Confident	67.1	Low	44 Å²	44	87.6 Å²	87.6	45%	0.454	46%	0.464	S	S	.	.	S	Bend	trans	-86.9	152.3	176.5	0	0	0	0	0	112.7	E638 T642	E638-G640 VanDerWaalsContact C-N 3.25Å; E638-G640 PolarHBondContact O-N 2.75Å; G640-T642 PolarHBondContact O-N 3.14Å
641	T	82.1	Confident	69.1	Low	62 Å²	62	85.4 Å²	85.4	38%	0.38	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-67.2	118.1	172.5	-47.1	0	0	0	0	110.3	D645 I649 A684	T641-D645 WeakPolarHBondContact CA-OD2 3.39Å; T641-D645 HydrophobicContact CG2-CB 3.72Å; T641-I649 HydrophobicContact CG2-CD1 3.97Å; T641-A684 HydrophobicContact CG2-CB 4.16Å
642	T	85.6	Confident	71.1	Confident	46 Å²	46	80.1 Å²	80.1	28%	0.282	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-84.3	171.7	175.1	74	0	0	0	0	111.3	G640 D644 D645 Q646	G640-T642 PolarHBondContact O-N 3.14Å; T642-D644 PolarHBondContact O-N 3.09Å; T642-D644 PolarHBondContact OG1-N 3.31Å; T642-D645 PolarHBondContact N-OD2 2.88Å; T642-D645 PolarHBondContact O-N 3.19Å; T642-D645 VanDerWaalsContact OG1-CG 3.32Å; T642-D645 PolarHBondContact OG1-N 3.1Å; T642-D645 VanDerWaalsContact OG1-N 3.11Å; T642-D645 PolarHBondContact OG1-OD2 2.99Å; T642-Q646 PolarHBondContact O-N 3.1Å
643	Q	83.4	Confident	73.1	Confident	161 Å²	161	77.3 Å²	77.3	75%	0.752	41%	0.411	S	S	*	.	H	α-helix	trans	-63.8	-27.4	173.3	-68.2	-173.1	-5.8	0	0	112.7	K647	Q643-K647 WeakPolarHBondContact O-CG 3.4Å; Q643-K647 PolarHBondContact O-N 2.99Å; Q643-K647 VanDerWaalsContact O-N 3.09Å
644	D	81.8	Confident	75.4	Confident	74 Å²	74	69.6 Å²	69.6	40%	0.396	38%	0.375	S	S	.	.	H	α-helix	trans	-83.9	-30.4	177.9	-59.7	-60.8	0	0	0	112.4	T642 Q646 K647 K648	T642-D644 PolarHBondContact O-N 3.09Å; T642-D644 PolarHBondContact OG1-N 3.31Å; D644-Q646 VanDerWaalsContact C-N 3.3Å; D644-K647 PolarHBondContact O-N 3.19Å; D644-K647 WeakPolarHBondContact OD1-CD 3.4Å; D644-K647 WeakPolarHBondContact OD1-CE 3.25Å; D644-K647 IonicContact OD1-NZ 2.9Å; D644-K647 PolarHBondContact OD1-NZ 3.33Å; D644-K648 WeakPolarHBondContact O-CG 3.41Å; D644-K648 PolarHBondContact O-N 3.29Å
645	D	86.6	Confident	78	Confident	5 Å²	5	65 Å²	65	3%	0.027	34%	0.343	C	S	.	.	H	α-helix	trans	-60.9	-42.5	163.9	-57.4	-36.9	0	0	0	110.4	T641 T642 K647 K648 I649 F676 K681	T641-D645 WeakPolarHBondContact CA-OD2 3.39Å; T641-D645 HydrophobicContact CG2-CB 3.72Å; T642-D645 PolarHBondContact N-OD2 2.88Å; T642-D645 PolarHBondContact O-N 3.19Å; T642-D645 VanDerWaalsContact OG1-CG 3.32Å; T642-D645 PolarHBondContact OG1-N 3.1Å; T642-D645 VanDerWaalsContact OG1-N 3.11Å; T642-D645 PolarHBondContact OG1-OD2 2.99Å; D645-K647 PolarHBondContact O-N 2.62Å; D645-K648 WeakPolarHBondContact O-CB 3.35Å; D645-K648 PolarHBondContact O-N 3.45Å; D645-K648 VanDerWaalsContact O-N 3.1Å; D645-I649 WeakPolarHBondContact O-CG1 3.46Å; D645-I649 PolarHBondContact O-N 2.85Å; D645-F676 HydrophobicContact CB-CE1 3.76Å; D645-F676 HydrophobicContact CB-CZ 3.84Å; D645-F676 WeakPolarHBondContact OD1-CE1 3.3Å; D645-K681 IonicContact OD1-NZ 2.76Å; D645-K681 PolarHBondContact OD1-NZ 3.27Å; D645-K681 WeakPolarHBondContact OD2-CD 3.29Å; D645-K681 WeakPolarHBondContact OD2-CE 3.47Å; D645-K681 IonicContact OD2-NZ 2.93Å; D645-K681 PolarHBondContact OD2-NZ 2.74Å
646	Q	88.9	Confident	80.4	Confident	76 Å²	76	58.1 Å²	58.1	36%	0.355	31%	0.312	S	S	.	.	H	α-helix	trans	-62	-40.7	177.5	-172.5	59.1	45.1	0	0	112	T642 D644 K648 I649 D650	T642-Q646 PolarHBondContact O-N 3.1Å; D644-Q646 VanDerWaalsContact C-N 3.3Å; Q646-K648 VanDerWaalsContact C-N 3.29Å; Q646-K648 PolarHBondContact O-N 2.91Å; Q646-I649 CarbonylContact O-C 3.53Å; Q646-I649 WeakPolarHBondContact O-CB 3.42Å; Q646-I649 PolarHBondContact O-N 3.09Å; Q646-I649 VanDerWaalsContact O-N 3.09Å; Q646-D650 WeakPolarHBondContact CG-OD2 3.37Å; Q646-D650 PolarHBondContact NE2-OD1 3.37Å; Q646-D650 PolarHBondContact NE2-OD2 3Å; Q646-D650 WeakPolarHBondContact O-CB 3.39Å; Q646-D650 PolarHBondContact O-N 3.12Å
647	K	86.7	Confident	82.5	Confident	117 Å²	117	57.2 Å²	57.2	51%	0.509	30%	0.299	S	S	.	.	H	α-helix	trans	-59.1	-37.1	172.2	-69.2	166.8	-161.7	166	0	112.7	Q643 D644 D645 D650 V651	Q643-K647 WeakPolarHBondContact O-CG 3.4Å; Q643-K647 PolarHBondContact O-N 2.99Å; Q643-K647 VanDerWaalsContact O-N 3.09Å; D644-K647 PolarHBondContact O-N 3.19Å; D644-K647 WeakPolarHBondContact OD1-CD 3.4Å; D644-K647 WeakPolarHBondContact OD1-CE 3.25Å; D644-K647 IonicContact OD1-NZ 2.9Å; D644-K647 PolarHBondContact OD1-NZ 3.33Å; D645-K647 PolarHBondContact O-N 2.62Å; K647-D650 CarbonylContact O-C 3.57Å; K647-D650 PolarHBondContact O-N 2.76Å; K647-V651 PolarHBondContact O-N 2.84Å
648	K	88.2	Confident	84.1	Confident	30 Å²	30	53.4 Å²	53.4	13%	0.13	28%	0.279	C	S	.	.	H	α-helix	trans	-71.6	-30.6	174.9	-65.1	165.7	-169.3	162.9	0	112.6	V622 D626 D644 D645 Q646 I672 F676	V622-K648 HydrophobicContact CG1-CG 4.13Å; D626-K648 WeakPolarHBondContact OD2-CE 3.25Å; D626-K648 IonicContact OD2-NZ 3.91Å; D626-K648 PolarHBondContact OD2-NZ 3.46Å; D644-K648 WeakPolarHBondContact O-CG 3.41Å; D644-K648 PolarHBondContact O-N 3.29Å; D645-K648 WeakPolarHBondContact O-CB 3.35Å; D645-K648 PolarHBondContact O-N 3.45Å; D645-K648 VanDerWaalsContact O-N 3.1Å; Q646-K648 VanDerWaalsContact C-N 3.29Å; Q646-K648 PolarHBondContact O-N 2.91Å; K648-I672 HydrophobicContact CB-CG2 4.27Å; K648-F676 HydrophobicContact CB-CZ 4.19Å; K648-F676 HydrophobicContact CD-CZ 4.43Å
649	I	90.5	Very high	85.7	Confident	3 Å²	3	49.5 Å²	49.5	2%	0.015	27%	0.266	C	S	.	.	H	α-helix	trans	-69.7	-37	170.1	-66.3	156.3	0	0	0	110.3	T641 D645 Q646 F676 A684 A687 V688 K691	T641-I649 HydrophobicContact CG2-CD1 3.97Å; D645-I649 WeakPolarHBondContact O-CG1 3.46Å; D645-I649 PolarHBondContact O-N 2.85Å; Q646-I649 CarbonylContact O-C 3.53Å; Q646-I649 WeakPolarHBondContact O-CB 3.42Å; Q646-I649 PolarHBondContact O-N 3.09Å; Q646-I649 VanDerWaalsContact O-N 3.09Å; I649-F676 HydrophobicContact CD1-CE2 4.37Å; I649-F676 HydrophobicContact CG1-CE2 3.96Å; I649-F676 HydrophobicContact CG1-CZ 4.34Å; I649-A684 HydrophobicContact CD1-CB 4.22Å; I649-A687 HydrophobicContact CD1-CB 3.77Å; I649-A687 HydrophobicContact CG1-CB 4.27Å; I649-A687 HydrophobicContact CG2-CB 4.16Å; I649-V688 HydrophobicContact CG1-CG2 3.77Å; I649-K691 HydrophobicContact CG2-CD 3.97Å; I649-K691 WeakPolarHBondContact O-CD 3.33Å; I649-K691 PolarHBondContact O-NZ 3.49Å
650	D	89.2	Confident	86.8	Confident	48 Å²	48	48.6 Å²	48.6	26%	0.257	27%	0.267	S	S	.	.	H	α-helix	trans	-88.8	-6.3	-175.7	-64.6	-27.3	0	0	0	115.3	R597 Q646 K647 D653 K691	R597-D650 PolarHBondContact NH1-O 3.35Å; R597-D650 PolarHBondContact NH2-O 3.43Å; Q646-D650 WeakPolarHBondContact CG-OD2 3.37Å; Q646-D650 PolarHBondContact NE2-OD1 3.37Å; Q646-D650 PolarHBondContact NE2-OD2 3Å; Q646-D650 WeakPolarHBondContact O-CB 3.39Å; Q646-D650 PolarHBondContact O-N 3.12Å; K647-D650 CarbonylContact O-C 3.57Å; K647-D650 PolarHBondContact O-N 2.76Å; D650-D653 VanDerWaalsContact O-OD2 3.12Å; D650-K691 IonicContact OD1-NZ 2.83Å; D650-K691 PolarHBondContact OD1-NZ 3.39Å
651	V	89.6	Confident	87.6	Confident	5 Å²	5	47.5 Å²	47.5	3%	0.03	25%	0.25	C	C	.	.	H	α-helix	trans	-79.5	-26	171.1	81.8	0	0	0	0	112.1	V618 V619 V622 K647 D653 W654	V618-V651 HydrophobicContact CG1-CG2 3.71Å; V619-V651 HydrophobicContact CB-CG1 4.41Å; V619-V651 HydrophobicContact CB-CG2 4.47Å; V619-V651 HydrophobicContact CG1-CG1 4.19Å; V619-V651 HydrophobicContact CG2-CG1 4.18Å; V619-V651 HydrophobicContact CG2-CG2 3.95Å; V619-V651 WeakPolarHBondContact CG2-O 3.42Å; V622-V651 HydrophobicContact CB-CB 4.22Å; V622-V651 HydrophobicContact CB-CG1 4.19Å; V622-V651 HydrophobicContact CB-CG2 3.94Å; V622-V651 HydrophobicContact CG1-CB 4.07Å; V622-V651 HydrophobicContact CG1-CG1 4.03Å; V622-V651 HydrophobicContact CG1-CG2 4.31Å; V622-V651 HydrophobicContact CG2-CB 4.46Å; V622-V651 HydrophobicContact CG2-CG2 3.84Å; K647-V651 PolarHBondContact O-N 2.84Å; V651-D653 PolarHBondContact O-N 3Å; V651-W654 WeakPolarHBondContact O-CB 3.5Å; V651-W654 PolarHBondContact O-N 2.55Å
652	I	90.8	Very high	88	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-30	-177.6	-59.7	174.4	0	0	0	111.7	W654 L655 L656 S669 I672 V688	I652-W654 PolarHBondContact O-N 3.37Å; I652-W654 VanDerWaalsContact O-N 3.1Å; I652-L655 PolarHBondContact O-N 2.84Å; I652-L656 HydrophobicContact CG2-CD1 4.07Å; I652-L656 HydrophobicContact CG2-CG 4.31Å; I652-S669 WeakPolarHBondContact CG2-OG 3.38Å; I652-I672 HydrophobicContact CD1-CD1 3.79Å; I652-I672 HydrophobicContact CG1-CD1 3.76Å; I652-V688 HydrophobicContact CD1-CB 4.21Å; I652-V688 HydrophobicContact CD1-CG1 3.47Å; I652-V688 VanDerWaalsContact CD1-CG1 3.47Å; I652-V688 HydrophobicContact CD1-CG2 3.94Å
653	D	90.1	Very high	88.2	Confident	35 Å²	35	44.4 Å²	44.4	19%	0.187	23%	0.231	C	C	.	.	H	α-helix	trans	-54	-33.3	179.3	-54.1	-36.5	0	0	0	112.4	R597 D650 V651 L655 L656 F657 K691	R597-D653 IonicContact NH1-OD2 3.98Å; R597-D653 PolarHBondContact NH1-OD2 2.97Å; R597-D653 VanDerWaalsContact NH1-OD2 3.13Å; D650-D653 VanDerWaalsContact O-OD2 3.12Å; V651-D653 PolarHBondContact O-N 3Å; D653-L655 PolarHBondContact O-N 2.87Å; D653-L656 PolarHBondContact O-N 2.9Å; D653-F657 HydrophobicContact CB-CE2 4.37Å; D653-F657 HydrophobicContact CB-CZ 4.45Å; D653-F657 WeakPolarHBondContact O-CD2 3.35Å; D653-F657 WeakPolarHBondContact O-CE2 3.41Å; D653-F657 PolarHBondContact O-N 2.86Å; D653-K691 WeakPolarHBondContact OD1-CD 3.41Å; D653-K691 WeakPolarHBondContact OD1-CE 3.32Å; D653-K691 IonicContact OD1-NZ 3.32Å; D653-K691 PolarHBondContact OD1-NZ 3.1Å; D653-K691 IonicContact OD2-NZ 3.96Å; D653-K691 PolarHBondContact OD2-NZ 3.45Å
654	W	90.4	Very high	88.6	Confident	4 Å²	4	38 Å²	38	2%	0.015	20%	0.201	C	C	.	.	H	α-helix	trans	-57.6	-33.9	177.3	-68.5	117.9	0	0	0	113.4	L588 V591 R597 L601 T615 V618 V651 I652 F657	L588-W654 HydrophobicContact CB-CH2 4.07Å; L588-W654 HydrophobicContact CB-CZ2 3.98Å; L588-W654 HydrophobicContact CD1-CE3 4.18Å; L588-W654 HydrophobicContact CD1-CH2 4.29Å; L588-W654 HydrophobicContact CD1-CZ3 3.99Å; L588-W654 HydrophobicContact CD2-CH2 3.66Å; L588-W654 HydrophobicContact CD2-CZ2 4.42Å; L588-W654 HydrophobicContact CD2-CZ3 3.91Å; L588-W654 HydrophobicContact CG-CH2 4.21Å; L588-W654 HydrophobicContact CG-CZ3 4.38Å; L588-W654 WeakPolarHBondContact O-CZ2 3.32Å; V591-W654 HydrophobicContact CB-CH2 4.12Å; V591-W654 HydrophobicContact CB-CZ2 4.15Å; V591-W654 HydrophobicContact CG1-CH2 4.2Å; R597-W654 HydrophobicContact CB-CE3 4.08Å; R597-W654 HydrophobicContact CB-CH2 3.54Å; R597-W654 HydrophobicContact CB-CZ2 4.22Å; R597-W654 HydrophobicContact CB-CZ3 3.46Å; R597-W654 VanDerWaalsContact CB-CZ3 3.46Å; R597-W654 HydrophobicContact CG-CE3 4.47Å; R597-W654 HydrophobicContact CG-CH2 3.38Å; R597-W654 HydrophobicContact CG-CZ2 3.63Å; R597-W654 HydrophobicContact CG-CZ3 3.85Å; L601-W654 HydrophobicContact CD1-CE3 4.16Å; L601-W654 HydrophobicContact CD2-CE3 3.93Å; L601-W654 HydrophobicContact CD2-CZ3 4Å; L601-W654 HydrophobicContact CG-CE3 4.09Å; L601-W654 HydrophobicContact CG-CZ3 4.06Å; T615-W654 HydrophobicContact CG2-CB 4.22Å; V618-W654 HydrophobicContact CG1-CG 4.46Å; V651-W654 WeakPolarHBondContact O-CB 3.5Å; V651-W654 PolarHBondContact O-N 2.55Å; I652-W654 PolarHBondContact O-N 3.37Å; I652-W654 VanDerWaalsContact O-N 3.1Å; W654-F657 HydrophobicContact CE3-CD2 4.43Å; W654-F657 HydrophobicContact CE3-CE2 4.16Å
655	L	90.4	Very high	89.2	Confident	1 Å²	1	34.5 Å²	34.5	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-89.5	-6.1	177.5	-65.8	169.6	0	0	0	113.2	T615 V619 I652 D653 H661 E664 A665 Q668	T615-L655 WeakPolarHBondContact OG1-CD2 3.46Å; V619-L655 HydrophobicContact CB-CD1 4.11Å; V619-L655 HydrophobicContact CG1-CD1 4.13Å; V619-L655 HydrophobicContact CG2-CD1 3.71Å; V619-L655 HydrophobicContact CG2-CG 3.93Å; I652-L655 PolarHBondContact O-N 2.84Å; D653-L655 PolarHBondContact O-N 2.87Å; L655-H661 HydrophobicContact CD2-CB 4.12Å; L655-E664 HydrophobicContact CD1-CG 3.99Å; L655-E664 HydrophobicContact CD2-CB 4.34Å; L655-E664 HydrophobicContact CD2-CG 3.95Å; L655-A665 HydrophobicContact CB-CB 3.73Å; L655-Q668 HydrophobicContact CD1-CB 4.16Å; L655-Q668 HydrophobicContact CD1-CG 3.89Å
656	L	90.5	Very high	89.5	Confident	37 Å²	37	34.4 Å²	34.4	19%	0.194	18%	0.182	C	C	.	.	H	α-helix	trans	-97.8	-15.9	-179.3	-65.1	176.8	0	0	0	113.4	I652 D653 D658 A665 K691	I652-L656 HydrophobicContact CG2-CD1 4.07Å; I652-L656 HydrophobicContact CG2-CG 4.31Å; D653-L656 PolarHBondContact O-N 2.9Å; L656-D658 VanDerWaalsContact C-N 3.31Å; L656-D658 PolarHBondContact O-N 3.43Å; L656-A665 HydrophobicContact CD2-CB 3.87Å; L656-K691 HydrophobicContact CD1-CB 4.24Å; L656-K691 VanDerWaalsContact CD1-O 3.27Å; L656-K691 WeakPolarHBondContact CD1-O 3.29Å
657	F	87.4	Confident	89.7	Confident	87 Å²	87	33.1 Å²	33.1	38%	0.382	18%	0.175	S	C	.	.	S	Bend	trans	-66.2	-28.9	176.8	-67.5	-60.8	0	0	0	114	R597 P598 L601 D653 W654	R597-F657 HydrophobicContact CB-CE2 3.67Å; R597-F657 HydrophobicContact CB-CZ 3.71Å; P598-F657 HydrophobicContact CG-CD1 4.13Å; P598-F657 HydrophobicContact CG-CE1 3.71Å; P598-F657 HydrophobicContact CG-CZ 4.18Å; L601-F657 HydrophobicContact CD1-CB 3.87Å; L601-F657 HydrophobicContact CD1-CD2 3.59Å; L601-F657 HydrophobicContact CD1-CG 4.07Å; D653-F657 HydrophobicContact CB-CE2 4.37Å; D653-F657 HydrophobicContact CB-CZ 4.45Å; D653-F657 WeakPolarHBondContact O-CD2 3.35Å; D653-F657 WeakPolarHBondContact O-CE2 3.41Å; D653-F657 PolarHBondContact O-N 2.86Å; W654-F657 HydrophobicContact CE3-CD2 4.43Å; W654-F657 HydrophobicContact CE3-CE2 4.16Å
658	D	85.5	Confident	89.9	Confident	67 Å²	67	27.9 Å²	27.9	36%	0.358	15%	0.152	S	C	.	.	S	Bend	trans	-116	118.9	176.7	-172.1	-18.9	0	0	0	109.7	L656 A660 H661	L656-D658 VanDerWaalsContact C-N 3.31Å; L656-D658 PolarHBondContact O-N 3.43Å; D658-A660 PolarHBondContact O-N 2.9Å; D658-A660 VanDerWaalsContact O-N 3.15Å; D658-A660 WeakPolarHBondContact OD1-CB 3.41Å; D658-A660 PolarHBondContact OD1-N 3.47Å; D658-H661 PolarHBondContact O-N 3.5Å; D658-H661 VanDerWaalsContact O-N 3.11Å; D658-H661 IonicContact OD2-CE1 2.73Å
659	P	86.4	Confident	90.2	Very high	59 Å²	59	26.4 Å²	26.4	38%	0.383	15%	0.146	S	C	.	.	G	3₁₀ helix	trans	-51.7	-32.5	173.6	-27.4	35.8	0	0	0	114.1	H661 R662 E699 Q703	P659-H661 PolarHBondContact O-N 3.48Å; P659-H661 VanDerWaalsContact O-N 3.14Å; P659-R662 VanDerWaalsContact O-CB 3.28Å; P659-R662 WeakPolarHBondContact O-CB 3.41Å; P659-R662 PolarHBondContact O-N 3.28Å; P659-E699 HydrophobicContact CB-CG 4.37Å; P659-Q703 PolarHBondContact O-NE2 3.43Å; P659-Q703 PolarHBondContact O-OE1 3.32Å
660	A	86.1	Confident	90.4	Very high	60 Å²	60	26.3 Å²	26.3	50%	0.496	15%	0.146	S	C	.	.	G	3₁₀ helix	trans	-62.5	-20.9	-178.8	0	0	0	0	0	113.3	D658	D658-A660 PolarHBondContact O-N 2.9Å; D658-A660 VanDerWaalsContact O-N 3.15Å; D658-A660 WeakPolarHBondContact OD1-CB 3.41Å; D658-A660 PolarHBondContact OD1-N 3.47Å
661	H	88.9	Confident	90.5	Very high	20 Å²	20	24.2 Å²	24.2	9%	0.093	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-91.2	7.4	177.5	-61.1	133	0	0	0	113.8	S612 L655 D658 P659 A663 E664 A665	S612-H661 WeakPolarHBondContact CA-NE2 3.42Å; S612-H661 WeakPolarHBondContact CB-NE2 3.44Å; S612-H661 PolarHBondContact OG-CD2 3.14Å; S612-H661 PolarHBondContact OG-NE2 2.92Å; L655-H661 HydrophobicContact CD2-CB 4.12Å; D658-H661 PolarHBondContact O-N 3.5Å; D658-H661 VanDerWaalsContact O-N 3.11Å; D658-H661 IonicContact OD2-CE1 2.73Å; P659-H661 PolarHBondContact O-N 3.48Å; P659-H661 VanDerWaalsContact O-N 3.14Å; H661-A663 VanDerWaalsContact C-N 3.31Å; H661-A663 PolarHBondContact O-N 2.87Å; H661-E664 WeakPolarHBondContact O-CB 3.15Å; H661-E664 PolarHBondContact O-N 3.38Å; H661-A665 PolarHBondContact O-N 3Å
662	R	90.8	Very high	90.6	Very high	21 Å²	21	24.2 Å²	24.2	8%	0.079	14%	0.135	C	C	.	.	H	α-helix	trans	-63.3	-31.5	-171.9	-157.2	71.6	72.7	81.6	5.4	114.5	P659 L666 D695 S696 I700	P659-R662 VanDerWaalsContact O-CB 3.28Å; P659-R662 WeakPolarHBondContact O-CB 3.41Å; P659-R662 PolarHBondContact O-N 3.28Å; R662-L666 WeakPolarHBondContact O-CB 3.45Å; R662-L666 PolarHBondContact O-N 3.2Å; R662-D695 IonicContact CZ-OD1 3.35Å; R662-D695 IonicContact NH1-OD1 2.73Å; R662-D695 PolarHBondContact NH1-OD1 2.94Å; R662-D695 IonicContact NH2-OD1 2.72Å; R662-S696 WeakPolarHBondContact CD-OG 3.33Å; R662-S696 VanDerWaalsContact NH1-CA 3.35Å; R662-S696 PolarHBondContact NH1-OG 3.3Å; R662-I700 HydrophobicContact CB-CG1 4.19Å; R662-I700 HydrophobicContact CG-CG1 4.4Å
663	A	90.9	Very high	90.7	Very high	22 Å²	22	24.2 Å²	24.2	18%	0.182	14%	0.135	C	C	.	.	H	α-helix	trans	-65.1	-43.3	173.2	0	0	0	0	0	111.9	H661 L666 K667 I700	H661-A663 VanDerWaalsContact C-N 3.31Å; H661-A663 PolarHBondContact O-N 2.87Å; A663-L666 PolarHBondContact O-N 2.93Å; A663-K667 WeakPolarHBondContact O-CG 3.5Å; A663-K667 PolarHBondContact O-N 2.73Å; A663-K667 VanDerWaalsContact O-N 3.08Å; A663-I700 HydrophobicContact CB-CD1 4.38Å; A663-I700 HydrophobicContact CB-CG1 4.23Å
664	E	91.4	Very high	90.8	Very high	27 Å²	27	23 Å²	23	13%	0.126	13%	0.127	C	C	.	.	H	α-helix	trans	-66.1	-45.3	175	-170.4	64.3	-125.6	0	0	111.2	R616 L655 H661 L666 K667 Q668	R616-E664 HydrophobicContact CB-CG 4.47Å; R616-E664 HydrophobicContact CG-CG 4.42Å; R616-E664 IonicContact CZ-OE2 2.82Å; R616-E664 VanDerWaalsContact NE-CD 3.28Å; R616-E664 IonicContact NE-OE1 3.64Å; R616-E664 IonicContact NE-OE2 2.73Å; R616-E664 PolarHBondContact NE-OE2 3.07Å; R616-E664 IonicContact NH2-OE2 2.81Å; R616-E664 PolarHBondContact NH2-OE2 2.83Å; L655-E664 HydrophobicContact CD1-CG 3.99Å; L655-E664 HydrophobicContact CD2-CB 4.34Å; L655-E664 HydrophobicContact CD2-CG 3.95Å; H661-E664 WeakPolarHBondContact O-CB 3.15Å; H661-E664 PolarHBondContact O-N 3.38Å; E664-L666 PolarHBondContact O-N 2.86Å; E664-K667 PolarHBondContact O-N 3.17Å; E664-K667 VanDerWaalsContact O-N 3.16Å; E664-Q668 HydrophobicContact CG-CG 4.28Å; E664-Q668 WeakPolarHBondContact O-CG 3.42Å; E664-Q668 PolarHBondContact O-N 3.5Å; E664-Q668 WeakPolarHBondContact OE1-CG 3.28Å; E664-Q668 PolarHBondContact OE1-NE2 3.09Å
665	A	93.1	Very high	90.7	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.008	14%	0.139	C	C	.	.	H	α-helix	trans	-53.3	-41.6	175.1	0	0	0	0	0	111.5	L655 L656 H661 S669	L655-A665 HydrophobicContact CB-CB 3.73Å; L656-A665 HydrophobicContact CD2-CB 3.87Å; H661-A665 PolarHBondContact O-N 3Å; A665-S669 WeakPolarHBondContact O-CB 3.19Å; A665-S669 PolarHBondContact O-N 2.67Å; A665-S669 PolarHBondContact O-OG 2.73Å
666	L	93.7	Very high	90.7	Very high	2 Å²	2	25.2 Å²	25.2	1%	0.01	14%	0.139	C	C	.	.	H	α-helix	trans	-68	-47.5	177.7	-163.9	69.9	0	0	0	112.2	R662 A663 E664 Q668 S669 N670 V692 I700 A720 I721 H724	R662-L666 WeakPolarHBondContact O-CB 3.45Å; R662-L666 PolarHBondContact O-N 3.2Å; A663-L666 PolarHBondContact O-N 2.93Å; E664-L666 PolarHBondContact O-N 2.86Å; L666-Q668 PolarHBondContact O-N 2.85Å; L666-S669 PolarHBondContact O-N 3.13Å; L666-N670 WeakPolarHBondContact O-CB 3.49Å; L666-N670 PolarHBondContact O-N 3.02Å; L666-N670 PolarHBondContact O-OD1 3.39Å; L666-V692 HydrophobicContact CD1-CG1 3.85Å; L666-I700 HydrophobicContact CB-CD1 4.43Å; L666-I700 HydrophobicContact CD2-CD1 3.86Å; L666-A720 HydrophobicContact CD2-CB 4.49Å; L666-I721 HydrophobicContact CD2-CB 4.37Å; L666-I721 HydrophobicContact CD2-CG1 3.54Å; L666-H724 HydrophobicContact CD1-CB 3.96Å; L666-H724 WeakPolarHBondContact CD1-ND1 3.46Å; L666-H724 HydrophobicContact CG-CB 4.4Å
667	K	92.4	Very high	90.7	Very high	50 Å²	50	23.5 Å²	23.5	22%	0.217	13%	0.13	C	C	.	.	H	α-helix	trans	-57.6	-48	176.9	-73.1	175.4	-175.1	174.1	0	111.8	A663 E664 N670 A671 E716 D717 A720	A663-K667 WeakPolarHBondContact O-CG 3.5Å; A663-K667 PolarHBondContact O-N 2.73Å; A663-K667 VanDerWaalsContact O-N 3.08Å; E664-K667 PolarHBondContact O-N 3.17Å; E664-K667 VanDerWaalsContact O-N 3.16Å; K667-N670 PolarHBondContact O-N 3.4Å; K667-A671 PolarHBondContact O-N 2.93Å; K667-A671 VanDerWaalsContact O-N 3.07Å; K667-E716 IonicContact NZ-OE2 3.38Å; K667-E716 PolarHBondContact NZ-OE2 2.97Å; K667-D717 WeakPolarHBondContact CE-OD1 3.27Å; K667-D717 IonicContact NZ-OD1 2.86Å; K667-D717 PolarHBondContact NZ-OD1 3.21Å; K667-A720 HydrophobicContact CG-CB 3.85Å
668	Q	92.4	Very high	90.7	Very high	6 Å²	6	20.4 Å²	20.4	3%	0.028	12%	0.121	C	C	.	.	H	α-helix	trans	-70.6	-40.4	-179.6	-60.5	-66.8	-18	0	0	112.1	V619 L655 E664 L666 N670 A671 I672	V619-Q668 HydrophobicContact CG1-CB 3.61Å; V619-Q668 HydrophobicContact CG1-CG 3.76Å; L655-Q668 HydrophobicContact CD1-CB 4.16Å; L655-Q668 HydrophobicContact CD1-CG 3.89Å; E664-Q668 HydrophobicContact CG-CG 4.28Å; E664-Q668 WeakPolarHBondContact O-CG 3.42Å; E664-Q668 PolarHBondContact O-N 3.5Å; E664-Q668 WeakPolarHBondContact OE1-CG 3.28Å; E664-Q668 PolarHBondContact OE1-NE2 3.09Å; L666-Q668 PolarHBondContact O-N 2.85Å; Q668-N670 VanDerWaalsContact C-N 3.33Å; Q668-N670 PolarHBondContact O-N 2.8Å; Q668-A671 PolarHBondContact O-N 3.46Å; Q668-I672 WeakPolarHBondContact O-CG1 3.2Å; Q668-I672 PolarHBondContact O-N 3.15Å
669	S	94	Very high	90.7	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-59.2	-44.3	174.1	-62.7	0	0	0	0	111.5	I652 A665 L666 I672 M673 V692	I652-S669 WeakPolarHBondContact CG2-OG 3.38Å; A665-S669 WeakPolarHBondContact O-CB 3.19Å; A665-S669 PolarHBondContact O-N 2.67Å; A665-S669 PolarHBondContact O-OG 2.73Å; L666-S669 PolarHBondContact O-N 3.13Å; S669-I672 PolarHBondContact O-N 3.26Å; S669-M673 WeakPolarHBondContact O-CB 3.25Å; S669-M673 WeakPolarHBondContact O-CG 3.29Å; S669-M673 PolarHBondContact O-N 3.45Å; S669-V692 WeakPolarHBondContact OG-CG2 3.37Å
670	N	94.1	Very high	90.6	Very high	1 Å²	1	23.1 Å²	23.1	1%	0.005	13%	0.129	C	C	.	.	H	α-helix	trans	-60.8	-46.7	175.5	-70.9	-6.5	0	0	0	111.4	L666 K667 Q668 I672 M673 R674 A720 H724 I727	L666-N670 WeakPolarHBondContact O-CB 3.49Å; L666-N670 PolarHBondContact O-N 3.02Å; L666-N670 PolarHBondContact O-OD1 3.39Å; K667-N670 PolarHBondContact O-N 3.4Å; Q668-N670 VanDerWaalsContact C-N 3.33Å; Q668-N670 PolarHBondContact O-N 2.8Å; N670-I672 VanDerWaalsContact C-N 3.34Å; N670-I672 PolarHBondContact O-N 3.03Å; N670-M673 CarbonylContact O-C 3.59Å; N670-M673 PolarHBondContact O-N 3.41Å; N670-M673 VanDerWaalsContact O-N 3.17Å; N670-M673 WeakPolarHBondContact OD1-CE 3.14Å; N670-R674 WeakPolarHBondContact O-CG 3.49Å; N670-R674 PolarHBondContact O-N 2.66Å; N670-A720 PolarHBondContact ND2-O 3.47Å; N670-H724 WeakPolarHBondContact OD1-CB 3.38Å; N670-H724 PolarHBondContact OD1-ND1 3.21Å; N670-I727 HydrophobicContact CB-CD1 4.33Å
671	A	91.8	Very high	90.7	Very high	4 Å²	4	21.1 Å²	21.1	3%	0.033	11%	0.11	C	C	.	.	H	α-helix	trans	-59.4	-41	177.8	0	0	0	0	0	113	K667 Q668 R674 N675	K667-A671 PolarHBondContact O-N 2.93Å; K667-A671 VanDerWaalsContact O-N 3.07Å; Q668-A671 PolarHBondContact O-N 3.46Å; A671-R674 PolarHBondContact O-N 3.32Å; A671-N675 PolarHBondContact O-N 2.99Å
672	I	91.1	Very high	90.8	Very high	5 Å²	5	21 Å²	21	3%	0.026	11%	0.109	C	C	.	.	H	α-helix	trans	-67.8	-41.8	175.6	-63.9	163.4	0	0	0	110.6	R623 K648 I652 Q668 S669 N670 R674 N675 F676 V688	R623-I672 HydrophobicContact CG-CG1 4.09Å; K648-I672 HydrophobicContact CB-CG2 4.27Å; I652-I672 HydrophobicContact CD1-CD1 3.79Å; I652-I672 HydrophobicContact CG1-CD1 3.76Å; Q668-I672 WeakPolarHBondContact O-CG1 3.2Å; Q668-I672 PolarHBondContact O-N 3.15Å; S669-I672 PolarHBondContact O-N 3.26Å; N670-I672 VanDerWaalsContact C-N 3.34Å; N670-I672 PolarHBondContact O-N 3.03Å; I672-R674 PolarHBondContact O-N 3.07Å; I672-N675 PolarHBondContact O-N 2.72Å; I672-F676 HydrophobicContact CG2-CD2 3.88Å; I672-F676 HydrophobicContact CG2-CE2 3.45Å; I672-F676 VanDerWaalsContact CG2-CE2 3.45Å; I672-F676 HydrophobicContact CG2-CZ 4.02Å; I672-F676 PolarHBondContact O-N 2.86Å; I672-V688 HydrophobicContact CG2-CG2 3.84Å
673	M	93	Very high	90.7	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-63.6	-37.6	174.5	-73.3	-174	-67.2	0	0	112.8	S669 N670 N675 F676 L677 V688 F689 I727	S669-M673 WeakPolarHBondContact O-CB 3.25Å; S669-M673 WeakPolarHBondContact O-CG 3.29Å; S669-M673 PolarHBondContact O-N 3.45Å; N670-M673 CarbonylContact O-C 3.59Å; N670-M673 PolarHBondContact O-N 3.41Å; N670-M673 VanDerWaalsContact O-N 3.17Å; N670-M673 WeakPolarHBondContact OD1-CE 3.14Å; M673-N675 VanDerWaalsContact C-N 3.29Å; M673-N675 PolarHBondContact O-N 2.94Å; M673-F676 PolarHBondContact O-N 2.9Å; M673-L677 WeakPolarHBondContact O-CB 3.48Å; M673-L677 VanDerWaalsContact O-CG 3.23Å; M673-L677 WeakPolarHBondContact O-CG 3.48Å; M673-L677 PolarHBondContact O-N 2.89Å; M673-V688 HydrophobicContact CE-CG1 4.31Å; M673-V688 HydrophobicContact CG-CB 3.73Å; M673-V688 HydrophobicContact CG-CG1 3.53Å; M673-V688 HydrophobicContact CG-CG2 4.49Å; M673-V688 HydrophobicContact SD-CB 4.25Å; M673-V688 HydrophobicContact SD-CG1 3.95Å; M673-F689 HydrophobicContact CE-CD2 4.45Å; M673-F689 HydrophobicContact SD-CB 3.85Å; M673-F689 HydrophobicContact SD-CD2 4.08Å; M673-F689 HydrophobicContact SD-CG 4.5Å; M673-I727 HydrophobicContact CB-CD1 4.04Å; M673-I727 HydrophobicContact CB-CG2 4.31Å; M673-I727 HydrophobicContact CE-CD1 4.09Å; M673-I727 HydrophobicContact CE-CG2 4.11Å; M673-I727 HydrophobicContact SD-CG2 3.66Å
674	R	91.6	Very high	90.7	Very high	8 Å²	8	24.2 Å²	24.2	3%	0.03	13%	0.125	C	C	.	.	H	α-helix	trans	-55.7	-45.6	174.1	-73	-162.5	-58.3	-94.2	8	111	N670 A671 I672 L677 A678 E723 M806 Q822 L826	N670-R674 WeakPolarHBondContact O-CG 3.49Å; N670-R674 PolarHBondContact O-N 2.66Å; A671-R674 PolarHBondContact O-N 3.32Å; I672-R674 PolarHBondContact O-N 3.07Å; R674-L677 PolarHBondContact O-N 3.27Å; R674-A678 WeakPolarHBondContact O-CB 3.29Å; R674-A678 PolarHBondContact O-N 3.25Å; R674-E723 WeakPolarHBondContact CD-OE1 3.46Å; R674-E723 WeakPolarHBondContact CG-OE1 3.39Å; R674-E723 IonicContact CZ-OE1 3.77Å; R674-E723 IonicContact NE-OE1 3.41Å; R674-E723 IonicContact NH1-OE1 3.47Å; R674-E723 PolarHBondContact NH1-OE1 3.33Å; R674-E723 IonicContact NH1-OE2 3.26Å; R674-E723 PolarHBondContact NH1-OE2 2.8Å; R674-M806 HydrophobicContact CG-CE 4.16Å; R674-Q822 VanDerWaalsContact CZ-OE1 3.28Å; R674-L826 HydrophobicContact CB-CD1 3.75Å; R674-L826 HydrophobicContact CG-CD1 3.7Å
675	N	88.8	Confident	90.8	Very high	49 Å²	49	22.9 Å²	22.9	26%	0.262	12%	0.119	S	C	.	.	H	α-helix	trans	-69	-42.6	179.1	-71.4	-5.5	0	0	0	112.5	A671 I672 M673 L677 A678 L679	A671-N675 PolarHBondContact O-N 2.99Å; I672-N675 PolarHBondContact O-N 2.72Å; M673-N675 VanDerWaalsContact C-N 3.29Å; M673-N675 PolarHBondContact O-N 2.94Å; N675-L677 PolarHBondContact O-N 3.43Å; N675-A678 PolarHBondContact O-N 3.38Å; N675-L679 WeakPolarHBondContact O-CG 3.32Å; N675-L679 PolarHBondContact O-N 2.81Å; N675-L679 VanDerWaalsContact O-N 3.07Å
676	F	89.9	Confident	90.8	Very high	3 Å²	3	25.1 Å²	25.1	1%	0.013	13%	0.128	C	C	.	.	H	α-helix	trans	-65.5	-36.3	175.3	-69.6	-34.2	0	0	0	113.3	D645 K648 I649 I672 M673 L679 Q680 K681 A684 A685 V688	D645-F676 HydrophobicContact CB-CE1 3.76Å; D645-F676 HydrophobicContact CB-CZ 3.84Å; D645-F676 WeakPolarHBondContact OD1-CE1 3.3Å; K648-F676 HydrophobicContact CB-CZ 4.19Å; K648-F676 HydrophobicContact CD-CZ 4.43Å; I649-F676 HydrophobicContact CD1-CE2 4.37Å; I649-F676 HydrophobicContact CG1-CE2 3.96Å; I649-F676 HydrophobicContact CG1-CZ 4.34Å; I672-F676 HydrophobicContact CG2-CD2 3.88Å; I672-F676 HydrophobicContact CG2-CE2 3.45Å; I672-F676 VanDerWaalsContact CG2-CE2 3.45Å; I672-F676 HydrophobicContact CG2-CZ 4.02Å; I672-F676 PolarHBondContact O-N 2.86Å; M673-F676 PolarHBondContact O-N 2.9Å; F676-L679 CarbonylContact O-C 3.58Å; F676-L679 PolarHBondContact O-N 2.72Å; F676-Q680 PolarHBondContact O-N 2.96Å; F676-K681 HydrophobicContact CB-CB 4.36Å; F676-K681 HydrophobicContact CD1-CB 4.43Å; F676-K681 HydrophobicContact CD1-CD 4.38Å; F676-K681 PolarHBondContact O-N 3.46Å; F676-A684 HydrophobicContact CB-CB 4.45Å; F676-A684 HydrophobicContact CD1-CB 4.01Å; F676-A684 HydrophobicContact CD2-CB 3.75Å; F676-A684 HydrophobicContact CE1-CB 4.13Å; F676-A684 HydrophobicContact CE2-CB 3.85Å; F676-A684 HydrophobicContact CG-CB 3.84Å; F676-A684 HydrophobicContact CZ-CB 4.05Å; F676-A685 HydrophobicContact CB-CB 4Å; F676-V688 HydrophobicContact CD2-CG2 4.05Å; F676-V688 HydrophobicContact CE2-CG2 3.72Å
677	L	90.6	Very high	90.8	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.005	14%	0.141	C	C	.	.	H	α-helix	trans	-67.5	-39.1	175.2	-71.6	176.4	0	0	0	112.2	M673 R674 N675 L679 Q680 A685 I727 Y730 L731 L826	M673-L677 WeakPolarHBondContact O-CB 3.48Å; M673-L677 VanDerWaalsContact O-CG 3.23Å; M673-L677 WeakPolarHBondContact O-CG 3.48Å; M673-L677 PolarHBondContact O-N 2.89Å; R674-L677 PolarHBondContact O-N 3.27Å; N675-L677 PolarHBondContact O-N 3.43Å; L677-L679 VanDerWaalsContact C-N 3.35Å; L677-Q680 PolarHBondContact O-N 3.44Å; L677-Q680 VanDerWaalsContact O-N 3.13Å; L677-A685 HydrophobicContact CD2-CB 4.1Å; L677-A685 HydrophobicContact CG-CB 4.28Å; L677-I727 HydrophobicContact CD1-CG1 4.17Å; L677-I727 HydrophobicContact CD1-CG2 4.22Å; L677-Y730 HydrophobicContact CD1-CD1 4.46Å; L677-Y730 HydrophobicContact CD2-CD1 3.7Å; L677-Y730 HydrophobicContact CD2-CE1 3.53Å; L677-L731 HydrophobicContact CD2-CD2 4.15Å; L677-L826 HydrophobicContact CB-CD2 3.82Å
678	A	87.8	Confident	90.9	Very high	23 Å²	23	24.3 Å²	24.3	19%	0.19	13%	0.131	C	C	.	.	H	α-helix	trans	-61.9	-42.6	174.4	0	0	0	0	0	112.1	F630 R674 N675 Q680 L826	F630-A678 HydrophobicContact CD2-CB 4.38Å; F630-A678 HydrophobicContact CE1-CB 3.96Å; F630-A678 HydrophobicContact CE2-CB 3.53Å; F630-A678 HydrophobicContact CZ-CB 3.29Å; R674-A678 WeakPolarHBondContact O-CB 3.29Å; R674-A678 PolarHBondContact O-N 3.25Å; N675-A678 PolarHBondContact O-N 3.38Å; A678-Q680 PolarHBondContact O-N 2.87Å; A678-L826 HydrophobicContact CB-CD2 4.15Å
679	L	85.1	Confident	91	Very high	107 Å²	107	26.2 Å²	26.2	56%	0.56	14%	0.139	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-0.1	175.4	-63.9	175.8	0	0	0	113.9	N675 F676 L677 K681	N675-L679 WeakPolarHBondContact O-CG 3.32Å; N675-L679 PolarHBondContact O-N 2.81Å; N675-L679 VanDerWaalsContact O-N 3.07Å; F676-L679 CarbonylContact O-C 3.58Å; F676-L679 PolarHBondContact O-N 2.72Å; L677-L679 VanDerWaalsContact C-N 3.35Å; L679-K681 HydrophobicContact CB-CG 4.25Å; L679-K681 PolarHBondContact O-N 2.98Å
680	Q	85	Confident	91	Very high	75 Å²	75	31.1 Å²	31.1	35%	0.35	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.8	27.6	-179.2	-45.1	178.2	32.3	0	0	114.1	F676 L677 A678 H682	F676-Q680 PolarHBondContact O-N 2.96Å; L677-Q680 PolarHBondContact O-N 3.44Å; L677-Q680 VanDerWaalsContact O-N 3.13Å; A678-Q680 PolarHBondContact O-N 2.87Å; Q680-H682 VanDerWaalsContact C-N 3.31Å; Q680-H682 PolarHBondContact O-N 2.9Å; Q680-H682 PolarHBondContact O-ND1 3.5Å
681	K	88.8	Confident	90.9	Very high	19 Å²	19	33.3 Å²	33.3	8%	0.083	18%	0.183	C	C	.	.			trans	-88.4	66.7	174.5	-65.1	-173	176.8	-175.6	0	110	E638 D645 F676 L679 D683 A684 A685	E638-K681 WeakPolarHBondContact O-CE 3.4Å; D645-K681 IonicContact OD1-NZ 2.76Å; D645-K681 PolarHBondContact OD1-NZ 3.27Å; D645-K681 WeakPolarHBondContact OD2-CD 3.29Å; D645-K681 WeakPolarHBondContact OD2-CE 3.47Å; D645-K681 IonicContact OD2-NZ 2.93Å; D645-K681 PolarHBondContact OD2-NZ 2.74Å; F676-K681 HydrophobicContact CB-CB 4.36Å; F676-K681 HydrophobicContact CD1-CB 4.43Å; F676-K681 HydrophobicContact CD1-CD 4.38Å; F676-K681 PolarHBondContact O-N 3.46Å; L679-K681 HydrophobicContact CB-CG 4.25Å; L679-K681 PolarHBondContact O-N 2.98Å; K681-D683 VanDerWaalsContact C-N 3.27Å; K681-D683 PolarHBondContact O-N 2.86Å; K681-A684 HydrophobicContact CB-CB 3.98Å; K681-A684 PolarHBondContact O-N 3.03Å; K681-A684 VanDerWaalsContact O-N 3.13Å; K681-A685 PolarHBondContact O-N 2.76Å
682	H	90.1	Very high	91	Very high	17 Å²	17	33.8 Å²	33.8	8%	0.079	19%	0.185	C	C	.	.	H	α-helix	trans	-56.2	-37.9	-174.4	-67.6	82.7	0	0	0	113.5	Q680 A685 K686 Y730 H734 R833	Q680-H682 VanDerWaalsContact C-N 3.31Å; Q680-H682 PolarHBondContact O-N 2.9Å; Q680-H682 PolarHBondContact O-ND1 3.5Å; H682-A685 PolarHBondContact O-N 2.72Å; H682-K686 WeakPolarHBondContact O-CG 3.26Å; H682-K686 PolarHBondContact O-N 2.99Å; H682-Y730 AromaticContact CD2-CE1 3.71Å; H682-Y730 AromaticContact NE2-CE1 3.47Å; H682-Y730 WeakPolarHBondContact NE2-CE1 3.47Å; H682-Y730 AromaticContact NE2-CZ 3.7Å; H682-Y730 PolarHBondContact NE2-OH 3.4Å; H682-H734 AromaticContact CD2-CD2 3.47Å; H682-H734 PolarHBondContact CD2-CD2 3.06Å; H682-H734 VanDerWaalsContact CD2-CD2 3.47Å; H682-H734 AromaticContact CD2-CG 3.7Å; H682-H734 AromaticContact CD2-NE2 3.85Å; H682-H734 AromaticContact CE1-CD2 3.83Å; H682-H734 AromaticContact CE1-NE2 3.63Å; H682-H734 AromaticContact ND1-NE2 3.93Å; H682-H734 AromaticContact NE2-CD2 3.27Å; H682-H734 PolarHBondContact NE2-CD2 2.84Å; H682-H734 VanDerWaalsContact NE2-CD2 3.27Å; H682-H734 AromaticContact NE2-CG 3.98Å; H682-H734 AromaticContact NE2-NE2 3.58Å; H682-R833 PolarHBondContact CE1-NH2 3.23Å
683	D	89.8	Confident	91.1	Very high	110 Å²	110	35.8 Å²	35.8	59%	0.588	20%	0.199	S	C	*	.	H	α-helix	trans	-71.6	-33.4	179.8	-60.1	-40.2	0	0	0	112.5	K681 K686 A687	K681-D683 VanDerWaalsContact C-N 3.27Å; K681-D683 PolarHBondContact O-N 2.86Å; D683-K686 PolarHBondContact O-N 2.79Å; D683-A687 WeakPolarHBondContact O-CB 3.29Å; D683-A687 PolarHBondContact O-N 3.3Å
684	A	91	Very high	90.9	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-68.6	-39.4	171.7	0	0	0	0	0	111.5	T641 I649 F676 K681 A687 V688	T641-A684 HydrophobicContact CG2-CB 4.16Å; I649-A684 HydrophobicContact CD1-CB 4.22Å; F676-A684 HydrophobicContact CB-CB 4.45Å; F676-A684 HydrophobicContact CD1-CB 4.01Å; F676-A684 HydrophobicContact CD2-CB 3.75Å; F676-A684 HydrophobicContact CE1-CB 4.13Å; F676-A684 HydrophobicContact CE2-CB 3.85Å; F676-A684 HydrophobicContact CG-CB 3.84Å; F676-A684 HydrophobicContact CZ-CB 4.05Å; K681-A684 HydrophobicContact CB-CB 3.98Å; K681-A684 PolarHBondContact O-N 3.03Å; K681-A684 VanDerWaalsContact O-N 3.13Å; A684-A687 PolarHBondContact O-N 2.85Å; A684-V688 PolarHBondContact O-N 3.36Å; A684-V688 VanDerWaalsContact O-N 3.07Å
685	A	92.8	Very high	90.9	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-63.4	-40.8	172.9	0	0	0	0	0	112.1	F676 L677 K681 H682 V688 F689 L731	F676-A685 HydrophobicContact CB-CB 4Å; L677-A685 HydrophobicContact CD2-CB 4.1Å; L677-A685 HydrophobicContact CG-CB 4.28Å; K681-A685 PolarHBondContact O-N 2.76Å; H682-A685 PolarHBondContact O-N 2.72Å; A685-V688 PolarHBondContact O-N 3.11Å; A685-F689 WeakPolarHBondContact O-CB 3.19Å; A685-F689 PolarHBondContact O-N 2.94Å; A685-L731 HydrophobicContact CB-CD2 4.14Å
686	K	92.7	Very high	91	Very high	48 Å²	48	46.3 Å²	46.3	21%	0.209	25%	0.249	C	C	.	.	H	α-helix	trans	-61.5	-43.3	170.9	-75.5	-176.4	179.4	-178.6	0	112.3	H682 D683 V688 F689 S690 L731 E735	H682-K686 WeakPolarHBondContact O-CG 3.26Å; H682-K686 PolarHBondContact O-N 2.99Å; D683-K686 PolarHBondContact O-N 2.79Å; K686-V688 VanDerWaalsContact C-N 3.32Å; K686-V688 PolarHBondContact O-N 3.07Å; K686-F689 WeakPolarHBondContact O-CB 3.42Å; K686-F689 PolarHBondContact O-N 2.7Å; K686-F689 VanDerWaalsContact O-N 3.09Å; K686-S690 PolarHBondContact O-N 2.89Å; K686-S690 PolarHBondContact O-OG 2.92Å; K686-L731 HydrophobicContact CG-CD1 4.36Å; K686-L731 HydrophobicContact CG-CD2 4.19Å; K686-E735 VanDerWaalsContact NZ-CD 3.27Å; K686-E735 IonicContact NZ-OE1 3.94Å; K686-E735 PolarHBondContact NZ-OE1 3.27Å
687	A	93.7	Very high	91.1	Very high	35 Å²	35	48.3 Å²	48.3	29%	0.289	26%	0.259	S	S	.	.	H	α-helix	trans	-62.2	-37.4	179.4	0	0	0	0	0	112.7	I649 D683 A684	I649-A687 HydrophobicContact CD1-CB 3.77Å; I649-A687 HydrophobicContact CG1-CB 4.27Å; I649-A687 HydrophobicContact CG2-CB 4.16Å; D683-A687 WeakPolarHBondContact O-CB 3.29Å; D683-A687 PolarHBondContact O-N 3.3Å; A684-A687 PolarHBondContact O-N 2.85Å
688	V	94.1	Very high	91	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-64.9	-49	168.3	173.3	0	0	0	0	111.2	I649 I652 I672 M673 F676 A684 A685 K686 S690 K691	I649-V688 HydrophobicContact CG1-CG2 3.77Å; I652-V688 HydrophobicContact CD1-CB 4.21Å; I652-V688 HydrophobicContact CD1-CG1 3.47Å; I652-V688 VanDerWaalsContact CD1-CG1 3.47Å; I652-V688 HydrophobicContact CD1-CG2 3.94Å; I672-V688 HydrophobicContact CG2-CG2 3.84Å; M673-V688 HydrophobicContact CE-CG1 4.31Å; M673-V688 HydrophobicContact CG-CB 3.73Å; M673-V688 HydrophobicContact CG-CG1 3.53Å; M673-V688 HydrophobicContact CG-CG2 4.49Å; M673-V688 HydrophobicContact SD-CB 4.25Å; M673-V688 HydrophobicContact SD-CG1 3.95Å; F676-V688 HydrophobicContact CD2-CG2 4.05Å; F676-V688 HydrophobicContact CE2-CG2 3.72Å; A684-V688 PolarHBondContact O-N 3.36Å; A684-V688 VanDerWaalsContact O-N 3.07Å; A685-V688 PolarHBondContact O-N 3.11Å; K686-V688 VanDerWaalsContact C-N 3.32Å; K686-V688 PolarHBondContact O-N 3.07Å; V688-S690 VanDerWaalsContact C-N 3.32Å; V688-S690 PolarHBondContact O-N 3.36Å; V688-K691 WeakPolarHBondContact O-CB 3.46Å; V688-K691 PolarHBondContact O-N 3.18Å
689	F	94.6	Very high	91.1	Very high	46 Å²	46	59.5 Å²	59.5	20%	0.202	30%	0.299	C	S	.	.	H	α-helix	trans	-55.7	-46.7	-177.9	-172.5	-89	0	0	0	112	M673 A685 K686 K691 V692 H724 R728 L731	M673-F689 HydrophobicContact CE-CD2 4.45Å; M673-F689 HydrophobicContact SD-CB 3.85Å; M673-F689 HydrophobicContact SD-CD2 4.08Å; M673-F689 HydrophobicContact SD-CG 4.5Å; A685-F689 WeakPolarHBondContact O-CB 3.19Å; A685-F689 PolarHBondContact O-N 2.94Å; K686-F689 WeakPolarHBondContact O-CB 3.42Å; K686-F689 PolarHBondContact O-N 2.7Å; K686-F689 VanDerWaalsContact O-N 3.09Å; F689-K691 PolarHBondContact O-N 2.93Å; F689-V692 PolarHBondContact O-N 2.82Å; F689-H724 AromaticContact CD2-CE1 3.74Å; F689-H724 AromaticContact CD2-NE2 3.94Å; F689-H724 AromaticContact CE2-CD2 3.86Å; F689-H724 AromaticContact CE2-CE1 3.47Å; F689-H724 VanDerWaalsContact CE2-CE1 3.47Å; F689-H724 WeakPolarHBondContact CE2-CE1 3.48Å; F689-H724 AromaticContact CE2-NE2 3.19Å; F689-H724 WeakPolarHBondContact CE2-NE2 3.33Å; F689-H724 AromaticContact CZ-NE2 3.68Å; F689-R728 HydrophobicContact CE1-CG 4.05Å; F689-R728 HydrophobicContact CE2-CB 3.63Å; F689-R728 HydrophobicContact CE2-CG 3.83Å; F689-R728 HydrophobicContact CZ-CB 3.72Å; F689-R728 HydrophobicContact CZ-CG 3.38Å; F689-L731 HydrophobicContact CB-CD1 3.84Å; F689-L731 HydrophobicContact CD2-CD1 4.18Å; F689-L731 HydrophobicContact CG-CD1 4.01Å
690	S	93.9	Very high	91.3	Very high	102 Å²	102	54.7 Å²	54.7	71%	0.713	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-12.6	178.9	-63.5	0	0	0	0	114.9	K686 V688	K686-S690 PolarHBondContact O-N 2.89Å; K686-S690 PolarHBondContact O-OG 2.92Å; V688-S690 VanDerWaalsContact C-N 3.32Å; V688-S690 PolarHBondContact O-N 3.36Å
691	K	92.6	Very high	91.4	Very high	48 Å²	48	56.7 Å²	56.7	21%	0.209	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-26.9	172.2	-78.4	-170.1	169.8	-163.8	0	113.3	I649 D650 D653 L656 V688 F689 P693	I649-K691 HydrophobicContact CG2-CD 3.97Å; I649-K691 WeakPolarHBondContact O-CD 3.33Å; I649-K691 PolarHBondContact O-NZ 3.49Å; D650-K691 IonicContact OD1-NZ 2.83Å; D650-K691 PolarHBondContact OD1-NZ 3.39Å; D653-K691 WeakPolarHBondContact OD1-CD 3.41Å; D653-K691 WeakPolarHBondContact OD1-CE 3.32Å; D653-K691 IonicContact OD1-NZ 3.32Å; D653-K691 PolarHBondContact OD1-NZ 3.1Å; D653-K691 IonicContact OD2-NZ 3.96Å; D653-K691 PolarHBondContact OD2-NZ 3.45Å; L656-K691 HydrophobicContact CD1-CB 4.24Å; L656-K691 VanDerWaalsContact CD1-O 3.27Å; L656-K691 WeakPolarHBondContact CD1-O 3.29Å; V688-K691 WeakPolarHBondContact O-CB 3.46Å; V688-K691 PolarHBondContact O-N 3.18Å; F689-K691 PolarHBondContact O-N 2.93Å; K691-P693 WeakPolarHBondContact O-CD 3.31Å
692	V	93.1	Very high	91.3	Very high	13 Å²	13	58.9 Å²	58.9	8%	0.079	30%	0.296	C	S	.	.	S	Bend	trans	-72.4	114.4	176.7	-179.1	0	0	0	0	108.5	L666 S669 F689	L666-V692 HydrophobicContact CD1-CG1 3.85Å; S669-V692 WeakPolarHBondContact OG-CG2 3.37Å; F689-V692 PolarHBondContact O-N 2.82Å
693	P	93.2	Very high	91.1	Very high	48 Å²	48	60.3 Å²	60.3	31%	0.312	30%	0.303	S	S	.	.			trans	-66.2	145.5	-175.7	-22	34.3	0	0	0	112.1	K691 D695 S696	K691-P693 WeakPolarHBondContact O-CD 3.31Å; P693-D695 WeakPolarHBondContact CB-OD1 3.25Å; P693-D695 PolarHBondContact O-N 2.84Å; P693-D695 VanDerWaalsContact O-N 3.09Å; P693-S696 WeakPolarHBondContact CD-OG 3.44Å; P693-S696 VanDerWaalsContact O-CB 3.23Å; P693-S696 WeakPolarHBondContact O-CB 3.38Å; P693-S696 PolarHBondContact O-N 3.4Å; P693-S696 PolarHBondContact O-OG 3.25Å
694	E	89.3	Confident	90.8	Very high	199 Å²	199	57.9 Å²	57.9	93%	0.93	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-25.2	-176	-61.9	-173.4	170.2	0	0	114	S696	E694-S696 VanDerWaalsContact C-N 3.3Å; E694-S696 PolarHBondContact O-N 3.31Å
695	D	91.6	Very high	90.3	Very high	76 Å²	76	62.4 Å²	62.4	41%	0.406	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-10.1	177.3	67.7	1.5	0	0	0	113.9	R662 P693 M697 R698 E699	R662-D695 IonicContact CZ-OD1 3.35Å; R662-D695 IonicContact NH1-OD1 2.73Å; R662-D695 PolarHBondContact NH1-OD1 2.94Å; R662-D695 IonicContact NH2-OD1 2.72Å; P693-D695 WeakPolarHBondContact CB-OD1 3.25Å; P693-D695 PolarHBondContact O-N 2.84Å; P693-D695 VanDerWaalsContact O-N 3.09Å; D695-M697 VanDerWaalsContact C-N 3.27Å; D695-M697 PolarHBondContact O-N 3.12Å; D695-M697 VanDerWaalsContact O-N 3.09Å; D695-R698 WeakPolarHBondContact O-CA 3.36Å; D695-R698 WeakPolarHBondContact O-CB 3.4Å; D695-R698 PolarHBondContact O-N 3.05Å; D695-E699 PolarHBondContact O-N 3.45Å
696	S	91.4	Very high	89.6	Confident	2 Å²	2	66.5 Å²	66.5	1%	0.014	35%	0.347	C	S	.	.	H	α-helix	trans	-52.2	-41.3	-170.1	-61.6	0	0	0	0	114.1	R662 P693 E694 E699 I700	R662-S696 WeakPolarHBondContact CD-OG 3.33Å; R662-S696 VanDerWaalsContact NH1-CA 3.35Å; R662-S696 PolarHBondContact NH1-OG 3.3Å; P693-S696 WeakPolarHBondContact CD-OG 3.44Å; P693-S696 VanDerWaalsContact O-CB 3.23Å; P693-S696 WeakPolarHBondContact O-CB 3.38Å; P693-S696 PolarHBondContact O-N 3.4Å; P693-S696 PolarHBondContact O-OG 3.25Å; E694-S696 VanDerWaalsContact C-N 3.3Å; E694-S696 PolarHBondContact O-N 3.31Å; S696-E699 PolarHBondContact O-N 3.43Å; S696-I700 WeakPolarHBondContact O-CD1 3.42Å; S696-I700 VanDerWaalsContact O-CG1 3.26Å; S696-I700 WeakPolarHBondContact O-CG1 3.37Å; S696-I700 PolarHBondContact O-N 2.93Å
697	M	91.3	Very high	88.6	Confident	46 Å²	46	69.1 Å²	69.1	23%	0.227	37%	0.367	C	S	.	.	H	α-helix	trans	-63.8	-46.7	177	-61.1	173	-171.5	0	0	110.8	D695 E699 I700 Y701 I721 H724 L725	D695-M697 VanDerWaalsContact C-N 3.27Å; D695-M697 PolarHBondContact O-N 3.12Å; D695-M697 VanDerWaalsContact O-N 3.09Å; M697-E699 VanDerWaalsContact C-N 3.27Å; M697-E699 PolarHBondContact O-N 3.32Å; M697-I700 PolarHBondContact O-N 2.96Å; M697-Y701 VanDerWaalsContact O-CD2 3.31Å; M697-Y701 WeakPolarHBondContact O-CD2 3.49Å; M697-Y701 PolarHBondContact O-N 3.11Å; M697-I721 HydrophobicContact CG-CG2 4.14Å; M697-I721 HydrophobicContact SD-CG2 4.2Å; M697-H724 VanDerWaalsContact CE-CD2 3.49Å; M697-H724 WeakPolarHBondContact CE-CD2 3.49Å; M697-L725 HydrophobicContact CE-CD2 3.71Å; M697-L725 HydrophobicContact CE-CG 3.91Å; M697-L725 HydrophobicContact SD-CD2 4.22Å
698	R	89.2	Confident	87.1	Confident	202 Å²	202	70.5 Å²	70.5	76%	0.762	38%	0.384	S	S	*	.	H	α-helix	trans	-62.7	-38.6	178.6	-61.2	179.9	-179.7	163.2	3.2	111.2	D695 Y701 S702	D695-R698 WeakPolarHBondContact O-CA 3.36Å; D695-R698 WeakPolarHBondContact O-CB 3.4Å; D695-R698 PolarHBondContact O-N 3.05Å; R698-Y701 PolarHBondContact O-N 3.18Å; R698-S702 VanDerWaalsContact O-CB 3.22Å; R698-S702 WeakPolarHBondContact O-CB 3.44Å; R698-S702 PolarHBondContact O-N 3.33Å
699	E	89.3	Confident	85.7	Confident	56 Å²	56	74.4 Å²	74.4	26%	0.262	40%	0.403	S	S	.	.	H	α-helix	trans	-68.3	-42.1	-179.1	-171.8	54	-156.3	0	0	111.9	P659 D695 S696 M697 Y701 S702 Q703	P659-E699 HydrophobicContact CB-CG 4.37Å; D695-E699 PolarHBondContact O-N 3.45Å; S696-E699 PolarHBondContact O-N 3.43Å; M697-E699 VanDerWaalsContact C-N 3.27Å; M697-E699 PolarHBondContact O-N 3.32Å; E699-Y701 PolarHBondContact O-N 3.41Å; E699-S702 WeakPolarHBondContact O-CB 3.46Å; E699-S702 PolarHBondContact O-N 2.6Å; E699-Q703 WeakPolarHBondContact O-CB 3.46Å; E699-Q703 VanDerWaalsContact O-CG 3.31Å; E699-Q703 WeakPolarHBondContact O-CG 3.37Å; E699-Q703 PolarHBondContact O-N 3.4Å; E699-Q703 PolarHBondContact OE1-NE2 3.21Å
700	I	89.2	Confident	84.2	Confident	7 Å²	7	79.5 Å²	79.5	4%	0.036	44%	0.438	C	S	.	.	H	α-helix	trans	-59.4	-47.6	173.2	-67.5	161.8	0	0	0	111.2	R662 A663 L666 S696 M697 S702 W704 L713 I721	R662-I700 HydrophobicContact CB-CG1 4.19Å; R662-I700 HydrophobicContact CG-CG1 4.4Å; A663-I700 HydrophobicContact CB-CD1 4.38Å; A663-I700 HydrophobicContact CB-CG1 4.23Å; L666-I700 HydrophobicContact CB-CD1 4.43Å; L666-I700 HydrophobicContact CD2-CD1 3.86Å; S696-I700 WeakPolarHBondContact O-CD1 3.42Å; S696-I700 VanDerWaalsContact O-CG1 3.26Å; S696-I700 WeakPolarHBondContact O-CG1 3.37Å; S696-I700 PolarHBondContact O-N 2.93Å; M697-I700 PolarHBondContact O-N 2.96Å; I700-S702 VanDerWaalsContact C-N 3.34Å; I700-S702 PolarHBondContact O-N 2.89Å; I700-W704 WeakPolarHBondContact O-CB 3.29Å; I700-W704 PolarHBondContact O-N 2.75Å; I700-W704 VanDerWaalsContact O-N 3.11Å; I700-L713 HydrophobicContact CG2-CD2 4.01Å; I700-I721 HydrophobicContact CD1-CD1 4.44Å; I700-I721 HydrophobicContact CG2-CD1 4.22Å
701	Y	87.8	Confident	83.1	Confident	117 Å²	117	77.1 Å²	77.1	46%	0.459	42%	0.424	S	S	.	.	H	α-helix	trans	-63.4	-37.8	175.2	-86.5	-93.5	0	0	0	112.5	M697 R698 E699 T705 L713 I721	M697-Y701 VanDerWaalsContact O-CD2 3.31Å; M697-Y701 WeakPolarHBondContact O-CD2 3.49Å; M697-Y701 PolarHBondContact O-N 3.11Å; R698-Y701 PolarHBondContact O-N 3.18Å; E699-Y701 PolarHBondContact O-N 3.41Å; Y701-T705 WeakPolarHBondContact O-CB 3.42Å; Y701-T705 PolarHBondContact O-N 2.9Å; Y701-T705 VanDerWaalsContact O-N 3.12Å; Y701-T705 PolarHBondContact O-OG1 3.26Å; Y701-L713 HydrophobicContact CD1-CD1 3.83Å; Y701-L713 HydrophobicContact CD2-CD1 3.81Å; Y701-L713 HydrophobicContact CE1-CD1 3.59Å; Y701-L713 HydrophobicContact CE2-CD1 3.58Å; Y701-L713 HydrophobicContact CG-CD1 3.95Å; Y701-L713 VanDerWaalsContact CZ-CD1 3.45Å; Y701-I721 HydrophobicContact CD2-CD1 4.32Å; Y701-I721 HydrophobicContact CE2-CD1 3.91Å
702	S	86.6	Confident	82.4	Confident	64 Å²	64	79.1 Å²	79.1	45%	0.448	44%	0.442	S	S	.	.	H	α-helix	trans	-62.3	-50.4	178	-176.3	0	0	0	0	111.2	R698 E699 I700 T705 A706	R698-S702 VanDerWaalsContact O-CB 3.22Å; R698-S702 WeakPolarHBondContact O-CB 3.44Å; R698-S702 PolarHBondContact O-N 3.33Å; E699-S702 WeakPolarHBondContact O-CB 3.46Å; E699-S702 PolarHBondContact O-N 2.6Å; I700-S702 VanDerWaalsContact C-N 3.34Å; I700-S702 PolarHBondContact O-N 2.89Å; S702-T705 PolarHBondContact O-N 3.06Å; S702-A706 WeakPolarHBondContact O-CB 3.34Å; S702-A706 PolarHBondContact O-N 3.29Å
703	Q	85.3	Confident	81.9	Confident	48 Å²	48	78.9 Å²	78.9	22%	0.224	44%	0.44	C	S	.	.	H	α-helix	trans	-63.4	-46.4	-179.7	-70.4	171	6.8	0	0	112.1	P659 E699 T705 A706 V707	P659-Q703 PolarHBondContact O-NE2 3.43Å; P659-Q703 PolarHBondContact O-OE1 3.32Å; E699-Q703 WeakPolarHBondContact O-CB 3.46Å; E699-Q703 VanDerWaalsContact O-CG 3.31Å; E699-Q703 WeakPolarHBondContact O-CG 3.37Å; E699-Q703 PolarHBondContact O-N 3.4Å; E699-Q703 PolarHBondContact OE1-NE2 3.21Å; Q703-T705 VanDerWaalsContact C-N 3.29Å; Q703-T705 PolarHBondContact O-N 3.19Å; Q703-A706 PolarHBondContact O-N 2.67Å; Q703-A706 VanDerWaalsContact O-N 3.1Å; Q703-V707 WeakPolarHBondContact O-CG2 3.49Å; Q703-V707 PolarHBondContact O-N 2.84Å; Q703-V707 VanDerWaalsContact O-N 3.16Å
704	W	83.6	Confident	81.6	Confident	59 Å²	59	78.5 Å²	78.5	22%	0.223	44%	0.438	C	S	.	.	H	α-helix	trans	-56.7	-43.8	175.6	-173.8	-103.6	0	0	0	112.2	I700 V707 A711 P712 L713 P714	I700-W704 WeakPolarHBondContact O-CB 3.29Å; I700-W704 PolarHBondContact O-N 2.75Å; I700-W704 VanDerWaalsContact O-N 3.11Å; W704-V707 PolarHBondContact O-N 2.71Å; W704-A711 PolarHBondContact NE1-O 2.83Å; W704-P712 WeakPolarHBondContact CZ2-O 3.46Å; W704-P712 PolarHBondContact NE1-O 3.17Å; W704-L713 HydrophobicContact CB-CD2 3.65Å; W704-L713 HydrophobicContact CD2-CD2 3.88Å; W704-L713 HydrophobicContact CE3-CD2 4.33Å; W704-L713 HydrophobicContact CG-CD2 3.57Å; W704-L713 HydrophobicContact CG-CG 4.19Å; W704-P714 HydrophobicContact CE3-CG 4.17Å; W704-P714 HydrophobicContact CH2-CG 3.57Å; W704-P714 HydrophobicContact CZ2-CG 4.3Å; W704-P714 HydrophobicContact CZ3-CG 3.49Å; W704-P714 VanDerWaalsContact CZ3-CG 3.49Å
705	T	82.1	Confident	81.5	Confident	95 Å²	95	69.4 Å²	69.4	58%	0.583	40%	0.397	S	S	*	.	H	α-helix	trans	-66.4	-37.8	176.4	-52.4	0	0	0	0	111.9	Y701 S702 Q703 V707 G708	Y701-T705 WeakPolarHBondContact O-CB 3.42Å; Y701-T705 PolarHBondContact O-N 2.9Å; Y701-T705 VanDerWaalsContact O-N 3.12Å; Y701-T705 PolarHBondContact O-OG1 3.26Å; S702-T705 PolarHBondContact O-N 3.06Å; Q703-T705 VanDerWaalsContact C-N 3.29Å; Q703-T705 PolarHBondContact O-N 3.19Å; T705-V707 VanDerWaalsContact C-N 3.31Å; T705-V707 PolarHBondContact O-N 2.97Å; T705-G708 PolarHBondContact O-N 3.32Å
706	A	77	Confident	81.4	Confident	85 Å²	85	70.3 Å²	70.3	70%	0.702	40%	0.399	S	S	*	.	H	α-helix	trans	-67.8	-26.5	-178.9	0	0	0	0	0	113.7	S702 Q703 G708	S702-A706 WeakPolarHBondContact O-CB 3.34Å; S702-A706 PolarHBondContact O-N 3.29Å; Q703-A706 PolarHBondContact O-N 2.67Å; Q703-A706 VanDerWaalsContact O-N 3.1Å; A706-G708 PolarHBondContact O-N 3.03Å
707	V	71.5	Confident	81.3	Confident	103 Å²	103	71.2 Å²	71.2	62%	0.624	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-0.3	171.7	-177.1	0	0	0	0	111.9	Q703 W704 T705 Q709	Q703-V707 WeakPolarHBondContact O-CG2 3.49Å; Q703-V707 PolarHBondContact O-N 2.84Å; Q703-V707 VanDerWaalsContact O-N 3.16Å; W704-V707 PolarHBondContact O-N 2.71Å; T705-V707 VanDerWaalsContact C-N 3.31Å; T705-V707 PolarHBondContact O-N 2.97Å; V707-Q709 VanDerWaalsContact C-N 3.33Å; V707-Q709 HydrophobicContact CB-CG 4.22Å; V707-Q709 HydrophobicContact CG1-CG 4.01Å
708	G	62.4	Low	81.2	Confident	64 Å²	64	72 Å²	72	66%	0.66	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.7	16	174.3	0	0	0	0	0	113.9	T705 A706	T705-G708 PolarHBondContact O-N 3.32Å; A706-G708 PolarHBondContact O-N 3.03Å
709	Q	64.3	Low	81.3	Confident	82 Å²	82	62.6 Å²	62.6	38%	0.383	37%	0.371	S	S	.	.			trans	-84.6	125.5	-176.5	-54.2	-164.8	26.7	0	0	110.7	V707 A711	V707-Q709 VanDerWaalsContact C-N 3.33Å; V707-Q709 HydrophobicContact CB-CG 4.22Å; V707-Q709 HydrophobicContact CG1-CG 4.01Å; Q709-A711 VanDerWaalsContact C-N 3.32Å
710	T	62.9	Low	81.5	Confident	153 Å²	153	60.1 Å²	60.1	94%	0.939	36%	0.361	S	S	*	.			trans	-90.6	3.7	175.9	53.6	0	0	0	0	113.3
711	A	70.8	Confident	81.7	Confident	52 Å²	52	60.5 Å²	60.5	43%	0.43	36%	0.363	S	S	.	.	S	Bend	trans	-80.8	154.7	176	0	0	0	0	0	111.4	W704 Q709	W704-A711 PolarHBondContact NE1-O 2.83Å; Q709-A711 VanDerWaalsContact C-N 3.32Å
712	P	77.8	Confident	81.9	Confident	90 Å²	90	56.1 Å²	56.1	58%	0.584	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-58	161.4	163.4	29.3	-36.2	0	0	0	110.7	W704	W704-P712 WeakPolarHBondContact CZ2-O 3.46Å; W704-P712 PolarHBondContact NE1-O 3.17Å
713	L	83.5	Confident	82.3	Confident	8 Å²	8	53.3 Å²	53.3	4%	0.042	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-53.1	160.1	174.4	-85.4	162.3	0	0	0	112.1	I700 Y701 W704 A715 D717 I721 R810	I700-L713 HydrophobicContact CG2-CD2 4.01Å; Y701-L713 HydrophobicContact CD1-CD1 3.83Å; Y701-L713 HydrophobicContact CD2-CD1 3.81Å; Y701-L713 HydrophobicContact CE1-CD1 3.59Å; Y701-L713 HydrophobicContact CE2-CD1 3.58Å; Y701-L713 HydrophobicContact CG-CD1 3.95Å; Y701-L713 VanDerWaalsContact CZ-CD1 3.45Å; W704-L713 HydrophobicContact CB-CD2 3.65Å; W704-L713 HydrophobicContact CD2-CD2 3.88Å; W704-L713 HydrophobicContact CE3-CD2 4.33Å; W704-L713 HydrophobicContact CG-CD2 3.57Å; W704-L713 HydrophobicContact CG-CG 4.19Å; L713-A715 PolarHBondContact O-N 3.21Å; L713-D717 HydrophobicContact CD2-CB 4.43Å; L713-I721 HydrophobicContact CD1-CD1 4.44Å; L713-R810 PolarHBondContact O-NH1 3.45Å
714	P	87.3	Confident	82.7	Confident	41 Å²	41	51.4 Å²	51.4	27%	0.266	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-54.7	140.1	166.9	-23.7	36	0	0	0	110.5	W704 E716 D717 E718	W704-P714 HydrophobicContact CE3-CG 4.17Å; W704-P714 HydrophobicContact CH2-CG 3.57Å; W704-P714 HydrophobicContact CZ2-CG 4.3Å; W704-P714 HydrophobicContact CZ3-CG 3.49Å; W704-P714 VanDerWaalsContact CZ3-CG 3.49Å; P714-E716 PolarHBondContact O-N 2.93Å; P714-D717 HydrophobicContact CB-CB 4.41Å; P714-D717 WeakPolarHBondContact CD-OD2 3.22Å; P714-D717 WeakPolarHBondContact CG-OD2 3Å; P714-D717 PolarHBondContact O-N 3.32Å; P714-E718 PolarHBondContact O-N 3.02Å; P714-E718 VanDerWaalsContact O-N 3.1Å
715	A	87.2	Confident	83.2	Confident	8 Å²	8	51 Å²	51	7%	0.066	32%	0.318	C	S	.	.	H	α-helix	trans	-56.5	-35.6	179.5	0	0	0	0	0	111.8	L713 N719 R810 E812	L713-A715 PolarHBondContact O-N 3.21Å; A715-N719 WeakPolarHBondContact O-CB 3.41Å; A715-N719 PolarHBondContact O-N 3.46Å; A715-N719 PolarHBondContact O-ND2 3.45Å; A715-R810 HydrophobicContact CB-CB 3.8Å; A715-E812 HydrophobicContact CB-CB 4.2Å
716	E	88.3	Confident	83.8	Confident	95 Å²	95	46.4 Å²	46.4	44%	0.444	29%	0.29	S	S	.	.	H	α-helix	trans	-59.9	-43.3	173.9	-62.4	176.3	-156.8	0	0	113.8	K667 P714 A720	K667-E716 IonicContact NZ-OE2 3.38Å; K667-E716 PolarHBondContact NZ-OE2 2.97Å; P714-E716 PolarHBondContact O-N 2.93Å; E716-A720 WeakPolarHBondContact O-CB 2.85Å; E716-A720 PolarHBondContact O-N 3.48Å
717	D	89.5	Confident	84.7	Confident	20 Å²	20	42.4 Å²	42.4	11%	0.107	26%	0.257	C	S	.	.	H	α-helix	trans	-74.6	-39.1	-175.4	-63.4	-13.6	0	0	0	110.1	K667 L713 P714 A720 I721	K667-D717 WeakPolarHBondContact CE-OD1 3.27Å; K667-D717 IonicContact NZ-OD1 2.86Å; K667-D717 PolarHBondContact NZ-OD1 3.21Å; L713-D717 HydrophobicContact CD2-CB 4.43Å; P714-D717 HydrophobicContact CB-CB 4.41Å; P714-D717 WeakPolarHBondContact CD-OD2 3.22Å; P714-D717 WeakPolarHBondContact CG-OD2 3Å; P714-D717 PolarHBondContact O-N 3.32Å; D717-A720 PolarHBondContact O-N 3.4Å; D717-I721 VanDerWaalsContact O-CG1 3.29Å; D717-I721 WeakPolarHBondContact O-CG1 3.45Å; D717-I721 PolarHBondContact O-N 3.41Å
718	E	89.8	Confident	85.8	Confident	64 Å²	64	42.2 Å²	42.2	30%	0.299	25%	0.245	S	C	.	.	H	α-helix	trans	-65.5	-44.9	174	-169.2	174.9	179	0	0	111.5	P714 I721 R722 R810	P714-E718 PolarHBondContact O-N 3.02Å; P714-E718 VanDerWaalsContact O-N 3.1Å; E718-I721 PolarHBondContact O-N 2.99Å; E718-R722 WeakPolarHBondContact O-CB 3.36Å; E718-R722 PolarHBondContact O-N 2.92Å; E718-R810 WeakPolarHBondContact OE2-CD 3.42Å; E718-R810 IonicContact OE2-CZ 3.24Å; E718-R810 IonicContact OE2-NE 2.71Å; E718-R810 IonicContact OE2-NH1 2.92Å; E718-R810 PolarHBondContact OE2-NH1 3.33Å
719	N	91.6	Very high	87.4	Confident	3 Å²	3	39.7 Å²	39.7	2%	0.016	22%	0.218	C	C	.	.	H	α-helix	trans	-63.8	-38	173.3	-74.6	-24.4	0	0	0	111.7	A715 R722 E723 D808 N809 R810	A715-N719 WeakPolarHBondContact O-CB 3.41Å; A715-N719 PolarHBondContact O-N 3.46Å; A715-N719 PolarHBondContact O-ND2 3.45Å; N719-R722 PolarHBondContact O-N 2.96Å; N719-E723 WeakPolarHBondContact O-CB 3.25Å; N719-E723 PolarHBondContact O-N 3.4Å; N719-D808 WeakPolarHBondContact CB-OD1 3.21Å; N719-N809 PolarHBondContact OD1-N 3.02Å; N719-N809 VanDerWaalsContact OD1-N 3.08Å; N719-R810 PolarHBondContact ND2-O 2.93Å; N719-R810 PolarHBondContact OD1-N 2.84Å
720	A	92.9	Very high	88.9	Confident	5 Å²	5	35.9 Å²	35.9	4%	0.041	20%	0.2	C	C	.	.	H	α-helix	trans	-67.5	-39.1	175.4	0	0	0	0	0	112.8	L666 K667 N670 E716 D717 E723 H724	L666-A720 HydrophobicContact CD2-CB 4.49Å; K667-A720 HydrophobicContact CG-CB 3.85Å; N670-A720 PolarHBondContact ND2-O 3.47Å; E716-A720 WeakPolarHBondContact O-CB 2.85Å; E716-A720 PolarHBondContact O-N 3.48Å; D717-A720 PolarHBondContact O-N 3.4Å; A720-E723 PolarHBondContact O-N 3.22Å; A720-H724 WeakPolarHBondContact O-CB 3.34Å; A720-H724 PolarHBondContact O-N 3.14Å
721	I	93	Very high	90.4	Very high	14 Å²	14	29 Å²	29	7%	0.072	16%	0.157	C	C	.	.	H	α-helix	trans	-63.1	-43.4	171.9	-70.2	167.4	0	0	0	110.3	L666 M697 I700 Y701 L713 D717 E718 H724 L725	L666-I721 HydrophobicContact CD2-CB 4.37Å; L666-I721 HydrophobicContact CD2-CG1 3.54Å; M697-I721 HydrophobicContact CG-CG2 4.14Å; M697-I721 HydrophobicContact SD-CG2 4.2Å; I700-I721 HydrophobicContact CD1-CD1 4.44Å; I700-I721 HydrophobicContact CG2-CD1 4.22Å; Y701-I721 HydrophobicContact CD2-CD1 4.32Å; Y701-I721 HydrophobicContact CE2-CD1 3.91Å; L713-I721 HydrophobicContact CD1-CD1 4.44Å; D717-I721 VanDerWaalsContact O-CG1 3.29Å; D717-I721 WeakPolarHBondContact O-CG1 3.45Å; D717-I721 PolarHBondContact O-N 3.41Å; E718-I721 PolarHBondContact O-N 2.99Å; I721-H724 PolarHBondContact O-N 2.75Å; I721-L725 HydrophobicContact CG2-CD1 4.19Å; I721-L725 WeakPolarHBondContact O-CG 3.48Å; I721-L725 PolarHBondContact O-N 3Å
722	R	92.8	Very high	91.5	Very high	25 Å²	25	29 Å²	29	9%	0.094	15%	0.148	C	C	.	.	H	α-helix	trans	-62.8	-43.8	176.1	-179.2	177.4	172.1	79.5	10.4	112.6	E718 N719 L725 C726 V801 D802 G804 V807 N809	E718-R722 WeakPolarHBondContact O-CB 3.36Å; E718-R722 PolarHBondContact O-N 2.92Å; N719-R722 PolarHBondContact O-N 2.96Å; R722-L725 PolarHBondContact O-N 3.04Å; R722-C726 PolarHBondContact O-N 3.23Å; R722-C726 PolarHBondContact O-SG 2.91Å; R722-V801 PolarHBondContact NH1-O 2.71Å; R722-V801 PolarHBondContact NH2-O 3.18Å; R722-D802 PolarHBondContact NH1-O 2.93Å; R722-D802 PolarHBondContact NH2-O 3.05Å; R722-G804 PolarHBondContact NH2-O 3.01Å; R722-V807 WeakPolarHBondContact CD-O 3.38Å; R722-V807 PolarHBondContact NE-O 3.37Å; R722-N809 WeakPolarHBondContact CD-OD1 3.45Å; R722-N809 PolarHBondContact NE-OD1 3.38Å; R722-N809 PolarHBondContact NH1-ND2 3.47Å; R722-N809 VanDerWaalsContact NH1-ND2 3.2Å
723	E	94.1	Very high	92.3	Very high	5 Å²	5	24.7 Å²	24.7	2%	0.023	12%	0.121	C	C	.	.	H	α-helix	trans	-62.8	-42.7	177	-171.5	-174.4	157.1	0	0	111.2	R674 N719 A720 L725 C726 I727 M806 R819 M823	R674-E723 WeakPolarHBondContact CD-OE1 3.46Å; R674-E723 WeakPolarHBondContact CG-OE1 3.39Å; R674-E723 IonicContact CZ-OE1 3.77Å; R674-E723 IonicContact NE-OE1 3.41Å; R674-E723 IonicContact NH1-OE1 3.47Å; R674-E723 PolarHBondContact NH1-OE1 3.33Å; R674-E723 IonicContact NH1-OE2 3.26Å; R674-E723 PolarHBondContact NH1-OE2 2.8Å; N719-E723 WeakPolarHBondContact O-CB 3.25Å; N719-E723 PolarHBondContact O-N 3.4Å; A720-E723 PolarHBondContact O-N 3.22Å; E723-L725 VanDerWaalsContact C-N 3.33Å; E723-L725 PolarHBondContact O-N 3.26Å; E723-C726 WeakPolarHBondContact O-CB 3.36Å; E723-C726 PolarHBondContact O-N 3.3Å; E723-C726 VanDerWaalsContact O-N 3.13Å; E723-I727 HydrophobicContact CG-CD1 4.21Å; E723-I727 WeakPolarHBondContact O-CG1 3.37Å; E723-I727 PolarHBondContact O-N 2.92Å; E723-M806 HydrophobicContact CG-CE 3.69Å; E723-M806 HydrophobicContact CG-SD 3.79Å; E723-R819 IonicContact OE2-CZ 3.65Å; E723-R819 VanDerWaalsContact OE2-CZ 3.26Å; E723-R819 IonicContact OE2-NE 2.71Å; E723-R819 PolarHBondContact OE2-NE 3.24Å; E723-R819 IonicContact OE2-NH2 3.68Å; E723-R819 PolarHBondContact OE2-NH2 3.22Å; E723-M823 HydrophobicContact CG-SD 4.48Å
724	H	95	Very high	92.7	Very high	8 Å²	8	25.4 Å²	25.4	4%	0.037	12%	0.124	C	C	.	.	H	α-helix	trans	-62	-39.6	175.7	-171.9	87.8	0	0	0	112.2	L666 N670 F689 M697 A720 I721 I727 R728	L666-H724 HydrophobicContact CD1-CB 3.96Å; L666-H724 WeakPolarHBondContact CD1-ND1 3.46Å; L666-H724 HydrophobicContact CG-CB 4.4Å; N670-H724 WeakPolarHBondContact OD1-CB 3.38Å; N670-H724 PolarHBondContact OD1-ND1 3.21Å; F689-H724 AromaticContact CD2-CE1 3.74Å; F689-H724 AromaticContact CD2-NE2 3.94Å; F689-H724 AromaticContact CE2-CD2 3.86Å; F689-H724 AromaticContact CE2-CE1 3.47Å; F689-H724 VanDerWaalsContact CE2-CE1 3.47Å; F689-H724 WeakPolarHBondContact CE2-CE1 3.48Å; F689-H724 AromaticContact CE2-NE2 3.19Å; F689-H724 WeakPolarHBondContact CE2-NE2 3.33Å; F689-H724 AromaticContact CZ-NE2 3.68Å; M697-H724 VanDerWaalsContact CE-CD2 3.49Å; M697-H724 WeakPolarHBondContact CE-CD2 3.49Å; A720-H724 WeakPolarHBondContact O-CB 3.34Å; A720-H724 PolarHBondContact O-N 3.14Å; I721-H724 PolarHBondContact O-N 2.75Å; H724-I727 PolarHBondContact O-N 3.33Å; H724-R728 PolarHBondContact O-N 3.19Å
725	L	94.3	Very high	92.9	Very high	50 Å²	50	27.9 Å²	27.9	26%	0.262	13%	0.132	S	C	.	.	H	α-helix	trans	-66.5	-36.2	173.3	-70.6	167.7	0	0	0	112.6	M697 I721 R722 E723 A729 F800	M697-L725 HydrophobicContact CE-CD2 3.71Å; M697-L725 HydrophobicContact CE-CG 3.91Å; M697-L725 HydrophobicContact SD-CD2 4.22Å; I721-L725 HydrophobicContact CG2-CD1 4.19Å; I721-L725 WeakPolarHBondContact O-CG 3.48Å; I721-L725 PolarHBondContact O-N 3Å; R722-L725 PolarHBondContact O-N 3.04Å; E723-L725 VanDerWaalsContact C-N 3.33Å; E723-L725 PolarHBondContact O-N 3.26Å; L725-A729 PolarHBondContact O-N 3.08Å; L725-A729 VanDerWaalsContact O-N 3.11Å; L725-F800 HydrophobicContact CB-CZ 4.15Å
726	C	95	Very high	93.2	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-62.2	-47.6	171.8	-67.2	0	0	0	0	110.9	R722 E723 R728 A729 Y730 F800 W805 M806	R722-C726 PolarHBondContact O-N 3.23Å; R722-C726 PolarHBondContact O-SG 2.91Å; E723-C726 WeakPolarHBondContact O-CB 3.36Å; E723-C726 PolarHBondContact O-N 3.3Å; E723-C726 VanDerWaalsContact O-N 3.13Å; C726-R728 PolarHBondContact O-N 3.48Å; C726-A729 PolarHBondContact O-N 2.83Å; C726-Y730 PolarHBondContact O-N 3.46Å; C726-Y730 VanDerWaalsContact O-N 3.1Å; C726-F800 HydrophobicContact CB-CZ 4.43Å; C726-F800 WeakPolarHBondContact SG-CE1 3.31Å; C726-F800 VanDerWaalsContact SG-CZ 3.51Å; C726-W805 VanDerWaalsContact C-NE1 3.34Å; C726-W805 HydrophobicContact CB-CG 4.3Å; C726-W805 PolarHBondContact O-NE1 3.4Å; C726-M806 HydrophobicContact CB-CG 4.08Å; C726-M806 HydrophobicContact CB-SD 3.53Å; C726-M806 VanDerWaalsContact CB-SD 3.53Å; C726-M806 PolarHBondContact SG-N 3.2Å
727	I	95.2	Very high	93.5	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-61.9	-43.7	178.6	-67.8	165.2	0	0	0	110.6	N670 M673 L677 E723 H724 A729 Y730 L731 M806	N670-I727 HydrophobicContact CB-CD1 4.33Å; M673-I727 HydrophobicContact CB-CD1 4.04Å; M673-I727 HydrophobicContact CB-CG2 4.31Å; M673-I727 HydrophobicContact CE-CD1 4.09Å; M673-I727 HydrophobicContact CE-CG2 4.11Å; M673-I727 HydrophobicContact SD-CG2 3.66Å; L677-I727 HydrophobicContact CD1-CG1 4.17Å; L677-I727 HydrophobicContact CD1-CG2 4.22Å; E723-I727 HydrophobicContact CG-CD1 4.21Å; E723-I727 WeakPolarHBondContact O-CG1 3.37Å; E723-I727 PolarHBondContact O-N 2.92Å; H724-I727 PolarHBondContact O-N 3.33Å; I727-A729 PolarHBondContact O-N 3.45Å; I727-Y730 PolarHBondContact O-N 3.36Å; I727-L731 HydrophobicContact CG2-CD1 3.97Å; I727-L731 HydrophobicContact CG2-CG 4.28Å; I727-L731 WeakPolarHBondContact O-CG 3.48Å; I727-L731 PolarHBondContact O-N 3.5Å; I727-M806 HydrophobicContact CG1-CE 4.37Å; I727-M806 HydrophobicContact CG1-SD 4.13Å
728	R	94.9	Very high	93.6	Very high	100 Å²	100	26.6 Å²	26.6	38%	0.377	13%	0.129	S	C	.	.	H	α-helix	trans	-56	-52	175.4	-165.4	-178.1	77	-142.6	-6	112	F689 H724 C726 Y730 L731 E732	F689-R728 HydrophobicContact CE1-CG 4.05Å; F689-R728 HydrophobicContact CE2-CB 3.63Å; F689-R728 HydrophobicContact CE2-CG 3.83Å; F689-R728 HydrophobicContact CZ-CB 3.72Å; F689-R728 HydrophobicContact CZ-CG 3.38Å; H724-R728 PolarHBondContact O-N 3.19Å; C726-R728 PolarHBondContact O-N 3.48Å; R728-Y730 PolarHBondContact O-N 2.96Å; R728-L731 PolarHBondContact O-N 2.97Å; R728-L731 VanDerWaalsContact O-N 3.12Å; R728-E732 WeakPolarHBondContact CD-OE1 3.19Å; R728-E732 HydrophobicContact CG-CG 4.33Å; R728-E732 WeakPolarHBondContact CG-OE1 3.49Å; R728-E732 IonicContact CZ-OE1 2.8Å; R728-E732 IonicContact NE-OE1 3.17Å; R728-E732 PolarHBondContact NE-OE1 2.99Å; R728-E732 WeakPolarHBondContact O-CG 3.24Å; R728-E732 PolarHBondContact O-N 3.24Å
729	A	94.9	Very high	93.6	Very high	11 Å²	11	27.7 Å²	27.7	9%	0.091	14%	0.137	C	C	.	.	H	α-helix	trans	-58.9	-36.3	179.7	0	0	0	0	0	112.5	L725 C726 I727 A733 V797 F800	L725-A729 PolarHBondContact O-N 3.08Å; L725-A729 VanDerWaalsContact O-N 3.11Å; C726-A729 PolarHBondContact O-N 2.83Å; I727-A729 PolarHBondContact O-N 3.45Å; A729-A733 VanDerWaalsContact O-CB 3.31Å; A729-A733 WeakPolarHBondContact O-CB 3.32Å; A729-A733 PolarHBondContact O-N 2.73Å; A729-A733 VanDerWaalsContact O-N 3.08Å; A729-V797 VanDerWaalsContact C-CG2 3.43Å; A729-V797 HydrophobicContact CB-CG2 3.85Å; A729-V797 VanDerWaalsContact O-CG2 3.27Å; A729-V797 WeakPolarHBondContact O-CG2 3.25Å; A729-F800 HydrophobicContact CB-CD2 4.32Å; A729-F800 HydrophobicContact CB-CE2 4.12Å
730	Y	95.3	Very high	93.8	Very high	2 Å²	2	27.9 Å²	27.9	1%	0.008	14%	0.137	C	C	.	.	H	α-helix	trans	-68.4	-42.6	175.1	179.1	-87.4	0	0	0	112.8	L677 H682 C726 I727 R728 A733 H734 W805 C830 L834	L677-Y730 HydrophobicContact CD1-CD1 4.46Å; L677-Y730 HydrophobicContact CD2-CD1 3.7Å; L677-Y730 HydrophobicContact CD2-CE1 3.53Å; H682-Y730 AromaticContact CD2-CE1 3.71Å; H682-Y730 AromaticContact NE2-CE1 3.47Å; H682-Y730 WeakPolarHBondContact NE2-CE1 3.47Å; H682-Y730 AromaticContact NE2-CZ 3.7Å; H682-Y730 PolarHBondContact NE2-OH 3.4Å; C726-Y730 PolarHBondContact O-N 3.46Å; C726-Y730 VanDerWaalsContact O-N 3.1Å; I727-Y730 PolarHBondContact O-N 3.36Å; R728-Y730 PolarHBondContact O-N 2.96Å; Y730-A733 PolarHBondContact O-N 2.91Å; Y730-H734 PolarHBondContact O-N 2.97Å; Y730-W805 HydrophobicContact CD2-CH2 4.28Å; Y730-W805 AromaticContact CD2-CZ2 3.85Å; Y730-W805 HydrophobicContact CD2-CZ2 3.85Å; Y730-W805 AromaticContact CG-CZ2 3.89Å; Y730-W805 HydrophobicContact CG-CZ2 3.89Å; Y730-C830 HydrophobicContact CD2-CB 3.92Å; Y730-C830 HydrophobicContact CE2-CB 3.44Å; Y730-C830 VanDerWaalsContact CE2-CB 3.44Å; Y730-C830 VanDerWaalsContact CE2-SG 3.51Å; Y730-L834 HydrophobicContact CD2-CD1 3.64Å; Y730-L834 HydrophobicContact CD2-CG 4.19Å; Y730-L834 HydrophobicContact CE2-CD1 3.83Å; Y730-L834 HydrophobicContact CE2-CD2 4.11Å; Y730-L834 HydrophobicContact CE2-CG 3.84Å
731	L	94.6	Very high	93.7	Very high	8 Å²	8	33 Å²	33	4%	0.042	16%	0.159	C	C	.	.	H	α-helix	trans	-67.2	-43.6	177.8	-67.7	177.4	0	0	0	111.6	L677 A685 K686 F689 I727 R728 A733 H734 E735	L677-L731 HydrophobicContact CD2-CD2 4.15Å; A685-L731 HydrophobicContact CB-CD2 4.14Å; K686-L731 HydrophobicContact CG-CD1 4.36Å; K686-L731 HydrophobicContact CG-CD2 4.19Å; F689-L731 HydrophobicContact CB-CD1 3.84Å; F689-L731 HydrophobicContact CD2-CD1 4.18Å; F689-L731 HydrophobicContact CG-CD1 4.01Å; I727-L731 HydrophobicContact CG2-CD1 3.97Å; I727-L731 HydrophobicContact CG2-CG 4.28Å; I727-L731 WeakPolarHBondContact O-CG 3.48Å; I727-L731 PolarHBondContact O-N 3.5Å; R728-L731 PolarHBondContact O-N 2.97Å; R728-L731 VanDerWaalsContact O-N 3.12Å; L731-A733 VanDerWaalsContact C-N 3.32Å; L731-A733 PolarHBondContact O-N 3.28Å; L731-H734 PolarHBondContact O-N 2.91Å; L731-E735 WeakPolarHBondContact O-CB 3.27Å; L731-E735 PolarHBondContact O-N 2.89Å
732	E	94.6	Very high	93.6	Very high	52 Å²	52	35.6 Å²	35.6	24%	0.243	18%	0.178	C	C	.	.	H	α-helix	trans	-55.8	-46	172.1	-71	177.1	-144.6	0	0	111.1	R728 H734 E735 A736 R793	R728-E732 WeakPolarHBondContact CD-OE1 3.19Å; R728-E732 HydrophobicContact CG-CG 4.33Å; R728-E732 WeakPolarHBondContact CG-OE1 3.49Å; R728-E732 IonicContact CZ-OE1 2.8Å; R728-E732 IonicContact NE-OE1 3.17Å; R728-E732 PolarHBondContact NE-OE1 2.99Å; R728-E732 WeakPolarHBondContact O-CG 3.24Å; R728-E732 PolarHBondContact O-N 3.24Å; E732-H734 PolarHBondContact O-N 3.35Å; E732-E735 PolarHBondContact O-N 3.26Å; E732-A736 WeakPolarHBondContact O-CB 3.45Å; E732-A736 PolarHBondContact O-N 2.66Å; E732-R793 IonicContact OE2-CZ 2.72Å; E732-R793 IonicContact OE2-NH1 2.72Å; E732-R793 PolarHBondContact OE2-NH1 2.71Å
733	A	94.3	Very high	93.5	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-66.6	-35.4	179.6	0	0	0	0	0	113.7	A729 Y730 L731 F737 R793 I794 V797 L834	A729-A733 VanDerWaalsContact O-CB 3.31Å; A729-A733 WeakPolarHBondContact O-CB 3.32Å; A729-A733 PolarHBondContact O-N 2.73Å; A729-A733 VanDerWaalsContact O-N 3.08Å; Y730-A733 PolarHBondContact O-N 2.91Å; L731-A733 VanDerWaalsContact C-N 3.32Å; L731-A733 PolarHBondContact O-N 3.28Å; A733-F737 WeakPolarHBondContact O-CB 3.5Å; A733-F737 PolarHBondContact O-N 3.4Å; A733-R793 HydrophobicContact CB-CB 3.8Å; A733-I794 HydrophobicContact CB-CG1 3.99Å; A733-V797 HydrophobicContact CB-CG2 4.13Å; A733-L834 HydrophobicContact CB-CD1 4.48Å; A733-L834 HydrophobicContact CB-CD2 4.47Å
734	H	92.6	Very high	93.3	Very high	23 Å²	23	36.7 Å²	36.7	11%	0.106	19%	0.187	C	C	.	.	H	α-helix	trans	-75.8	-32.1	175.4	-160.8	-63.3	0	0	0	112.1	H682 Y730 L731 E732 T738 R833	H682-H734 AromaticContact CD2-CD2 3.47Å; H682-H734 PolarHBondContact CD2-CD2 3.06Å; H682-H734 VanDerWaalsContact CD2-CD2 3.47Å; H682-H734 AromaticContact CD2-CG 3.7Å; H682-H734 AromaticContact CD2-NE2 3.85Å; H682-H734 AromaticContact CE1-CD2 3.83Å; H682-H734 AromaticContact CE1-NE2 3.63Å; H682-H734 AromaticContact ND1-NE2 3.93Å; H682-H734 AromaticContact NE2-CD2 3.27Å; H682-H734 PolarHBondContact NE2-CD2 2.84Å; H682-H734 VanDerWaalsContact NE2-CD2 3.27Å; H682-H734 AromaticContact NE2-CG 3.98Å; H682-H734 AromaticContact NE2-NE2 3.58Å; Y730-H734 PolarHBondContact O-N 2.97Å; L731-H734 PolarHBondContact O-N 2.91Å; E732-H734 PolarHBondContact O-N 3.35Å; H734-T738 PolarHBondContact O-N 2.91Å; H734-T738 PolarHBondContact O-OG1 3.01Å; H734-R833 PolarHBondContact NE2-NH2 3.25Å; H734-R833 VanDerWaalsContact NE2-NH2 3.11Å
735	E	92.1	Very high	92.9	Very high	93 Å²	93	40.1 Å²	40.1	44%	0.435	21%	0.213	S	C	.	.	H	α-helix	trans	-67.9	-51.9	175.7	-178.5	152.2	-110.9	0	0	111.8	K686 L731 E732 F737 T738 D739	K686-E735 VanDerWaalsContact NZ-CD 3.27Å; K686-E735 IonicContact NZ-OE1 3.94Å; K686-E735 PolarHBondContact NZ-OE1 3.27Å; L731-E735 WeakPolarHBondContact O-CB 3.27Å; L731-E735 PolarHBondContact O-N 2.89Å; E732-E735 PolarHBondContact O-N 3.26Å; E735-F737 PolarHBondContact O-N 3.33Å; E735-T738 PolarHBondContact O-N 2.75Å; E735-D739 PolarHBondContact O-N 3.4Å
736	A	93.4	Very high	92.6	Very high	6 Å²	6	41.3 Å²	41.3	5%	0.05	23%	0.225	C	C	.	.	H	α-helix	trans	-54	-41.2	173.7	0	0	0	0	0	111.4	E732 D739 W740 D789 V790 R793	E732-A736 WeakPolarHBondContact O-CB 3.45Å; E732-A736 PolarHBondContact O-N 2.66Å; A736-D739 PolarHBondContact O-N 3.35Å; A736-W740 VanDerWaalsContact O-CB 3.29Å; A736-W740 WeakPolarHBondContact O-CB 3.3Å; A736-W740 PolarHBondContact O-N 3.03Å; A736-D789 VanDerWaalsContact CB-OD2 3.31Å; A736-D789 WeakPolarHBondContact CB-OD2 3.04Å; A736-V790 HydrophobicContact CB-CG2 3.76Å; A736-V790 WeakPolarHBondContact O-CG2 3.31Å; A736-R793 HydrophobicContact CB-CG 4.07Å
737	F	93.2	Very high	92.1	Very high	24 Å²	24	43.4 Å²	43.4	11%	0.105	24%	0.243	C	C	.	.	H	α-helix	trans	-65.1	-40.9	176.7	176	-93.1	0	0	0	112.6	A733 E735 W740 F741 L837 V841	A733-F737 WeakPolarHBondContact O-CB 3.5Å; A733-F737 PolarHBondContact O-N 3.4Å; E735-F737 PolarHBondContact O-N 3.33Å; F737-W740 HydrophobicContact CD2-CE3 4.03Å; F737-W740 HydrophobicContact CD2-CZ3 4.45Å; F737-W740 AromaticContact CE2-CE3 3.77Å; F737-W740 HydrophobicContact CE2-CE3 3.77Å; F737-W740 AromaticContact CE2-CZ3 3.75Å; F737-W740 HydrophobicContact CE2-CZ3 3.75Å; F737-W740 HydrophobicContact CZ-CE3 4.46Å; F737-W740 HydrophobicContact CZ-CZ3 4.32Å; F737-W740 PolarHBondContact O-N 3.48Å; F737-F741 HydrophobicContact CE1-CB 4.13Å; F737-F741 HydrophobicContact CE1-CG 4.42Å; F737-F741 HydrophobicContact CZ-CB 4.2Å; F737-F741 HydrophobicContact CZ-CD2 4.24Å; F737-F741 HydrophobicContact CZ-CG 4.43Å; F737-F741 WeakPolarHBondContact O-CB 3.48Å; F737-F741 PolarHBondContact O-N 2.92Å; F737-L837 HydrophobicContact CD1-CD1 3.86Å; F737-L837 HydrophobicContact CD1-CD2 4.47Å; F737-L837 HydrophobicContact CD2-CB 3.99Å; F737-L837 HydrophobicContact CD2-CD1 4.33Å; F737-L837 HydrophobicContact CE1-CD1 4.16Å; F737-L837 HydrophobicContact CE1-CD2 3.94Å; F737-L837 HydrophobicContact CE2-CB 4.02Å; F737-L837 HydrophobicContact CE2-CD2 4.12Å; F737-L837 HydrophobicContact CE2-CG 4.45Å; F737-L837 HydrophobicContact CG-CB 4.45Å; F737-L837 HydrophobicContact CG-CD1 3.97Å; F737-L837 HydrophobicContact CZ-CD2 3.75Å; F737-L837 HydrophobicContact CZ-CG 4.47Å; F737-V841 HydrophobicContact CD2-CG2 3.76Å; F737-V841 HydrophobicContact CE2-CG2 3.78Å
738	T	91.4	Very high	91.7	Very high	65 Å²	65	45.3 Å²	45.3	40%	0.399	26%	0.255	S	S	.	.	H	α-helix	trans	-63.7	-43	175.9	-69.6	0	0	0	0	111.5	H734 E735 F741 S742	H734-T738 PolarHBondContact O-N 2.91Å; H734-T738 PolarHBondContact O-OG1 3.01Å; E735-T738 PolarHBondContact O-N 2.75Å; T738-F741 PolarHBondContact O-N 3.22Å; T738-S742 WeakPolarHBondContact O-CB 3.45Å; T738-S742 PolarHBondContact O-N 3.41Å; T738-S742 PolarHBondContact O-OG 2.69Å
739	D	91.3	Very high	91.2	Very high	88 Å²	88	49.1 Å²	49.1	47%	0.471	28%	0.277	S	S	.	.	H	α-helix	trans	-62.8	-48	176.3	-86.3	11.5	0	0	0	111.5	E735 A736 F741 S742 H743 L786	E735-D739 PolarHBondContact O-N 3.4Å; A736-D739 PolarHBondContact O-N 3.35Å; D739-F741 PolarHBondContact O-N 3.02Å; D739-S742 PolarHBondContact O-N 3.49Å; D739-S742 PolarHBondContact O-OG 3.27Å; D739-H743 WeakPolarHBondContact O-CB 3.43Å; D739-H743 PolarHBondContact O-N 3.14Å; D739-L786 HydrophobicContact CB-CD2 4.46Å
740	W	94.4	Very high	90.6	Very high	7 Å²	7	56.6 Å²	56.6	3%	0.027	30%	0.303	C	S	.	.	H	α-helix	trans	-58	-44.8	172.8	175.2	91.9	0	0	0	112.3	A736 F737 H743 S744 L786 T787 V790 V841 S844	A736-W740 VanDerWaalsContact O-CB 3.29Å; A736-W740 WeakPolarHBondContact O-CB 3.3Å; A736-W740 PolarHBondContact O-N 3.03Å; F737-W740 HydrophobicContact CD2-CE3 4.03Å; F737-W740 HydrophobicContact CD2-CZ3 4.45Å; F737-W740 AromaticContact CE2-CE3 3.77Å; F737-W740 HydrophobicContact CE2-CE3 3.77Å; F737-W740 AromaticContact CE2-CZ3 3.75Å; F737-W740 HydrophobicContact CE2-CZ3 3.75Å; F737-W740 HydrophobicContact CZ-CE3 4.46Å; F737-W740 HydrophobicContact CZ-CZ3 4.32Å; F737-W740 PolarHBondContact O-N 3.48Å; W740-H743 PolarHBondContact O-N 3.31Å; W740-S744 VanDerWaalsContact O-CB 3.3Å; W740-S744 WeakPolarHBondContact O-CB 3.45Å; W740-S744 PolarHBondContact O-N 3.11Å; W740-S744 PolarHBondContact O-OG 2.72Å; W740-L786 HydrophobicContact CB-CB 4.15Å; W740-L786 HydrophobicContact CG-CB 4.43Å; W740-T787 PolarHBondContact NE1-OG1 3.26Å; W740-T787 VanDerWaalsContact NE1-OG1 3.08Å; W740-V790 HydrophobicContact CB-CG2 3.62Å; W740-V790 HydrophobicContact CG-CG2 4.13Å; W740-V841 HydrophobicContact CD2-CG1 4.48Å; W740-V841 HydrophobicContact CD2-CG2 3.96Å; W740-V841 HydrophobicContact CE3-CG2 3.77Å; W740-V841 HydrophobicContact CH2-CB 4.37Å; W740-V841 HydrophobicContact CH2-CG2 3.95Å; W740-V841 HydrophobicContact CZ2-CB 4.21Å; W740-V841 HydrophobicContact CZ2-CG1 4.16Å; W740-V841 HydrophobicContact CZ2-CG2 4.08Å; W740-V841 HydrophobicContact CZ3-CG2 3.77Å; W740-S844 VanDerWaalsContact CH2-OG 3.27Å; W740-S844 WeakPolarHBondContact CH2-OG 3.47Å; W740-S844 WeakPolarHBondContact CZ2-OG 3.34Å
741	F	91.3	Very high	89.8	Confident	113 Å²	113	58 Å²	58	50%	0.496	31%	0.312	S	S	.	.	H	α-helix	trans	-67	-42.4	-177.5	179.9	-104.1	0	0	0	111.6	F737 T738 D739 S744 S745	F737-F741 HydrophobicContact CE1-CB 4.13Å; F737-F741 HydrophobicContact CE1-CG 4.42Å; F737-F741 HydrophobicContact CZ-CB 4.2Å; F737-F741 HydrophobicContact CZ-CD2 4.24Å; F737-F741 HydrophobicContact CZ-CG 4.43Å; F737-F741 WeakPolarHBondContact O-CB 3.48Å; F737-F741 PolarHBondContact O-N 2.92Å; T738-F741 PolarHBondContact O-N 3.22Å; D739-F741 PolarHBondContact O-N 3.02Å; F741-S744 PolarHBondContact O-N 2.94Å; F741-S744 PolarHBondContact O-OG 2.78Å; F741-S745 WeakPolarHBondContact O-CB 3.48Å; F741-S745 PolarHBondContact O-N 2.79Å; F741-S745 PolarHBondContact O-OG 3.42Å
742	S	91.3	Very high	88.7	Confident	68 Å²	68	62.4 Å²	62.4	48%	0.476	35%	0.349	S	S	.	.	H	α-helix	trans	-64.2	-42	175.9	74.1	0	0	0	0	112	T738 D739 S745 S746	T738-S742 WeakPolarHBondContact O-CB 3.45Å; T738-S742 PolarHBondContact O-N 3.41Å; T738-S742 PolarHBondContact O-OG 2.69Å; D739-S742 PolarHBondContact O-N 3.49Å; D739-S742 PolarHBondContact O-OG 3.27Å; S742-S745 PolarHBondContact O-N 2.76Å; S742-S746 PolarHBondContact O-N 3.3Å; S742-S746 PolarHBondContact O-OG 3.3Å
743	H	90.9	Very high	87.4	Confident	21 Å²	21	65 Å²	65	10%	0.097	36%	0.364	C	S	.	.	H	α-helix	trans	-69.8	-38.5	175.7	-175.3	77.5	0	0	0	112.4	D739 W740 S745 S746 W779 L786	D739-H743 WeakPolarHBondContact O-CB 3.43Å; D739-H743 PolarHBondContact O-N 3.14Å; W740-H743 PolarHBondContact O-N 3.31Å; H743-S745 VanDerWaalsContact C-N 3.25Å; H743-S745 PolarHBondContact O-N 2.73Å; H743-S746 PolarHBondContact O-N 3.02Å; H743-S746 PolarHBondContact O-OG 3.12Å; H743-W779 AromaticContact CD2-NE1 3.93Å; H743-W779 AromaticContact CE1-CD1 3.44Å; H743-W779 VanDerWaalsContact CE1-CD1 3.44Å; H743-W779 AromaticContact NE2-CD1 3.36Å; H743-W779 AromaticContact NE2-CG 3.86Å; H743-W779 AromaticContact NE2-NE1 3.69Å; H743-W779 PolarHBondContact NE2-O 3.45Å; H743-W779 PolarHBondContact O-NE1 3.17Å; H743-L786 HydrophobicContact CB-CD1 3.71Å
744	S	88.9	Confident	85.9	Confident	31 Å²	31	67.9 Å²	67.9	22%	0.217	39%	0.389	C	S	.	.	H	α-helix	trans	-63.8	-32.9	174.9	76.8	0	0	0	0	112.2	W740 F741	W740-S744 VanDerWaalsContact O-CB 3.3Å; W740-S744 WeakPolarHBondContact O-CB 3.45Å; W740-S744 PolarHBondContact O-N 3.11Å; W740-S744 PolarHBondContact O-OG 2.72Å; F741-S744 PolarHBondContact O-N 2.94Å; F741-S744 PolarHBondContact O-OG 2.78Å
745	S	86.9	Confident	84.3	Confident	81 Å²	81	73.2 Å²	73.2	57%	0.566	43%	0.425	S	S	*	.	H	α-helix	trans	-76.2	-22	179.3	-60.2	0	0	0	0	113.4	F741 S742 H743 A747	F741-S745 WeakPolarHBondContact O-CB 3.48Å; F741-S745 PolarHBondContact O-N 2.79Å; F741-S745 PolarHBondContact O-OG 3.42Å; S742-S745 PolarHBondContact O-N 2.76Å; H743-S745 VanDerWaalsContact C-N 3.25Å; H743-S745 PolarHBondContact O-N 2.73Å; S745-A747 VanDerWaalsContact C-N 3.28Å; S745-A747 PolarHBondContact O-N 3.26Å
746	S	87.5	Confident	83	Confident	74 Å²	74	77.6 Å²	77.6	52%	0.517	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	24.5	-179.9	64.2	0	0	0	0	114	S742 H743	S742-S746 PolarHBondContact O-N 3.3Å; S742-S746 PolarHBondContact O-OG 3.3Å; H743-S746 PolarHBondContact O-N 3.02Å; H743-S746 PolarHBondContact O-OG 3.12Å
747	A	85.9	Confident	81.4	Confident	45 Å²	45	79 Å²	79	37%	0.372	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-51.2	128.7	-179.5	0	0	0	0	0	113	S745 Q749 W779	S745-A747 VanDerWaalsContact C-N 3.28Å; S745-A747 PolarHBondContact O-N 3.26Å; A747-Q749 PolarHBondContact O-N 3.07Å; A747-W779 HydrophobicContact CB-CH2 4.11Å; A747-W779 HydrophobicContact CB-CZ2 3.57Å
748	P	86.2	Confident	80.5	Confident	39 Å²	39	84.7 Å²	84.7	25%	0.253	48%	0.482	S	S	.	.	P	Polyproline II helix	trans	-54.5	129.2	179.8	-30.4	36.6	0	0	0	112.8	Y772 W779	P748-Y772 HydrophobicContact CB-CD2 4.16Å; P748-Y772 HydrophobicContact CB-CE2 3.96Å; P748-Y772 WeakPolarHBondContact O-CE2 3.49Å; P748-W779 VanDerWaalsContact CD-CG 3.47Å; P748-W779 HydrophobicContact CG-CB 3.94Å; P748-W779 HydrophobicContact CG-CG 4.17Å
749	Q	83.6	Confident	79.4	Confident	180 Å²	180	89.7 Å²	89.7	84%	0.841	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-79	138.9	176.1	-65.5	-169.8	1.3	0	0	111	A747 Y772	A747-Q749 PolarHBondContact O-N 3.07Å; Q749-Y772 VanDerWaalsContact O-CD2 3.28Å; Q749-Y772 WeakPolarHBondContact O-CD2 3.43Å; Q749-Y772 WeakPolarHBondContact O-CE2 3.38Å
750	R	82.1	Confident	78.5	Confident	168 Å²	168	90.4 Å²	90.4	63%	0.634	51%	0.506	S	S	*	.	P	Polyproline II helix	trans	-69.5	134.2	178.4	-168.3	178.7	-167	177.5	7.3	110.6	A752 E769 Y772	R750-A752 PolarHBondContact O-N 3.25Å; R750-E769 IonicContact NE-OE2 3.77Å; R750-Y772 HydrophobicContact CB-CE1 4.35Å; R750-Y772 HydrophobicContact CB-CE2 4.31Å; R750-Y772 HydrophobicContact CG-CD1 4.45Å; R750-Y772 HydrophobicContact CG-CE1 4.03Å
751	P	78.4	Confident	77.3	Confident	32 Å²	32	93.9 Å²	93.9	21%	0.208	52%	0.523	C	S	.	.	P	Polyproline II helix	trans	-55.2	131.6	176.4	-26.8	34.5	0	0	0	112.8	L753 K768 Y772	P751-L753 PolarHBondContact O-N 3.11Å; P751-K768 HydrophobicContact CB-CB 4.36Å; P751-K768 HydrophobicContact CG-CB 4.18Å; P751-Y772 HydrophobicContact CG-CG 4.28Å
752	A	72.9	Confident	76.4	Confident	100 Å²	100	95.8 Å²	95.8	83%	0.826	53%	0.527	S	S	*	.			trans	-72.2	111.9	174.5	0	0	0	0	0	110.5	R750	R750-A752 PolarHBondContact O-N 3.25Å
753	L	65.8	Low	75.7	Confident	106 Å²	106	95.6 Å²	95.6	56%	0.555	52%	0.522	S	S	*	.			trans	-82.6	119.8	-179.5	-65.4	171.8	0	0	0	110.9	P751 N765	P751-L753 PolarHBondContact O-N 3.11Å; L753-N765 HydrophobicContact CD2-CB 4.12Å
754	A	64.1	Low	75	Confident	62 Å²	62	96.5 Å²	96.5	51%	0.512	53%	0.534	S	S	.	.			trans	-72.7	129	169.4	0	0	0	0	0	110.1	E756	A754-E756 VanDerWaalsContact C-N 3.31Å; A754-E756 PolarHBondContact O-N 3.06Å
755	P	59.5	Low	74.5	Confident	135 Å²	135	96.5 Å²	96.5	88%	0.877	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-17	-168	25.3	-34.2	0	0	0	115.5
756	E	63.5	Low	74.2	Confident	184 Å²	184	97.3 Å²	97.3	86%	0.86	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.6	45.9	-178.6	-62.1	-167.7	162.2	0	0	112.6	A754	A754-E756 VanDerWaalsContact C-N 3.31Å; A754-E756 PolarHBondContact O-N 3.06Å
757	A	60.5	Low	73.9	Confident	36 Å²	36	98.9 Å²	98.9	30%	0.298	53%	0.527	S	S	.	.			trans	-65.8	133.9	-178.4	0	0	0	0	0	113.9	E761	A757-E761 HydrophobicContact CB-CB 3.92Å
758	K	73.6	Confident	73.7	Confident	144 Å²	144	102 Å²	102	63%	0.626	53%	0.532	S	S	*	.			trans	-68.1	164.8	172.5	-65	168.5	-172.3	155.7	0	111.3	T760 E761 R762	K758-T760 VanDerWaalsContact C-N 3.3Å; K758-T760 PolarHBondContact O-N 3.41Å; K758-T760 VanDerWaalsContact O-N 3.16Å; K758-E761 HydrophobicContact CB-CG 4.5Å; K758-E761 WeakPolarHBondContact CB-OE2 3.17Å; K758-E761 PolarHBondContact N-OE2 2.93Å; K758-E761 CarbonylContact O-C 3.59Å; K758-E761 WeakPolarHBondContact O-CA 3.24Å; K758-E761 WeakPolarHBondContact O-CB 3.42Å; K758-E761 PolarHBondContact O-N 3.29Å; K758-R762 WeakPolarHBondContact O-CB 3.37Å; K758-R762 PolarHBondContact O-N 3.13Å
759	F	69.9	Low	73.6	Confident	169 Å²	169	102 Å²	102	74%	0.741	53%	0.528	S	S	*	.	H	α-helix	trans	-52.4	-41.6	-177.2	-179.2	-100.3	0	0	0	114.4	R762 V763	F759-R762 WeakPolarHBondContact O-CB 3.48Å; F759-R762 PolarHBondContact O-N 2.95Å; F759-V763 HydrophobicContact CE1-CG2 4.42Å; F759-V763 HydrophobicContact CZ-CG2 4.37Å; F759-V763 PolarHBondContact O-N 3.25Å; F759-V763 VanDerWaalsContact O-N 3.11Å
760	T	72	Confident	73.6	Confident	103 Å²	103	100.4 Å²	100.4	63%	0.632	52%	0.519	S	S	*	.	H	α-helix	trans	-67.6	-40	175.9	45.1	0	0	0	0	112.9	K758 R762 V763 A764	K758-T760 VanDerWaalsContact C-N 3.3Å; K758-T760 PolarHBondContact O-N 3.41Å; K758-T760 VanDerWaalsContact O-N 3.16Å; T760-R762 VanDerWaalsContact C-N 3.32Å; T760-V763 PolarHBondContact O-N 3.17Å; T760-A764 PolarHBondContact O-N 3.13Å
761	E	68.9	Low	73.7	Confident	80 Å²	80	97.6 Å²	97.6	37%	0.374	51%	0.513	S	S	.	.	H	α-helix	trans	-69.6	-32.3	175.9	-65.2	155.2	-171.9	0	0	111	A757 K758 A764 N765	A757-E761 HydrophobicContact CB-CB 3.92Å; K758-E761 HydrophobicContact CB-CG 4.5Å; K758-E761 WeakPolarHBondContact CB-OE2 3.17Å; K758-E761 PolarHBondContact N-OE2 2.93Å; K758-E761 CarbonylContact O-C 3.59Å; K758-E761 WeakPolarHBondContact O-CA 3.24Å; K758-E761 WeakPolarHBondContact O-CB 3.42Å; K758-E761 PolarHBondContact O-N 3.29Å; E761-A764 PolarHBondContact O-N 3.23Å; E761-N765 WeakPolarHBondContact O-CB 3.28Å; E761-N765 PolarHBondContact O-N 3.42Å; E761-N765 PolarHBondContact O-ND2 2.85Å; E761-N765 PolarHBondContact O-OD1 3.42Å
762	R	71.7	Confident	74.1	Confident	154 Å²	154	97.5 Å²	97.5	58%	0.581	51%	0.508	S	S	*	.	H	α-helix	trans	-65.1	-46.8	173.6	-176	177.8	-178.6	143.8	3.3	111.8	K758 F759 T760 A764 N765 E766	K758-R762 WeakPolarHBondContact O-CB 3.37Å; K758-R762 PolarHBondContact O-N 3.13Å; F759-R762 WeakPolarHBondContact O-CB 3.48Å; F759-R762 PolarHBondContact O-N 2.95Å; T760-R762 VanDerWaalsContact C-N 3.32Å; R762-A764 VanDerWaalsContact C-N 3.31Å; R762-A764 PolarHBondContact O-N 2.93Å; R762-N765 PolarHBondContact O-N 3.46Å; R762-E766 WeakPolarHBondContact CG-OE1 3.11Å; R762-E766 IonicContact NE-OE1 2.71Å; R762-E766 PolarHBondContact NE-OE1 3.42Å; R762-E766 WeakPolarHBondContact O-CG 3.45Å; R762-E766 PolarHBondContact O-N 3.35Å
763	V	77.2	Confident	74.8	Confident	63 Å²	63	97.4 Å²	97.4	38%	0.382	49%	0.491	S	S	.	.	H	α-helix	trans	-61.8	-40.5	173.3	175.6	0	0	0	0	110.9	F759 T760 N765 E766 M767	F759-V763 HydrophobicContact CE1-CG2 4.42Å; F759-V763 HydrophobicContact CZ-CG2 4.37Å; F759-V763 PolarHBondContact O-N 3.25Å; F759-V763 VanDerWaalsContact O-N 3.11Å; T760-V763 PolarHBondContact O-N 3.17Å; V763-N765 VanDerWaalsContact C-N 3.34Å; V763-N765 PolarHBondContact O-N 3.4Å; V763-E766 PolarHBondContact O-N 2.88Å; V763-M767 WeakPolarHBondContact O-CG 3.38Å; V763-M767 PolarHBondContact O-N 2.63Å
764	A	76.7	Confident	75.8	Confident	41 Å²	41	95.2 Å²	95.2	34%	0.339	49%	0.488	S	S	.	.	H	α-helix	trans	-64.2	-36	174.9	0	0	0	0	0	112.9	T760 E761 R762 M767 K768	T760-A764 PolarHBondContact O-N 3.13Å; E761-A764 PolarHBondContact O-N 3.23Å; R762-A764 VanDerWaalsContact C-N 3.31Å; R762-A764 PolarHBondContact O-N 2.93Å; A764-M767 PolarHBondContact O-N 3.01Å; A764-K768 WeakPolarHBondContact O-CB 3.42Å; A764-K768 VanDerWaalsContact O-CG 3.31Å; A764-K768 WeakPolarHBondContact O-CG 3.24Å; A764-K768 PolarHBondContact O-N 3.34Å
765	N	77.9	Confident	77	Confident	30 Å²	30	95.1 Å²	95.1	16%	0.16	48%	0.483	C	S	.	.	H	α-helix	trans	-70.9	-37.9	174	-69.5	-16.1	0	0	0	111.8	L753 E761 R762 V763 M767 K768 E769	L753-N765 HydrophobicContact CD2-CB 4.12Å; E761-N765 WeakPolarHBondContact O-CB 3.28Å; E761-N765 PolarHBondContact O-N 3.42Å; E761-N765 PolarHBondContact O-ND2 2.85Å; E761-N765 PolarHBondContact O-OD1 3.42Å; R762-N765 PolarHBondContact O-N 3.46Å; V763-N765 VanDerWaalsContact C-N 3.34Å; V763-N765 PolarHBondContact O-N 3.4Å; N765-M767 VanDerWaalsContact C-N 3.32Å; N765-K768 PolarHBondContact O-N 3.45Å; N765-E769 VanDerWaalsContact O-CB 3.31Å; N765-E769 WeakPolarHBondContact O-CB 3.4Å; N765-E769 PolarHBondContact O-N 3.42Å
766	E	80.3	Confident	78.3	Confident	98 Å²	98	95.1 Å²	95.1	46%	0.458	47%	0.466	S	S	.	.	H	α-helix	trans	-66.8	-31.2	173.8	-72.6	171.2	-160.6	0	0	112.2	R762 V763 K770	R762-E766 WeakPolarHBondContact CG-OE1 3.11Å; R762-E766 IonicContact NE-OE1 2.71Å; R762-E766 PolarHBondContact NE-OE1 3.42Å; R762-E766 WeakPolarHBondContact O-CG 3.45Å; R762-E766 PolarHBondContact O-N 3.35Å; V763-E766 PolarHBondContact O-N 2.88Å; E766-K770 WeakPolarHBondContact O-CG 3.41Å; E766-K770 PolarHBondContact O-N 3.25Å
767	M	80.4	Confident	79.5	Confident	108 Å²	108	91 Å²	91	53%	0.532	45%	0.453	S	S	.	.	H	α-helix	trans	-70.5	-49.4	169.3	-72.1	-176.5	66.8	0	0	111.8	V763 A764 N765 E769 K770 E771	V763-M767 WeakPolarHBondContact O-CG 3.38Å; V763-M767 PolarHBondContact O-N 2.63Å; A764-M767 PolarHBondContact O-N 3.01Å; N765-M767 VanDerWaalsContact C-N 3.32Å; M767-E769 VanDerWaalsContact C-N 3.31Å; M767-E769 PolarHBondContact O-N 3.16Å; M767-K770 WeakPolarHBondContact O-CB 3.34Å; M767-K770 PolarHBondContact O-N 3.48Å; M767-E771 WeakPolarHBondContact O-CG 3.49Å; M767-E771 PolarHBondContact O-N 2.97Å
768	K	82.3	Confident	81	Confident	109 Å²	109	95.8 Å²	95.8	47%	0.474	47%	0.47	S	S	.	.	H	α-helix	trans	-60.7	-36	177.6	-74.7	172.9	179.2	-179.8	0	113.6	P751 A764 N765 Y772	P751-K768 HydrophobicContact CB-CB 4.36Å; P751-K768 HydrophobicContact CG-CB 4.18Å; A764-K768 WeakPolarHBondContact O-CB 3.42Å; A764-K768 VanDerWaalsContact O-CG 3.31Å; A764-K768 WeakPolarHBondContact O-CG 3.24Å; A764-K768 PolarHBondContact O-N 3.34Å; N765-K768 PolarHBondContact O-N 3.45Å; K768-Y772 WeakPolarHBondContact O-CB 3.4Å; K768-Y772 PolarHBondContact O-N 3.23Å
769	E	83.7	Confident	81.8	Confident	39 Å²	39	91.4 Å²	91.4	18%	0.182	45%	0.449	C	S	.	.	H	α-helix	trans	-70.3	-33.3	175.1	179.4	67.1	-146.1	0	0	111.1	R750 N765 M767 Q773	R750-E769 IonicContact NE-OE2 3.77Å; N765-E769 VanDerWaalsContact O-CB 3.31Å; N765-E769 WeakPolarHBondContact O-CB 3.4Å; N765-E769 PolarHBondContact O-N 3.42Å; M767-E769 VanDerWaalsContact C-N 3.31Å; M767-E769 PolarHBondContact O-N 3.16Å; E769-Q773 WeakPolarHBondContact O-CB 3.11Å; E769-Q773 WeakPolarHBondContact O-CG 3.38Å; E769-Q773 PolarHBondContact O-N 3.4Å; E769-Q773 PolarHBondContact OE1-NE2 3.07Å
770	K	84.4	Confident	82.8	Confident	148 Å²	148	85.7 Å²	85.7	64%	0.643	43%	0.431	S	S	*	.	H	α-helix	trans	-70.3	-42.6	171.2	-76.1	175.5	-179.3	178.2	0	112.9	E766 M767 Y772 Q773 A774	E766-K770 WeakPolarHBondContact O-CG 3.41Å; E766-K770 PolarHBondContact O-N 3.25Å; M767-K770 WeakPolarHBondContact O-CB 3.34Å; M767-K770 PolarHBondContact O-N 3.48Å; K770-Y772 VanDerWaalsContact C-N 3.35Å; K770-Q773 PolarHBondContact O-N 2.79Å; K770-A774 WeakPolarHBondContact O-CB 3.42Å; K770-A774 PolarHBondContact O-N 2.85Å
771	E	84.1	Confident	83.6	Confident	109 Å²	109	84 Å²	84	51%	0.509	42%	0.423	S	S	.	.	H	α-helix	trans	-59.6	-47	173.2	-71.6	162.7	-173.9	0	0	110.2	M767 Q773 A774 S775	M767-E771 WeakPolarHBondContact O-CG 3.49Å; M767-E771 PolarHBondContact O-N 2.97Å; E771-Q773 PolarHBondContact O-N 2.78Å; E771-A774 PolarHBondContact O-N 3.49Å; E771-S775 PolarHBondContact O-N 3.11Å; E771-S775 PolarHBondContact O-OG 3.24Å
772	Y	87.6	Confident	84.7	Confident	29 Å²	29	87.5 Å²	87.5	11%	0.114	43%	0.433	C	S	.	.	H	α-helix	trans	-56.4	-46.4	172.7	171.9	-110.5	0	0	0	112.8	P748 Q749 R750 P751 K768 K770 R776	P748-Y772 HydrophobicContact CB-CD2 4.16Å; P748-Y772 HydrophobicContact CB-CE2 3.96Å; P748-Y772 WeakPolarHBondContact O-CE2 3.49Å; Q749-Y772 VanDerWaalsContact O-CD2 3.28Å; Q749-Y772 WeakPolarHBondContact O-CD2 3.43Å; Q749-Y772 WeakPolarHBondContact O-CE2 3.38Å; R750-Y772 HydrophobicContact CB-CE1 4.35Å; R750-Y772 HydrophobicContact CB-CE2 4.31Å; R750-Y772 HydrophobicContact CG-CD1 4.45Å; R750-Y772 HydrophobicContact CG-CE1 4.03Å; P751-Y772 HydrophobicContact CG-CG 4.28Å; K768-Y772 WeakPolarHBondContact O-CB 3.4Å; K768-Y772 PolarHBondContact O-N 3.23Å; K770-Y772 VanDerWaalsContact C-N 3.35Å; Y772-R776 WeakPolarHBondContact O-CB 3.42Å; Y772-R776 PolarHBondContact O-N 2.74Å; Y772-R776 PolarHBondContact OH-NH1 3.09Å
773	Q	87.1	Confident	85.6	Confident	99 Å²	99	81.2 Å²	81.2	46%	0.463	41%	0.41	S	S	.	.	H	α-helix	trans	-65.7	-37.8	178.3	-74.9	169.1	16.7	0	0	112.3	E769 K770 E771 T777	E769-Q773 WeakPolarHBondContact O-CB 3.11Å; E769-Q773 WeakPolarHBondContact O-CG 3.38Å; E769-Q773 PolarHBondContact O-N 3.4Å; E769-Q773 PolarHBondContact OE1-NE2 3.07Å; K770-Q773 PolarHBondContact O-N 2.79Å; E771-Q773 PolarHBondContact O-N 2.78Å; Q773-T777 WeakPolarHBondContact O-CB 3.2Å; Q773-T777 PolarHBondContact O-N 3.25Å; Q773-T777 PolarHBondContact O-OG1 3.08Å
774	A	87.4	Confident	86.3	Confident	60 Å²	60	81.5 Å²	81.5	50%	0.496	41%	0.41	S	S	.	.	H	α-helix	trans	-63.9	-55.8	174	0	0	0	0	0	111.3	K770 E771 R776 T777 E778	K770-A774 WeakPolarHBondContact O-CB 3.42Å; K770-A774 PolarHBondContact O-N 2.85Å; E771-A774 PolarHBondContact O-N 3.49Å; A774-R776 VanDerWaalsContact C-N 3.28Å; A774-R776 PolarHBondContact O-N 3.19Å; A774-T777 WeakPolarHBondContact O-CB 3.46Å; A774-T777 PolarHBondContact O-N 3.05Å; A774-E778 PolarHBondContact O-N 3.43Å
775	S	87.6	Confident	87.1	Confident	59 Å²	59	84.4 Å²	84.4	41%	0.413	42%	0.423	S	S	.	.	H	α-helix	trans	-62.1	-32.7	179	-60.5	0	0	0	0	113	E771 W779	E771-S775 PolarHBondContact O-N 3.11Å; E771-S775 PolarHBondContact O-OG 3.24Å; S775-W779 WeakPolarHBondContact O-CB 3.29Å; S775-W779 PolarHBondContact O-N 3.36Å
776	R	88.3	Confident	87.7	Confident	135 Å²	135	84.2 Å²	84.2	51%	0.509	42%	0.422	S	S	.	.	H	α-helix	trans	-67.9	-35.9	172.8	-179.3	173.2	176.3	151.8	0.7	112.3	Y772 A774 S780	Y772-R776 WeakPolarHBondContact O-CB 3.42Å; Y772-R776 PolarHBondContact O-N 2.74Å; Y772-R776 PolarHBondContact OH-NH1 3.09Å; A774-R776 VanDerWaalsContact C-N 3.28Å; A774-R776 PolarHBondContact O-N 3.19Å; R776-S780 VanDerWaalsContact O-CB 3.31Å; R776-S780 WeakPolarHBondContact O-CB 2.95Å; R776-S780 PolarHBondContact O-N 3.1Å
777	T	89.1	Confident	88.3	Confident	97 Å²	97	79.5 Å²	79.5	60%	0.595	40%	0.4	S	S	*	.	H	α-helix	trans	-70.1	-44.3	177.4	-55.4	0	0	0	0	110.9	Q773 A774 S780 S781	Q773-T777 WeakPolarHBondContact O-CB 3.2Å; Q773-T777 PolarHBondContact O-N 3.25Å; Q773-T777 PolarHBondContact O-OG1 3.08Å; A774-T777 WeakPolarHBondContact O-CB 3.46Å; A774-T777 PolarHBondContact O-N 3.05Å; T777-S780 PolarHBondContact O-N 3.28Å; T777-S781 PolarHBondContact O-N 3.27Å; T777-S781 PolarHBondContact O-OG 3.37Å
778	E	90.3	Very high	89	Confident	138 Å²	138	78.3 Å²	78.3	65%	0.645	39%	0.393	S	S	*	.	H	α-helix	trans	-63.9	-43.7	174.5	-176.8	-179.1	-176	0	0	112.4	A774 S780 S781 R782	A774-E778 PolarHBondContact O-N 3.43Å; E778-S780 VanDerWaalsContact C-N 3.34Å; E778-S780 PolarHBondContact O-N 2.86Å; E778-S781 PolarHBondContact O-N 3.21Å; E778-S781 PolarHBondContact O-OG 3.38Å; E778-S781 VanDerWaalsContact O-OG 3.13Å; E778-R782 WeakPolarHBondContact O-CB 3.47Å; E778-R782 PolarHBondContact O-N 2.92Å; E778-R782 VanDerWaalsContact O-N 3.07Å
779	W	92.1	Very high	89.5	Confident	51 Å²	51	75.5 Å²	75.5	19%	0.193	38%	0.384	C	S	.	.	H	α-helix	trans	-60.2	-43.5	174	172.9	86.2	0	0	0	111.6	H743 A747 P748 S775 L783	H743-W779 AromaticContact CD2-NE1 3.93Å; H743-W779 AromaticContact CE1-CD1 3.44Å; H743-W779 VanDerWaalsContact CE1-CD1 3.44Å; H743-W779 AromaticContact NE2-CD1 3.36Å; H743-W779 AromaticContact NE2-CG 3.86Å; H743-W779 AromaticContact NE2-NE1 3.69Å; H743-W779 PolarHBondContact NE2-O 3.45Å; H743-W779 PolarHBondContact O-NE1 3.17Å; A747-W779 HydrophobicContact CB-CH2 4.11Å; A747-W779 HydrophobicContact CB-CZ2 3.57Å; P748-W779 VanDerWaalsContact CD-CG 3.47Å; P748-W779 HydrophobicContact CG-CB 3.94Å; P748-W779 HydrophobicContact CG-CG 4.17Å; S775-W779 WeakPolarHBondContact O-CB 3.29Å; S775-W779 PolarHBondContact O-N 3.36Å; W779-L783 HydrophobicContact CH2-CD2 3.62Å; W779-L783 HydrophobicContact CZ2-CD2 3.84Å; W779-L783 HydrophobicContact CZ3-CD2 4.1Å; W779-L783 WeakPolarHBondContact O-CB 3.45Å; W779-L783 PolarHBondContact O-N 3.43Å
780	S	89.3	Confident	90	Very high	50 Å²	50	73.7 Å²	73.7	35%	0.35	38%	0.375	S	S	.	.	H	α-helix	trans	-66.7	-45.4	179.8	-163.2	0	0	0	0	112	R776 T777 E778 R782 L783 D784	R776-S780 VanDerWaalsContact O-CB 3.31Å; R776-S780 WeakPolarHBondContact O-CB 2.95Å; R776-S780 PolarHBondContact O-N 3.1Å; T777-S780 PolarHBondContact O-N 3.28Å; E778-S780 VanDerWaalsContact C-N 3.34Å; E778-S780 PolarHBondContact O-N 2.86Å; S780-R782 VanDerWaalsContact C-N 3.34Å; S780-R782 PolarHBondContact O-N 2.87Å; S780-L783 WeakPolarHBondContact O-CB 3.19Å; S780-L783 PolarHBondContact O-N 3.25Å; S780-L783 VanDerWaalsContact O-N 3.14Å; S780-D784 PolarHBondContact O-N 3.14Å
781	S	90.2	Very high	90.4	Very high	68 Å²	68	67.8 Å²	67.8	48%	0.476	35%	0.349	S	S	.	.	H	α-helix	trans	-65.7	-37.6	179.9	62.9	0	0	0	0	112.1	T777 E778 D784 V785	T777-S781 PolarHBondContact O-N 3.27Å; T777-S781 PolarHBondContact O-OG 3.37Å; E778-S781 PolarHBondContact O-N 3.21Å; E778-S781 PolarHBondContact O-OG 3.38Å; E778-S781 VanDerWaalsContact O-OG 3.13Å; S781-D784 PolarHBondContact O-N 2.99Å; S781-V785 WeakPolarHBondContact O-CG2 3.23Å; S781-V785 PolarHBondContact O-N 3.37Å; S781-V785 VanDerWaalsContact O-N 3.17Å
782	R	90.7	Very high	90.9	Very high	153 Å²	153	68.1 Å²	68.1	58%	0.577	35%	0.351	S	S	*	.	H	α-helix	trans	-66.3	-37.8	171.2	-179.1	169.3	175.4	177.1	-1.1	112.3	E778 S780 V785 L786	E778-R782 WeakPolarHBondContact O-CB 3.47Å; E778-R782 PolarHBondContact O-N 2.92Å; E778-R782 VanDerWaalsContact O-N 3.07Å; S780-R782 VanDerWaalsContact C-N 3.34Å; S780-R782 PolarHBondContact O-N 2.87Å; R782-V785 PolarHBondContact O-N 3.13Å; R782-L786 HydrophobicContact CG-CD1 4.03Å; R782-L786 WeakPolarHBondContact O-CG 3.45Å; R782-L786 PolarHBondContact O-N 3.26Å
783	L	91.6	Very high	91.2	Very high	21 Å²	21	70.4 Å²	70.4	11%	0.11	36%	0.359	C	S	.	.	H	α-helix	trans	-65.6	-38.9	175.9	-175	69.5	0	0	0	111.8	W779 S780 L786 T787	W779-L783 HydrophobicContact CH2-CD2 3.62Å; W779-L783 HydrophobicContact CZ2-CD2 3.84Å; W779-L783 HydrophobicContact CZ3-CD2 4.1Å; W779-L783 WeakPolarHBondContact O-CB 3.45Å; W779-L783 PolarHBondContact O-N 3.43Å; S780-L783 WeakPolarHBondContact O-CB 3.19Å; S780-L783 PolarHBondContact O-N 3.25Å; S780-L783 VanDerWaalsContact O-N 3.14Å; L783-L786 PolarHBondContact O-N 3.02Å; L783-T787 VanDerWaalsContact O-CB 3.31Å; L783-T787 WeakPolarHBondContact O-CB 3.47Å; L783-T787 PolarHBondContact O-N 2.96Å; L783-T787 PolarHBondContact O-OG1 2.91Å
784	D	90.6	Very high	91.5	Very high	69 Å²	69	65.7 Å²	65.7	37%	0.369	34%	0.337	S	S	.	.	H	α-helix	trans	-65.2	-40.2	176	-86.8	-56.1	0	0	0	112.4	S780 S781 T787 E788 R847	S780-D784 PolarHBondContact O-N 3.14Å; S781-D784 PolarHBondContact O-N 2.99Å; D784-T787 WeakPolarHBondContact O-CB 3.35Å; D784-T787 PolarHBondContact O-N 3.07Å; D784-E788 PolarHBondContact O-N 3.11Å; D784-E788 VanDerWaalsContact O-N 3.08Å; D784-R847 IonicContact OD1-CZ 2.79Å; D784-R847 IonicContact OD1-NE 3.89Å; D784-R847 IonicContact OD1-NH2 2.8Å; D784-R847 PolarHBondContact OD1-NH2 3.33Å
785	V	93.4	Very high	91.8	Very high	103 Å²	103	64.9 Å²	64.9	62%	0.624	32%	0.322	S	S	*	.	H	α-helix	trans	-64.3	-47	174.1	171.8	0	0	0	0	111.3	S781 R782 T787 E788 D789	S781-V785 WeakPolarHBondContact O-CG2 3.23Å; S781-V785 PolarHBondContact O-N 3.37Å; S781-V785 VanDerWaalsContact O-N 3.17Å; R782-V785 PolarHBondContact O-N 3.13Å; V785-T787 VanDerWaalsContact C-N 3.25Å; V785-T787 PolarHBondContact O-N 3.15Å; V785-E788 PolarHBondContact O-N 3.27Å; V785-D789 PolarHBondContact O-N 3.22Å; V785-D789 VanDerWaalsContact O-N 3.09Å
786	L	92.4	Very high	92.1	Very high	25 Å²	25	65.6 Å²	65.6	13%	0.131	32%	0.321	C	S	.	.	H	α-helix	trans	-63.6	-32.3	175.2	-69.5	168.9	0	0	0	111.8	D739 W740 H743 R782 L783 V790	D739-L786 HydrophobicContact CB-CD2 4.46Å; W740-L786 HydrophobicContact CB-CB 4.15Å; W740-L786 HydrophobicContact CG-CB 4.43Å; H743-L786 HydrophobicContact CB-CD1 3.71Å; R782-L786 HydrophobicContact CG-CD1 4.03Å; R782-L786 WeakPolarHBondContact O-CG 3.45Å; R782-L786 PolarHBondContact O-N 3.26Å; L783-L786 PolarHBondContact O-N 3.02Å; L786-V790 WeakPolarHBondContact O-CB 3.42Å; L786-V790 WeakPolarHBondContact O-CG2 3.39Å; L786-V790 PolarHBondContact O-N 3.11Å
787	T	92.6	Very high	92.3	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-66.6	-36.5	175.4	-60	0	0	0	0	111.5	W740 L783 D784 V785 K791 V841 S845	W740-T787 PolarHBondContact NE1-OG1 3.26Å; W740-T787 VanDerWaalsContact NE1-OG1 3.08Å; L783-T787 VanDerWaalsContact O-CB 3.31Å; L783-T787 WeakPolarHBondContact O-CB 3.47Å; L783-T787 PolarHBondContact O-N 2.96Å; L783-T787 PolarHBondContact O-OG1 2.91Å; D784-T787 WeakPolarHBondContact O-CB 3.35Å; D784-T787 PolarHBondContact O-N 3.07Å; V785-T787 VanDerWaalsContact C-N 3.25Å; V785-T787 PolarHBondContact O-N 3.15Å; T787-K791 WeakPolarHBondContact O-CB 3.22Å; T787-K791 PolarHBondContact O-N 3.48Å; T787-V841 HydrophobicContact CG2-CG1 3.86Å; T787-S845 PolarHBondContact OG1-OG 3.4Å; T787-S845 VanDerWaalsContact OG1-OG 3.11Å
788	E	93.4	Very high	92.4	Very high	83 Å²	83	54.8 Å²	54.8	39%	0.388	27%	0.269	S	S	.	.	H	α-helix	trans	-70.3	-47.6	173.8	-74.7	-60	129.8	0	0	112.6	D784 V785 V790 K791 E792 R847	D784-E788 PolarHBondContact O-N 3.11Å; D784-E788 VanDerWaalsContact O-N 3.08Å; V785-E788 PolarHBondContact O-N 3.27Å; E788-V790 PolarHBondContact O-N 2.7Å; E788-K791 WeakPolarHBondContact O-CB 3.48Å; E788-K791 PolarHBondContact O-N 3.34Å; E788-K791 VanDerWaalsContact O-N 3.15Å; E788-K791 IonicContact OE1-NZ 2.72Å; E788-K791 PolarHBondContact OE1-NZ 3.48Å; E788-K791 WeakPolarHBondContact OE2-CE 3.36Å; E788-K791 IonicContact OE2-NZ 2.72Å; E788-K791 PolarHBondContact OE2-NZ 3.13Å; E788-E792 PolarHBondContact O-N 3.18Å; E788-R847 IonicContact OE1-CZ 2.75Å; E788-R847 IonicContact OE1-NH1 3.94Å; E788-R847 PolarHBondContact OE1-NH1 3.27Å; E788-R847 IonicContact OE1-NH2 3.31Å
789	D	93.1	Very high	92.5	Very high	50 Å²	50	51.5 Å²	51.5	27%	0.267	26%	0.256	S	S	.	.	H	α-helix	trans	-62.6	-45.9	179.7	178.3	69.9	0	0	0	111.3	A736 V785 K791 E792 R793	A736-D789 VanDerWaalsContact CB-OD2 3.31Å; A736-D789 WeakPolarHBondContact CB-OD2 3.04Å; V785-D789 PolarHBondContact O-N 3.22Å; V785-D789 VanDerWaalsContact O-N 3.09Å; D789-K791 VanDerWaalsContact C-N 3.25Å; D789-K791 PolarHBondContact O-N 3.24Å; D789-E792 PolarHBondContact O-N 3.12Å; D789-E792 VanDerWaalsContact O-N 3.12Å; D789-R793 WeakPolarHBondContact O-CG 3.23Å; D789-R793 PolarHBondContact O-N 3.3Å; D789-R793 IonicContact OD1-CZ 2.87Å; D789-R793 IonicContact OD1-NE 3.65Å; D789-R793 PolarHBondContact OD1-NE 2.82Å; D789-R793 IonicContact OD1-NH2 3.18Å; D789-R793 PolarHBondContact OD1-NH2 3.46Å; D789-R793 IonicContact OD2-NE 3.74Å
790	V	94.3	Very high	92.5	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-55.1	-42	173	171.3	0	0	0	0	112.3	A736 W740 L786 E788 I794 V841	A736-V790 HydrophobicContact CB-CG2 3.76Å; A736-V790 WeakPolarHBondContact O-CG2 3.31Å; W740-V790 HydrophobicContact CB-CG2 3.62Å; W740-V790 HydrophobicContact CG-CG2 4.13Å; L786-V790 WeakPolarHBondContact O-CB 3.42Å; L786-V790 WeakPolarHBondContact O-CG2 3.39Å; L786-V790 PolarHBondContact O-N 3.11Å; E788-V790 PolarHBondContact O-N 2.7Å; V790-I794 HydrophobicContact CG1-CD1 3.69Å; V790-I794 HydrophobicContact CG1-CG1 4.43Å; V790-I794 WeakPolarHBondContact O-CB 3.41Å; V790-I794 VanDerWaalsContact O-CG1 3.29Å; V790-I794 WeakPolarHBondContact O-CG1 3.41Å; V790-I794 PolarHBondContact O-N 3.36Å; V790-V841 HydrophobicContact CG1-CG1 4.28Å; V790-V841 HydrophobicContact CG1-CG2 3.92Å
791	K	93.3	Very high	92.4	Very high	25 Å²	25	52.2 Å²	52.2	11%	0.109	26%	0.262	C	S	.	.	H	α-helix	trans	-65.1	-44.8	178.4	-176.9	-178.6	77.9	-175.7	0	111.1	T787 E788 D789 Y795 L838 L842 E850	T787-K791 WeakPolarHBondContact O-CB 3.22Å; T787-K791 PolarHBondContact O-N 3.48Å; E788-K791 WeakPolarHBondContact O-CB 3.48Å; E788-K791 PolarHBondContact O-N 3.34Å; E788-K791 VanDerWaalsContact O-N 3.15Å; E788-K791 IonicContact OE1-NZ 2.72Å; E788-K791 PolarHBondContact OE1-NZ 3.48Å; E788-K791 WeakPolarHBondContact OE2-CE 3.36Å; E788-K791 IonicContact OE2-NZ 2.72Å; E788-K791 PolarHBondContact OE2-NZ 3.13Å; D789-K791 VanDerWaalsContact C-N 3.25Å; D789-K791 PolarHBondContact O-N 3.24Å; K791-Y795 HydrophobicContact CD-CE2 4.04Å; K791-Y795 HydrophobicContact CG-CD2 3.73Å; K791-Y795 HydrophobicContact CG-CE2 3.43Å; K791-Y795 VanDerWaalsContact CG-CE2 3.43Å; K791-Y795 WeakPolarHBondContact O-CB 3.5Å; K791-Y795 WeakPolarHBondContact O-CD2 3.33Å; K791-Y795 PolarHBondContact O-N 2.95Å; K791-L838 HydrophobicContact CB-CD1 4.2Å; K791-L838 HydrophobicContact CG-CD1 4.22Å; K791-L842 HydrophobicContact CD-CD2 4.15Å; K791-E850 VanDerWaalsContact CD-OE2 3.28Å; K791-E850 WeakPolarHBondContact CD-OE2 3.34Å; K791-E850 WeakPolarHBondContact CE-OE2 3.33Å; K791-E850 IonicContact NZ-OE1 2.73Å; K791-E850 IonicContact NZ-OE2 2.86Å; K791-E850 PolarHBondContact NZ-OE2 3.43Å
792	E	94	Very high	91.9	Very high	115 Å²	115	54.6 Å²	54.6	54%	0.537	27%	0.269	S	S	.	.	H	α-helix	trans	-62.9	-51.1	176.5	-168.6	179.3	146.4	0	0	111.7	E788 D789 I794 Y795 N796	E788-E792 PolarHBondContact O-N 3.18Å; D789-E792 PolarHBondContact O-N 3.12Å; D789-E792 VanDerWaalsContact O-N 3.12Å; E792-I794 PolarHBondContact O-N 3.47Å; E792-Y795 PolarHBondContact O-N 2.95Å; E792-N796 VanDerWaalsContact O-CG 3.25Å; E792-N796 PolarHBondContact O-N 2.9Å; E792-N796 PolarHBondContact O-ND2 3.49Å
793	R	94.9	Very high	91.4	Very high	78 Å²	78	50 Å²	50	29%	0.294	27%	0.269	S	S	.	.	H	α-helix	trans	-60.3	-43.3	179.5	-57.6	-54.4	165.6	158.7	-5.5	112.4	E732 A733 A736 D789 N796 V797	E732-R793 IonicContact OE2-CZ 2.72Å; E732-R793 IonicContact OE2-NH1 2.72Å; E732-R793 PolarHBondContact OE2-NH1 2.71Å; A733-R793 HydrophobicContact CB-CB 3.8Å; A736-R793 HydrophobicContact CB-CG 4.07Å; D789-R793 WeakPolarHBondContact O-CG 3.23Å; D789-R793 PolarHBondContact O-N 3.3Å; D789-R793 IonicContact OD1-CZ 2.87Å; D789-R793 IonicContact OD1-NE 3.65Å; D789-R793 PolarHBondContact OD1-NE 2.82Å; D789-R793 IonicContact OD1-NH2 3.18Å; D789-R793 PolarHBondContact OD1-NH2 3.46Å; D789-R793 IonicContact OD2-NE 3.74Å; R793-N796 PolarHBondContact O-N 2.96Å; R793-V797 PolarHBondContact O-N 2.93Å
794	I	93.7	Very high	91.3	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-67.9	-38.3	177.8	-65.4	172.7	0	0	0	110.9	A733 V790 E792 N796 V797 L798 L834 L838	A733-I794 HydrophobicContact CB-CG1 3.99Å; V790-I794 HydrophobicContact CG1-CD1 3.69Å; V790-I794 HydrophobicContact CG1-CG1 4.43Å; V790-I794 WeakPolarHBondContact O-CB 3.41Å; V790-I794 VanDerWaalsContact O-CG1 3.29Å; V790-I794 WeakPolarHBondContact O-CG1 3.41Å; V790-I794 PolarHBondContact O-N 3.36Å; E792-I794 PolarHBondContact O-N 3.47Å; I794-N796 VanDerWaalsContact C-N 3.34Å; I794-N796 PolarHBondContact O-N 3.39Å; I794-V797 PolarHBondContact O-N 3.24Å; I794-V797 VanDerWaalsContact O-N 3.16Å; I794-L798 HydrophobicContact CG2-CD1 3.82Å; I794-L798 HydrophobicContact CG2-CG 4.08Å; I794-L798 WeakPolarHBondContact O-CG 3.44Å; I794-L798 PolarHBondContact O-N 3.27Å; I794-L834 HydrophobicContact CG1-CD2 4.4Å; I794-L834 HydrophobicContact CG2-CB 4.06Å; I794-L838 HydrophobicContact CB-CD2 4.33Å; I794-L838 HydrophobicContact CD1-CB 3.9Å; I794-L838 HydrophobicContact CD1-CD1 4.44Å; I794-L838 HydrophobicContact CG2-CB 4.03Å; I794-L838 HydrophobicContact CG2-CD2 3.83Å; I794-L838 HydrophobicContact CG2-CG 4.46Å
795	Y	93	Very high	91.5	Very high	42 Å²	42	46.1 Å²	46.1	17%	0.165	25%	0.249	C	C	.	.	H	α-helix	trans	-65.2	-35.5	173.7	-78.1	-47.2	0	0	0	112.9	K791 E792 V797 L798 L799 L838 L854 I857	K791-Y795 HydrophobicContact CD-CE2 4.04Å; K791-Y795 HydrophobicContact CG-CD2 3.73Å; K791-Y795 HydrophobicContact CG-CE2 3.43Å; K791-Y795 VanDerWaalsContact CG-CE2 3.43Å; K791-Y795 WeakPolarHBondContact O-CB 3.5Å; K791-Y795 WeakPolarHBondContact O-CD2 3.33Å; K791-Y795 PolarHBondContact O-N 2.95Å; E792-Y795 PolarHBondContact O-N 2.95Å; Y795-V797 PolarHBondContact O-N 3.4Å; Y795-L798 HydrophobicContact CD1-CD1 4.42Å; Y795-L798 PolarHBondContact O-N 3.45Å; Y795-L799 HydrophobicContact CD1-CD1 4.24Å; Y795-L799 WeakPolarHBondContact O-CB 3.46Å; Y795-L799 PolarHBondContact O-N 3.09Å; Y795-L838 HydrophobicContact CE1-CD2 4.05Å; Y795-L854 HydrophobicContact CE1-CD2 3.69Å; Y795-L854 WeakPolarHBondContact OH-CD2 3.34Å; Y795-I857 HydrophobicContact CD1-CD1 4.21Å; Y795-I857 HydrophobicContact CE1-CD1 3.45Å; Y795-I857 VanDerWaalsContact CE1-CD1 3.45Å
796	N	93.2	Very high	91.4	Very high	75 Å²	75	41.4 Å²	41.4	40%	0.401	22%	0.221	S	C	.	.	H	α-helix	trans	-60.3	-26.4	173.6	-68.5	-22.2	0	0	0	112.6	E792 R793 I794 F800	E792-N796 VanDerWaalsContact O-CG 3.25Å; E792-N796 PolarHBondContact O-N 2.9Å; E792-N796 PolarHBondContact O-ND2 3.49Å; R793-N796 PolarHBondContact O-N 2.96Å; I794-N796 VanDerWaalsContact C-N 3.34Å; I794-N796 PolarHBondContact O-N 3.39Å; N796-F800 WeakPolarHBondContact O-CA 3.44Å; N796-F800 WeakPolarHBondContact O-CB 3.45Å; N796-F800 WeakPolarHBondContact O-CD2 3.29Å
797	V	93.6	Very high	91.3	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.006	23%	0.228	C	C	.	.	H	α-helix	trans	-84.3	-46.5	172.5	179	0	0	0	0	112.2	A729 A733 R793 I794 Y795 L799 W805 L831 L834	A729-V797 VanDerWaalsContact C-CG2 3.43Å; A729-V797 HydrophobicContact CB-CG2 3.85Å; A729-V797 VanDerWaalsContact O-CG2 3.27Å; A729-V797 WeakPolarHBondContact O-CG2 3.25Å; A733-V797 HydrophobicContact CB-CG2 4.13Å; R793-V797 PolarHBondContact O-N 2.93Å; I794-V797 PolarHBondContact O-N 3.24Å; I794-V797 VanDerWaalsContact O-N 3.16Å; Y795-V797 PolarHBondContact O-N 3.4Å; V797-L799 VanDerWaalsContact C-N 3.35Å; V797-L799 PolarHBondContact O-N 3.31Å; V797-W805 HydrophobicContact CG1-CB 4.41Å; V797-W805 HydrophobicContact CG1-CD2 4.08Å; V797-W805 HydrophobicContact CG1-CG 3.83Å; V797-L831 HydrophobicContact CG1-CD2 3.75Å; V797-L834 HydrophobicContact CB-CD1 3.91Å; V797-L834 HydrophobicContact CG1-CD1 3.57Å; V797-L834 HydrophobicContact CG2-CD1 4.12Å
798	L	91.4	Very high	91.1	Very high	3 Å²	3	44.4 Å²	44.4	2%	0.016	24%	0.238	C	C	.	.	H	α-helix	trans	-68.2	-33.2	-177.9	-66	176.9	0	0	0	113	I794 Y795 L831 L838 L865	I794-L798 HydrophobicContact CG2-CD1 3.82Å; I794-L798 HydrophobicContact CG2-CG 4.08Å; I794-L798 WeakPolarHBondContact O-CG 3.44Å; I794-L798 PolarHBondContact O-N 3.27Å; Y795-L798 HydrophobicContact CD1-CD1 4.42Å; Y795-L798 PolarHBondContact O-N 3.45Å; L798-L831 HydrophobicContact CD2-CD2 4.3Å; L798-L838 HydrophobicContact CD1-CD2 4.37Å; L798-L865 HydrophobicContact CB-CD1 4.31Å; L798-L865 HydrophobicContact CD2-CD1 4.45Å
799	L	91.5	Very high	90.6	Very high	70 Å²	70	43.9 Å²	43.9	37%	0.366	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.1	24.9	-178	-56.9	175.8	0	0	0	112	Y795 V797 V801 I857	Y795-L799 HydrophobicContact CD1-CD1 4.24Å; Y795-L799 WeakPolarHBondContact O-CB 3.46Å; Y795-L799 PolarHBondContact O-N 3.09Å; V797-L799 VanDerWaalsContact C-N 3.35Å; V797-L799 PolarHBondContact O-N 3.31Å; L799-V801 PolarHBondContact O-N 2.89Å; L799-I857 HydrophobicContact CD2-CG2 3.92Å
800	F	92.4	Very high	90.2	Very high	25 Å²	25	44 Å²	44	11%	0.11	24%	0.235	C	C	.	.			trans	-52.8	137.3	-176.7	-163.6	-83.8	0	0	0	111.6	L725 C726 A729 N796 G804 W805	L725-F800 HydrophobicContact CB-CZ 4.15Å; C726-F800 HydrophobicContact CB-CZ 4.43Å; C726-F800 WeakPolarHBondContact SG-CE1 3.31Å; C726-F800 VanDerWaalsContact SG-CZ 3.51Å; A729-F800 HydrophobicContact CB-CD2 4.32Å; A729-F800 HydrophobicContact CB-CE2 4.12Å; N796-F800 WeakPolarHBondContact O-CA 3.44Å; N796-F800 WeakPolarHBondContact O-CB 3.45Å; N796-F800 WeakPolarHBondContact O-CD2 3.29Å; F800-G804 WeakPolarHBondContact O-CA 3.27Å; F800-G804 PolarHBondContact O-N 3.41Å; F800-W805 HydrophobicContact CB-CB 4Å; F800-W805 HydrophobicContact CG-CB 4.42Å
801	V	88.1	Confident	89.4	Confident	91 Å²	91	53.2 Å²	53.2	55%	0.552	28%	0.278	S	S	*	.	S	Bend	trans	-65.2	155.5	-167.5	-62.5	0	0	0	0	113.6	R722 L799	R722-V801 PolarHBondContact NH1-O 2.71Å; R722-V801 PolarHBondContact NH2-O 3.18Å; L799-V801 PolarHBondContact O-N 2.89Å
802	D	78.7	Confident	88.5	Confident	118 Å²	118	58.9 Å²	58.9	63%	0.631	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.4	72.3	168.7	-50.4	-42.8	0	0	0	113.8	R722 N809	R722-D802 PolarHBondContact NH1-O 2.93Å; R722-D802 PolarHBondContact NH2-O 3.05Å; D802-N809 PolarHBondContact O-ND2 3.43Å; D802-N809 VanDerWaalsContact O-ND2 3.15Å; D802-N809 PolarHBondContact O-OD1 3.35Å
803	G	79.9	Confident	87.5	Confident	56 Å²	56	55.2 Å²	55.2	58%	0.577	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.7	-17.1	176.7	0	0	0	0	0	115.7
804	G	89.4	Confident	86.5	Confident	5 Å²	5	59.5 Å²	59.5	5%	0.052	32%	0.316	C	S	.	.			trans	94	173.7	176	0	0	0	0	0	115.6	R722 F800	R722-G804 PolarHBondContact NH2-O 3.01Å; F800-G804 WeakPolarHBondContact O-CA 3.27Å; F800-G804 PolarHBondContact O-N 3.41Å
805	W	94.2	Very high	85.3	Confident	3 Å²	3	65 Å²	65	1%	0.011	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	131.6	-169.2	-174.9	81.3	0	0	0	113.5	C726 Y730 V797 F800 V807 L826 R827 C830 L831	C726-W805 VanDerWaalsContact C-NE1 3.34Å; C726-W805 HydrophobicContact CB-CG 4.3Å; C726-W805 PolarHBondContact O-NE1 3.4Å; Y730-W805 HydrophobicContact CD2-CH2 4.28Å; Y730-W805 AromaticContact CD2-CZ2 3.85Å; Y730-W805 HydrophobicContact CD2-CZ2 3.85Å; Y730-W805 AromaticContact CG-CZ2 3.89Å; Y730-W805 HydrophobicContact CG-CZ2 3.89Å; V797-W805 HydrophobicContact CG1-CB 4.41Å; V797-W805 HydrophobicContact CG1-CD2 4.08Å; V797-W805 HydrophobicContact CG1-CG 3.83Å; F800-W805 HydrophobicContact CB-CB 4Å; F800-W805 HydrophobicContact CG-CB 4.42Å; W805-V807 VanDerWaalsContact C-N 3.35Å; W805-V807 PolarHBondContact O-N 3.02Å; W805-L826 HydrophobicContact CH2-CB 4.46Å; W805-L826 HydrophobicContact CZ3-CB 4.49Å; W805-R827 HydrophobicContact CE3-CG 3.98Å; W805-R827 HydrophobicContact CZ3-CG 4.2Å; W805-R827 WeakPolarHBondContact O-CD 3.47Å; W805-R827 WeakPolarHBondContact O-CG 3.35Å; W805-R827 PolarHBondContact O-NH1 2.99Å; W805-C830 HydrophobicContact CH2-CB 3.52Å; W805-C830 HydrophobicContact CZ2-CB 4.42Å; W805-C830 HydrophobicContact CZ3-CB 3.71Å; W805-L831 HydrophobicContact CB-CD2 4.3Å; W805-L831 HydrophobicContact CD2-CD2 4.08Å; W805-L831 HydrophobicContact CE3-CD1 4.21Å; W805-L831 HydrophobicContact CE3-CD2 3.75Å; W805-L831 HydrophobicContact CE3-CG 3.9Å; W805-L831 HydrophobicContact CG-CD2 4.35Å; W805-L831 HydrophobicContact CZ3-CD2 4.48Å; W805-L831 HydrophobicContact CZ3-CG 4.39Å
806	M	91.9	Very high	84.8	Confident	4 Å²	4	66.5 Å²	66.5	2%	0.02	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.2	47.8	-176	-57	-67	-78.5	0	0	112.8	R674 E723 C726 I727 M823 L826 R827	R674-M806 HydrophobicContact CG-CE 4.16Å; E723-M806 HydrophobicContact CG-CE 3.69Å; E723-M806 HydrophobicContact CG-SD 3.79Å; C726-M806 HydrophobicContact CB-CG 4.08Å; C726-M806 HydrophobicContact CB-SD 3.53Å; C726-M806 VanDerWaalsContact CB-SD 3.53Å; C726-M806 PolarHBondContact SG-N 3.2Å; I727-M806 HydrophobicContact CG1-CE 4.37Å; I727-M806 HydrophobicContact CG1-SD 4.13Å; M806-M823 HydrophobicContact CB-CB 4.39Å; M806-M823 HydrophobicContact CE-CG 4.04Å; M806-M823 HydrophobicContact CE-SD 4.46Å; M806-L826 HydrophobicContact CE-CD1 3.96Å; M806-R827 HydrophobicContact CB-CG 4.02Å; M806-R827 VanDerWaalsContact O-CD 3.29Å; M806-R827 WeakPolarHBondContact O-CD 3.38Å
807	V	89.9	Confident	84.3	Confident	47 Å²	47	70.8 Å²	70.8	29%	0.285	38%	0.379	S	S	.	.			trans	-128.1	133.4	171.3	-175.2	0	0	0	0	107.2	R722 W805 R827	R722-V807 WeakPolarHBondContact CD-O 3.38Å; R722-V807 PolarHBondContact NE-O 3.37Å; W805-V807 VanDerWaalsContact C-N 3.35Å; W805-V807 PolarHBondContact O-N 3.02Å; V807-R827 VanDerWaalsContact CG2-NH1 3.33Å
808	D	88.8	Confident	83.9	Confident	41 Å²	41	75.4 Å²	75.4	22%	0.219	40%	0.401	C	S	.	.			trans	-75.1	150.7	176	-71.8	-26.9	0	0	0	111.5	N719 R819 M823	N719-D808 WeakPolarHBondContact CB-OD1 3.21Å; D808-R819 IonicContact OD1-CZ 3.79Å; D808-R819 IonicContact OD1-NH1 3.62Å; D808-R819 PolarHBondContact OD1-NH1 3.45Å; D808-R819 IonicContact OD1-NH2 3.97Å; D808-R819 PolarHBondContact OD1-NH2 3.47Å; D808-R819 IonicContact OD2-CZ 2.68Å; D808-R819 IonicContact OD2-NH1 3.99Å; D808-R819 PolarHBondContact OD2-NH1 3.21Å; D808-R819 IonicContact OD2-NH2 3.05Å; D808-M823 WeakPolarHBondContact OD2-CE 3.17Å
809	N	84.1	Confident	83.8	Confident	72 Å²	72	76.8 Å²	76.8	39%	0.385	41%	0.406	S	S	.	.	S	Bend	trans	-104.1	-15.1	-178.7	-78.2	16.5	0	0	0	113.4	N719 R722 D802	N719-N809 PolarHBondContact OD1-N 3.02Å; N719-N809 VanDerWaalsContact OD1-N 3.08Å; R722-N809 WeakPolarHBondContact CD-OD1 3.45Å; R722-N809 PolarHBondContact NE-OD1 3.38Å; R722-N809 PolarHBondContact NH1-ND2 3.47Å; R722-N809 VanDerWaalsContact NH1-ND2 3.2Å; D802-N809 PolarHBondContact O-ND2 3.43Å; D802-N809 VanDerWaalsContact O-ND2 3.15Å; D802-N809 PolarHBondContact O-OD1 3.35Å
810	R	83.6	Confident	83.7	Confident	53 Å²	53	76.3 Å²	76.3	20%	0.2	41%	0.408	C	S	.	.			trans	-131.5	122.7	177.6	-70	175.3	66	-162.7	-4.8	109.9	L713 A715 E718 N719 E812	L713-R810 PolarHBondContact O-NH1 3.45Å; A715-R810 HydrophobicContact CB-CB 3.8Å; E718-R810 WeakPolarHBondContact OE2-CD 3.42Å; E718-R810 IonicContact OE2-CZ 3.24Å; E718-R810 IonicContact OE2-NE 2.71Å; E718-R810 IonicContact OE2-NH1 2.92Å; E718-R810 PolarHBondContact OE2-NH1 3.33Å; N719-R810 PolarHBondContact ND2-O 2.93Å; N719-R810 PolarHBondContact OD1-N 2.84Å; R810-E812 VanDerWaalsContact C-N 3.3Å; R810-E812 IonicContact CZ-OE2 3.76Å; R810-E812 VanDerWaalsContact CZ-OE2 3.24Å; R810-E812 IonicContact NE-OE2 2.73Å; R810-E812 PolarHBondContact NE-OE2 3.07Å; R810-E812 IonicContact NH2-OE2 3.9Å; R810-E812 PolarHBondContact NH2-OE2 3.09Å
811	E	77.8	Confident	83.5	Confident	193 Å²	193	80.9 Å²	80.9	90%	0.902	43%	0.43	S	S	*	.			trans	-93.7	18.2	-180	-57.9	178.7	162.2	0	0	111.9
812	E	74.6	Confident	83.5	Confident	145 Å²	145	77 Å²	77	68%	0.678	41%	0.406	S	S	*	.			trans	-90.4	-4	-172.9	-59.8	176	137.7	0	0	113.9	A715 R810	A715-E812 HydrophobicContact CB-CB 4.2Å; R810-E812 VanDerWaalsContact C-N 3.3Å; R810-E812 IonicContact CZ-OE2 3.76Å; R810-E812 VanDerWaalsContact CZ-OE2 3.24Å; R810-E812 IonicContact NE-OE2 2.73Å; R810-E812 PolarHBondContact NE-OE2 3.07Å; R810-E812 IonicContact NH2-OE2 3.9Å; R810-E812 PolarHBondContact NH2-OE2 3.09Å
813	S	72.9	Confident	84.1	Confident	38 Å²	38	72 Å²	72	27%	0.266	38%	0.379	S	S	.	.	S	Bend	trans	-84.5	168.7	174.8	55	0	0	0	0	112.1
814	E	73.8	Confident	84.6	Confident	168 Å²	168	72 Å²	72	79%	0.785	37%	0.374	S	S	*	.			trans	-62.9	146.3	169.2	-64.9	-157.8	158.6	0	0	111.4	D816	E814-D816 PolarHBondContact O-N 3.48Å; E814-D816 VanDerWaalsContact O-N 3.12Å
815	P	69.6	Low	84.7	Confident	114 Å²	114	72.3 Å²	72.3	74%	0.74	38%	0.375	S	S	*	.			trans	-80.2	94.2	-173.6	31.2	-35.2	0	0	0	112.4	E817	P815-E817 PolarHBondContact O-N 3.2Å
816	D	81	Confident	84.6	Confident	74 Å²	74	72.1 Å²	72.1	40%	0.396	38%	0.375	S	S	.	.			trans	-74.4	86.5	166.6	-176.7	-10.3	0	0	0	110.5	E814 E818 R819 S820	E814-D816 PolarHBondContact O-N 3.48Å; E814-D816 VanDerWaalsContact O-N 3.12Å; D816-E818 PolarHBondContact O-N 3.4Å; D816-E818 WeakPolarHBondContact OD1-CB 3.39Å; D816-E818 PolarHBondContact OD1-N 3.04Å; D816-R819 HydrophobicContact CB-CB 4.03Å; D816-R819 PolarHBondContact O-N 3.03Å; D816-R819 PolarHBondContact OD1-N 3.38Å; D816-R819 WeakPolarHBondContact OD2-CB 3.49Å; D816-S820 WeakPolarHBondContact O-CB 3.24Å; D816-S820 PolarHBondContact O-N 2.82Å; D816-S820 PolarHBondContact O-OG 3.38Å; D816-S820 VanDerWaalsContact O-OG 3.08Å
817	E	83.8	Confident	84.6	Confident	165 Å²	165	74 Å²	74	77%	0.771	38%	0.382	S	S	*	.	H	α-helix	trans	-58.5	-32.5	178.1	-64.7	-167.8	166.8	0	0	112.8	P815 H821	P815-E817 PolarHBondContact O-N 3.2Å; E817-H821 VanDerWaalsContact O-CB 3.32Å; E817-H821 WeakPolarHBondContact O-CB 3.39Å; E817-H821 PolarHBondContact O-N 3.14Å
818	E	84.9	Confident	84.7	Confident	98 Å²	98	74 Å²	74	46%	0.458	38%	0.384	S	S	.	.	H	α-helix	trans	-67.8	-51.3	179.9	-168.2	-156.4	118.3	0	0	110.2	D816 H821 Q822	D816-E818 PolarHBondContact O-N 3.4Å; D816-E818 WeakPolarHBondContact OD1-CB 3.39Å; D816-E818 PolarHBondContact OD1-N 3.04Å; E818-H821 PolarHBondContact O-N 3.3Å; E818-Q822 VanDerWaalsContact O-CG 3.25Å; E818-Q822 WeakPolarHBondContact O-CG 3.27Å; E818-Q822 PolarHBondContact O-N 2.68Å; E818-Q822 PolarHBondContact OE1-NE2 3.38Å
819	R	89.2	Confident	84.8	Confident	32 Å²	32	73.8 Å²	73.8	12%	0.121	38%	0.382	C	S	.	.	H	α-helix	trans	-61.2	-44.8	174.3	174	173	172.2	-80.7	-8.4	111.5	E723 D808 D816 H821 Q822 M823	E723-R819 IonicContact OE2-CZ 3.65Å; E723-R819 VanDerWaalsContact OE2-CZ 3.26Å; E723-R819 IonicContact OE2-NE 2.71Å; E723-R819 PolarHBondContact OE2-NE 3.24Å; E723-R819 IonicContact OE2-NH2 3.68Å; E723-R819 PolarHBondContact OE2-NH2 3.22Å; D808-R819 IonicContact OD1-CZ 3.79Å; D808-R819 IonicContact OD1-NH1 3.62Å; D808-R819 PolarHBondContact OD1-NH1 3.45Å; D808-R819 IonicContact OD1-NH2 3.97Å; D808-R819 PolarHBondContact OD1-NH2 3.47Å; D808-R819 IonicContact OD2-CZ 2.68Å; D808-R819 IonicContact OD2-NH1 3.99Å; D808-R819 PolarHBondContact OD2-NH1 3.21Å; D808-R819 IonicContact OD2-NH2 3.05Å; D816-R819 HydrophobicContact CB-CB 4.03Å; D816-R819 PolarHBondContact O-N 3.03Å; D816-R819 PolarHBondContact OD1-N 3.38Å; D816-R819 WeakPolarHBondContact OD2-CB 3.49Å; R819-H821 VanDerWaalsContact C-N 3.29Å; R819-H821 PolarHBondContact O-N 3.26Å; R819-Q822 PolarHBondContact O-N 3.24Å; R819-M823 HydrophobicContact CG-CE 4.31Å; R819-M823 HydrophobicContact CG-CG 4.33Å; R819-M823 HydrophobicContact CG-SD 4.47Å; R819-M823 PolarHBondContact NH2-SD 3.39Å; R819-M823 WeakPolarHBondContact O-CG 3.43Å; R819-M823 PolarHBondContact O-N 2.93Å
820	S	88.2	Confident	85.1	Confident	60 Å²	60	70.4 Å²	70.4	42%	0.42	36%	0.364	S	S	.	.	H	α-helix	trans	-58.7	-41.2	177.1	-63.7	0	0	0	0	111.8	D816 A824	D816-S820 WeakPolarHBondContact O-CB 3.24Å; D816-S820 PolarHBondContact O-N 2.82Å; D816-S820 PolarHBondContact O-OG 3.38Å; D816-S820 VanDerWaalsContact O-OG 3.08Å; S820-A824 WeakPolarHBondContact O-CB 3.44Å; S820-A824 PolarHBondContact O-N 2.76Å; S820-A824 VanDerWaalsContact O-N 3.09Å
821	H	89	Confident	85.5	Confident	121 Å²	121	68 Å²	68	56%	0.56	36%	0.355	S	S	*	.	H	α-helix	trans	-65.1	-47.5	174.2	-171.7	84.4	0	0	0	112.2	E817 E818 R819 M823 A824 A825	E817-H821 VanDerWaalsContact O-CB 3.32Å; E817-H821 WeakPolarHBondContact O-CB 3.39Å; E817-H821 PolarHBondContact O-N 3.14Å; E818-H821 PolarHBondContact O-N 3.3Å; R819-H821 VanDerWaalsContact C-N 3.29Å; R819-H821 PolarHBondContact O-N 3.26Å; H821-M823 VanDerWaalsContact C-N 3.34Å; H821-M823 PolarHBondContact O-N 2.79Å; H821-A824 PolarHBondContact O-N 2.81Å; H821-A825 WeakPolarHBondContact O-CB 3.26Å; H821-A825 PolarHBondContact O-N 2.93Å
822	Q	89.1	Confident	86.2	Confident	11 Å²	11	58.8 Å²	58.8	5%	0.051	31%	0.312	C	S	.	.	H	α-helix	trans	-57.2	-44.3	177.2	-71.9	165.9	1.6	0	0	111.8	F630 R674 E818 R819 A825 L826	F630-Q822 HydrophobicContact CD2-CG 3.79Å; F630-Q822 HydrophobicContact CE2-CB 4.12Å; F630-Q822 HydrophobicContact CE2-CG 3.79Å; R674-Q822 VanDerWaalsContact CZ-OE1 3.28Å; E818-Q822 VanDerWaalsContact O-CG 3.25Å; E818-Q822 WeakPolarHBondContact O-CG 3.27Å; E818-Q822 PolarHBondContact O-N 2.68Å; E818-Q822 PolarHBondContact OE1-NE2 3.38Å; R819-Q822 PolarHBondContact O-N 3.24Å; Q822-A825 PolarHBondContact O-N 3.17Å; Q822-L826 WeakPolarHBondContact O-CB 3.5Å; Q822-L826 VanDerWaalsContact O-CG 3.26Å; Q822-L826 WeakPolarHBondContact O-CG 3.45Å; Q822-L826 PolarHBondContact O-N 3Å
823	M	91	Very high	87	Confident	11 Å²	11	55.4 Å²	55.4	5%	0.054	29%	0.294	C	S	.	.	H	α-helix	trans	-65.6	-42.9	177.4	-67.6	-160.7	-62.7	0	0	112.6	E723 M806 D808 R819 H821 L826 R827	E723-M823 HydrophobicContact CG-SD 4.48Å; M806-M823 HydrophobicContact CB-CB 4.39Å; M806-M823 HydrophobicContact CE-CG 4.04Å; M806-M823 HydrophobicContact CE-SD 4.46Å; D808-M823 WeakPolarHBondContact OD2-CE 3.17Å; R819-M823 HydrophobicContact CG-CE 4.31Å; R819-M823 HydrophobicContact CG-CG 4.33Å; R819-M823 HydrophobicContact CG-SD 4.47Å; R819-M823 PolarHBondContact NH2-SD 3.39Å; R819-M823 WeakPolarHBondContact O-CG 3.43Å; R819-M823 PolarHBondContact O-N 2.93Å; H821-M823 VanDerWaalsContact C-N 3.34Å; H821-M823 PolarHBondContact O-N 2.79Å; M823-L826 PolarHBondContact O-N 3.3Å; M823-R827 WeakPolarHBondContact O-CG 3.3Å; M823-R827 PolarHBondContact O-N 3.28Å
824	A	90.3	Very high	87.9	Confident	57 Å²	57	53.6 Å²	53.6	47%	0.471	28%	0.281	S	S	.	.	H	α-helix	trans	-63.5	-41.6	176.3	0	0	0	0	0	112	S820 H821 R827 S828	S820-A824 WeakPolarHBondContact O-CB 3.44Å; S820-A824 PolarHBondContact O-N 2.76Å; S820-A824 VanDerWaalsContact O-N 3.09Å; H821-A824 PolarHBondContact O-N 2.81Å; A824-R827 WeakPolarHBondContact O-CB 3.33Å; A824-R827 PolarHBondContact O-N 3.46Å; A824-S828 PolarHBondContact O-N 3.44Å; A824-S828 VanDerWaalsContact O-N 3.14Å
825	A	90.4	Very high	88.8	Confident	11 Å²	11	45.6 Å²	45.6	9%	0.091	24%	0.243	C	C	.	.	H	α-helix	trans	-66.5	-44.2	176.3	0	0	0	0	0	111.7	F630 H821 Q822 R827 S828 L829	F630-A825 HydrophobicContact CD1-CB 3.98Å; F630-A825 HydrophobicContact CE1-CB 3.41Å; F630-A825 VanDerWaalsContact CE1-CB 3.41Å; F630-A825 HydrophobicContact CZ-CB 4.16Å; H821-A825 WeakPolarHBondContact O-CB 3.26Å; H821-A825 PolarHBondContact O-N 2.93Å; Q822-A825 PolarHBondContact O-N 3.17Å; A825-R827 VanDerWaalsContact C-N 3.34Å; A825-R827 PolarHBondContact O-N 3.34Å; A825-S828 PolarHBondContact O-N 3.45Å; A825-S828 VanDerWaalsContact O-N 3.08Å; A825-S828 PolarHBondContact O-OG 2.88Å; A825-L829 PolarHBondContact O-N 3.19Å
826	L	91.9	Very high	89.9	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-59.7	-39.8	173.3	-75.8	171.5	0	0	0	112.7	F630 R674 L677 A678 W805 M806 Q822 M823 S828 L829 C830	F630-L826 HydrophobicContact CZ-CD2 4.37Å; F630-L826 HydrophobicContact CZ-CG 4.17Å; R674-L826 HydrophobicContact CB-CD1 3.75Å; R674-L826 HydrophobicContact CG-CD1 3.7Å; L677-L826 HydrophobicContact CB-CD2 3.82Å; A678-L826 HydrophobicContact CB-CD2 4.15Å; W805-L826 HydrophobicContact CH2-CB 4.46Å; W805-L826 HydrophobicContact CZ3-CB 4.49Å; M806-L826 HydrophobicContact CE-CD1 3.96Å; Q822-L826 WeakPolarHBondContact O-CB 3.5Å; Q822-L826 VanDerWaalsContact O-CG 3.26Å; Q822-L826 WeakPolarHBondContact O-CG 3.45Å; Q822-L826 PolarHBondContact O-N 3Å; M823-L826 PolarHBondContact O-N 3.3Å; L826-S828 VanDerWaalsContact C-N 3.34Å; L826-S828 PolarHBondContact O-N 3.06Å; L826-L829 PolarHBondContact O-N 3.41Å; L826-C830 VanDerWaalsContact O-CB 3.24Å; L826-C830 WeakPolarHBondContact O-CB 3.45Å; L826-C830 PolarHBondContact O-N 3.5Å
827	R	93.1	Very high	90.4	Very high	44 Å²	44	40.6 Å²	40.6	17%	0.166	21%	0.208	C	C	.	.	H	α-helix	trans	-56.1	-48.9	171.3	-76.2	168.3	55.5	83.5	-4.3	110.9	W805 M806 V807 M823 A824 A825 L829 L831 P832 V868	W805-R827 HydrophobicContact CE3-CG 3.98Å; W805-R827 HydrophobicContact CZ3-CG 4.2Å; W805-R827 WeakPolarHBondContact O-CD 3.47Å; W805-R827 WeakPolarHBondContact O-CG 3.35Å; W805-R827 PolarHBondContact O-NH1 2.99Å; M806-R827 HydrophobicContact CB-CG 4.02Å; M806-R827 VanDerWaalsContact O-CD 3.29Å; M806-R827 WeakPolarHBondContact O-CD 3.38Å; V807-R827 VanDerWaalsContact CG2-NH1 3.33Å; M823-R827 WeakPolarHBondContact O-CG 3.3Å; M823-R827 PolarHBondContact O-N 3.28Å; A824-R827 WeakPolarHBondContact O-CB 3.33Å; A824-R827 PolarHBondContact O-N 3.46Å; A825-R827 VanDerWaalsContact C-N 3.34Å; A825-R827 PolarHBondContact O-N 3.34Å; R827-L829 VanDerWaalsContact C-N 3.26Å; R827-L829 PolarHBondContact O-N 3.46Å; R827-L831 HydrophobicContact CB-CD1 4.22Å; R827-L831 HydrophobicContact CG-CD1 4.23Å; R827-L831 WeakPolarHBondContact O-CB 3.47Å; R827-L831 PolarHBondContact O-N 2.74Å; R827-L831 VanDerWaalsContact O-N 3.16Å; R827-P832 WeakPolarHBondContact O-CD 3.41Å; R827-V868 HydrophobicContact CB-CG1 4.01Å; R827-V868 WeakPolarHBondContact O-CG1 3.5Å
828	S	91.3	Very high	90.8	Very high	47 Å²	47	32.8 Å²	32.8	33%	0.329	17%	0.171	S	C	.	.	H	α-helix	trans	-63.6	-26.6	179.3	79.4	0	0	0	0	114.3	A824 A825 L826 P832	A824-S828 PolarHBondContact O-N 3.44Å; A824-S828 VanDerWaalsContact O-N 3.14Å; A825-S828 PolarHBondContact O-N 3.45Å; A825-S828 VanDerWaalsContact O-N 3.08Å; A825-S828 PolarHBondContact O-OG 2.88Å; L826-S828 VanDerWaalsContact C-N 3.34Å; L826-S828 PolarHBondContact O-N 3.06Å; S828-P832 WeakPolarHBondContact O-CD 3.46Å; S828-P832 WeakPolarHBondContact O-CG 3.4Å
829	L	90.4	Very high	91.1	Very high	36 Å²	36	28.2 Å²	28.2	19%	0.188	15%	0.15	C	C	.	.	H	α-helix	trans	-87	-47.5	177.8	-174.3	62.6	0	0	0	112.8	A825 L826 R827 R833	A825-L829 PolarHBondContact O-N 3.19Å; L826-L829 PolarHBondContact O-N 3.41Å; R827-L829 VanDerWaalsContact C-N 3.26Å; R827-L829 PolarHBondContact O-N 3.46Å; L829-R833 VanDerWaalsContact O-CB 3.3Å; L829-R833 WeakPolarHBondContact O-CB 3.22Å
830	C	91.8	Very high	91.2	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.007	16%	0.163	C	C	.	.	H	α-helix	trans	-86	-40	-166	-74.2	0	0	0	0	113.3	Y730 W805 L826 R833 L834	Y730-C830 HydrophobicContact CD2-CB 3.92Å; Y730-C830 HydrophobicContact CE2-CB 3.44Å; Y730-C830 VanDerWaalsContact CE2-CB 3.44Å; Y730-C830 VanDerWaalsContact CE2-SG 3.51Å; W805-C830 HydrophobicContact CH2-CB 3.52Å; W805-C830 HydrophobicContact CZ2-CB 4.42Å; W805-C830 HydrophobicContact CZ3-CB 3.71Å; L826-C830 VanDerWaalsContact O-CB 3.24Å; L826-C830 WeakPolarHBondContact O-CB 3.45Å; L826-C830 PolarHBondContact O-N 3.5Å; C830-R833 PolarHBondContact O-N 3.21Å; C830-L834 WeakPolarHBondContact O-CG 3.36Å; C830-L834 PolarHBondContact O-N 3.46Å
831	L	92.6	Very high	91.3	Very high	2 Å²	2	26.6 Å²	26.6	1%	0.01	14%	0.144	C	C	.	.	H	α-helix	trans	-70.1	-45.7	-175.9	-59.9	177.3	0	0	0	112	V797 L798 W805 R827 R833 L834 T835 L865 V868	V797-L831 HydrophobicContact CG1-CD2 3.75Å; L798-L831 HydrophobicContact CD2-CD2 4.3Å; W805-L831 HydrophobicContact CB-CD2 4.3Å; W805-L831 HydrophobicContact CD2-CD2 4.08Å; W805-L831 HydrophobicContact CE3-CD1 4.21Å; W805-L831 HydrophobicContact CE3-CD2 3.75Å; W805-L831 HydrophobicContact CE3-CG 3.9Å; W805-L831 HydrophobicContact CG-CD2 4.35Å; W805-L831 HydrophobicContact CZ3-CD2 4.48Å; W805-L831 HydrophobicContact CZ3-CG 4.39Å; R827-L831 HydrophobicContact CB-CD1 4.22Å; R827-L831 HydrophobicContact CG-CD1 4.23Å; R827-L831 WeakPolarHBondContact O-CB 3.47Å; R827-L831 PolarHBondContact O-N 2.74Å; R827-L831 VanDerWaalsContact O-N 3.16Å; L831-R833 PolarHBondContact O-N 3.22Å; L831-L834 PolarHBondContact O-N 3.01Å; L831-T835 PolarHBondContact O-N 3.43Å; L831-T835 VanDerWaalsContact O-N 3.07Å; L831-T835 PolarHBondContact O-OG1 3.16Å; L831-T835 VanDerWaalsContact O-OG1 3.12Å; L831-L865 HydrophobicContact CD1-CD2 4.17Å; L831-V868 HydrophobicContact CB-CG1 4.33Å; L831-V868 HydrophobicContact CD1-CG1 4.28Å
832	P	92.2	Very high	91.3	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-61.4	-41.1	172.2	-24.9	37.2	0	0	0	112.7	R827 S828 T835 F836 F869 E873	R827-P832 WeakPolarHBondContact O-CD 3.41Å; S828-P832 WeakPolarHBondContact O-CD 3.46Å; S828-P832 WeakPolarHBondContact O-CG 3.4Å; P832-T835 WeakPolarHBondContact O-CB 3.44Å; P832-T835 PolarHBondContact O-N 2.94Å; P832-F836 WeakPolarHBondContact O-CD2 3.29Å; P832-F836 PolarHBondContact O-N 3.24Å; P832-F869 HydrophobicContact CB-CD1 3.77Å; P832-F869 HydrophobicContact CB-CE1 3.77Å; P832-F869 HydrophobicContact CB-CG 4.27Å; P832-F869 HydrophobicContact CB-CZ 4.26Å; P832-F869 HydrophobicContact CG-CD1 3.97Å; P832-F869 HydrophobicContact CG-CD2 4.14Å; P832-F869 HydrophobicContact CG-CE1 4.19Å; P832-F869 HydrophobicContact CG-CE2 4.35Å; P832-F869 HydrophobicContact CG-CG 3.94Å; P832-F869 HydrophobicContact CG-CZ 4.37Å; P832-E873 WeakPolarHBondContact CB-OE1 3.4Å
833	R	90.4	Very high	91.3	Very high	74 Å²	74	21.9 Å²	21.9	28%	0.279	12%	0.122	S	C	.	.	H	α-helix	trans	-59.2	-53.1	177.2	177.2	172.7	170	154	-8.1	111.8	H682 H734 L829 C830 L831 T835 F836 L837	H682-R833 PolarHBondContact CE1-NH2 3.23Å; H734-R833 PolarHBondContact NE2-NH2 3.25Å; H734-R833 VanDerWaalsContact NE2-NH2 3.11Å; L829-R833 VanDerWaalsContact O-CB 3.3Å; L829-R833 WeakPolarHBondContact O-CB 3.22Å; C830-R833 PolarHBondContact O-N 3.21Å; L831-R833 PolarHBondContact O-N 3.22Å; R833-T835 VanDerWaalsContact C-N 3.29Å; R833-T835 PolarHBondContact O-N 3.02Å; R833-F836 PolarHBondContact O-N 3.02Å; R833-F836 VanDerWaalsContact O-N 3.07Å; R833-L837 WeakPolarHBondContact O-CG 3.32Å; R833-L837 PolarHBondContact O-N 3.41Å
834	L	92.3	Very high	91.1	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-60.8	-38	178.7	-73	-176.3	0	0	0	112.1	Y730 A733 I794 V797 C830 L831 F836 L837 L838	Y730-L834 HydrophobicContact CD2-CD1 3.64Å; Y730-L834 HydrophobicContact CD2-CG 4.19Å; Y730-L834 HydrophobicContact CE2-CD1 3.83Å; Y730-L834 HydrophobicContact CE2-CD2 4.11Å; Y730-L834 HydrophobicContact CE2-CG 3.84Å; A733-L834 HydrophobicContact CB-CD1 4.48Å; A733-L834 HydrophobicContact CB-CD2 4.47Å; I794-L834 HydrophobicContact CG1-CD2 4.4Å; I794-L834 HydrophobicContact CG2-CB 4.06Å; V797-L834 HydrophobicContact CB-CD1 3.91Å; V797-L834 HydrophobicContact CG1-CD1 3.57Å; V797-L834 HydrophobicContact CG2-CD1 4.12Å; C830-L834 WeakPolarHBondContact O-CG 3.36Å; C830-L834 PolarHBondContact O-N 3.46Å; L831-L834 PolarHBondContact O-N 3.01Å; L834-F836 PolarHBondContact O-N 3.46Å; L834-L837 HydrophobicContact CD2-CD1 4.3Å; L834-L837 PolarHBondContact O-N 3.12Å; L834-L838 WeakPolarHBondContact O-CB 3.41Å; L834-L838 PolarHBondContact O-N 3.47Å
835	T	92.6	Very high	90.8	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-59.3	-43.6	171.9	-65.4	0	0	0	0	112.4	L831 P832 R833 L838 L839 I858 F869 F877	L831-T835 PolarHBondContact O-N 3.43Å; L831-T835 VanDerWaalsContact O-N 3.07Å; L831-T835 PolarHBondContact O-OG1 3.16Å; L831-T835 VanDerWaalsContact O-OG1 3.12Å; P832-T835 WeakPolarHBondContact O-CB 3.44Å; P832-T835 PolarHBondContact O-N 2.94Å; R833-T835 VanDerWaalsContact C-N 3.29Å; R833-T835 PolarHBondContact O-N 3.02Å; T835-L838 PolarHBondContact O-N 2.85Å; T835-L839 WeakPolarHBondContact O-CB 3.47Å; T835-L839 WeakPolarHBondContact O-CG 3.35Å; T835-L839 PolarHBondContact O-N 2.85Å; T835-I858 HydrophobicContact CG2-CD1 3.53Å; T835-F869 HydrophobicContact CG2-CE1 4.12Å; T835-F869 HydrophobicContact CG2-CZ 3.98Å; T835-F877 HydrophobicContact CG2-CD2 3.82Å; T835-F877 HydrophobicContact CG2-CE2 3.68Å
836	F	92.6	Very high	90.6	Very high	52 Å²	52	26.3 Å²	26.3	23%	0.228	15%	0.15	C	C	.	.	H	α-helix	trans	-69.7	-32	176.5	-76.2	-62.7	0	0	0	113.4	P832 R833 L834 L839 S840 E873 R876 F877	P832-F836 WeakPolarHBondContact O-CD2 3.29Å; P832-F836 PolarHBondContact O-N 3.24Å; R833-F836 PolarHBondContact O-N 3.02Å; R833-F836 VanDerWaalsContact O-N 3.07Å; L834-F836 PolarHBondContact O-N 3.46Å; F836-L839 HydrophobicContact CD1-CD1 3.79Å; F836-L839 HydrophobicContact CE1-CD1 4.1Å; F836-S840 PolarHBondContact O-N 2.92Å; F836-E873 HydrophobicContact CE2-CB 4.04Å; F836-E873 HydrophobicContact CE2-CG 4.16Å; F836-E873 HydrophobicContact CZ-CB 4.32Å; F836-R876 HydrophobicContact CE1-CB 4.22Å; F836-R876 HydrophobicContact CZ-CB 3.99Å; F836-F877 HydrophobicContact CE1-CB 4.22Å; F836-F877 HydrophobicContact CZ-CB 4.14Å
837	L	92.1	Very high	90.3	Very high	31 Å²	31	28.5 Å²	28.5	16%	0.162	16%	0.158	C	C	.	.	H	α-helix	trans	-65.1	-48.8	171.1	-62.4	-173.5	0	0	0	110.8	F737 R833 L834 L839 S840 V841	F737-L837 HydrophobicContact CD1-CD1 3.86Å; F737-L837 HydrophobicContact CD1-CD2 4.47Å; F737-L837 HydrophobicContact CD2-CB 3.99Å; F737-L837 HydrophobicContact CD2-CD1 4.33Å; F737-L837 HydrophobicContact CE1-CD1 4.16Å; F737-L837 HydrophobicContact CE1-CD2 3.94Å; F737-L837 HydrophobicContact CE2-CB 4.02Å; F737-L837 HydrophobicContact CE2-CD2 4.12Å; F737-L837 HydrophobicContact CE2-CG 4.45Å; F737-L837 HydrophobicContact CG-CB 4.45Å; F737-L837 HydrophobicContact CG-CD1 3.97Å; F737-L837 HydrophobicContact CZ-CD2 3.75Å; F737-L837 HydrophobicContact CZ-CG 4.47Å; R833-L837 WeakPolarHBondContact O-CG 3.32Å; R833-L837 PolarHBondContact O-N 3.41Å; L834-L837 HydrophobicContact CD2-CD1 4.3Å; L834-L837 PolarHBondContact O-N 3.12Å; L837-L839 VanDerWaalsContact C-N 3.34Å; L837-L839 PolarHBondContact O-N 2.95Å; L837-S840 WeakPolarHBondContact O-CA 3.48Å; L837-S840 WeakPolarHBondContact O-CB 3.48Å; L837-S840 PolarHBondContact O-N 3.39Å; L837-V841 VanDerWaalsContact O-CG2 3.3Å; L837-V841 WeakPolarHBondContact O-CG2 3.2Å; L837-V841 PolarHBondContact O-N 3.39Å
838	L	92.2	Very high	90	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-61.9	-39.1	177.1	-176.7	58.3	0	0	0	112.5	K791 I794 Y795 L798 L834 T835 S840 V841 L842 L854	K791-L838 HydrophobicContact CB-CD1 4.2Å; K791-L838 HydrophobicContact CG-CD1 4.22Å; I794-L838 HydrophobicContact CB-CD2 4.33Å; I794-L838 HydrophobicContact CD1-CB 3.9Å; I794-L838 HydrophobicContact CD1-CD1 4.44Å; I794-L838 HydrophobicContact CG2-CB 4.03Å; I794-L838 HydrophobicContact CG2-CD2 3.83Å; I794-L838 HydrophobicContact CG2-CG 4.46Å; Y795-L838 HydrophobicContact CE1-CD2 4.05Å; L798-L838 HydrophobicContact CD1-CD2 4.37Å; L834-L838 WeakPolarHBondContact O-CB 3.41Å; L834-L838 PolarHBondContact O-N 3.47Å; T835-L838 PolarHBondContact O-N 2.85Å; L838-S840 VanDerWaalsContact C-N 3.33Å; L838-S840 PolarHBondContact O-N 2.91Å; L838-V841 PolarHBondContact O-N 3.15Å; L838-L842 HydrophobicContact CD1-CD1 3.99Å; L838-L842 HydrophobicContact CD1-CG 3.96Å; L838-L842 HydrophobicContact CG-CD1 3.95Å; L838-L842 HydrophobicContact CG-CG 4.34Å; L838-L842 WeakPolarHBondContact O-CB 3.49Å; L838-L842 WeakPolarHBondContact O-CG 3.41Å; L838-L842 PolarHBondContact O-N 3.35Å; L838-L854 HydrophobicContact CD2-CD1 4.37Å; L838-L854 HydrophobicContact CD2-CD2 3.78Å; L838-L854 HydrophobicContact CG-CD1 4.36Å
839	L	91.6	Very high	89.7	Confident	2 Å²	2	29.5 Å²	29.5	1%	0.01	16%	0.16	C	C	.	.	H	α-helix	trans	-57.1	-45.9	169.8	-82.6	178.5	0	0	0	111.8	T835 F836 L837 Q843 V851 L854 F877 K880 L881	T835-L839 WeakPolarHBondContact O-CB 3.47Å; T835-L839 WeakPolarHBondContact O-CG 3.35Å; T835-L839 PolarHBondContact O-N 2.85Å; F836-L839 HydrophobicContact CD1-CD1 3.79Å; F836-L839 HydrophobicContact CE1-CD1 4.1Å; L837-L839 VanDerWaalsContact C-N 3.34Å; L837-L839 PolarHBondContact O-N 2.95Å; L839-Q843 WeakPolarHBondContact O-CB 3.27Å; L839-Q843 VanDerWaalsContact O-CG 3.22Å; L839-Q843 WeakPolarHBondContact O-CG 3.36Å; L839-Q843 PolarHBondContact O-N 3.44Å; L839-V851 HydrophobicContact CD2-CB 4.44Å; L839-V851 HydrophobicContact CD2-CG1 3.47Å; L839-V851 VanDerWaalsContact CD2-CG1 3.47Å; L839-L854 HydrophobicContact CD2-CD1 3.82Å; L839-L854 HydrophobicContact CG-CD1 4.19Å; L839-F877 HydrophobicContact CD1-CD2 3.49Å; L839-F877 VanDerWaalsContact CD1-CD2 3.49Å; L839-F877 HydrophobicContact CD1-CE2 3.76Å; L839-F877 HydrophobicContact CD2-CE2 4.18Å; L839-F877 HydrophobicContact CG-CD2 4.37Å; L839-F877 HydrophobicContact CG-CE2 4.15Å; L839-K880 HydrophobicContact CD1-CB 3.94Å; L839-K880 HydrophobicContact CD1-CG 4.4Å; L839-L881 HydrophobicContact CD2-CD2 4.34Å
840	S	90	Very high	89.5	Confident	58 Å²	58	29.8 Å²	29.8	41%	0.406	16%	0.16	S	C	.	.	H	α-helix	trans	-64	-43.8	179.8	-164.5	0	0	0	0	111.7	F836 L837 L838 S844	F836-S840 PolarHBondContact O-N 2.92Å; L837-S840 WeakPolarHBondContact O-CA 3.48Å; L837-S840 WeakPolarHBondContact O-CB 3.48Å; L837-S840 PolarHBondContact O-N 3.39Å; L838-S840 VanDerWaalsContact C-N 3.33Å; L838-S840 PolarHBondContact O-N 2.91Å; S840-S844 WeakPolarHBondContact O-CB 3.21Å; S840-S844 PolarHBondContact O-N 2.87Å; S840-S844 PolarHBondContact O-OG 3.2Å
841	V	90.9	Very high	89.3	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-57.8	-59.8	175.4	171.4	0	0	0	0	110.1	F737 W740 T787 V790 L837 L838 Q843 S844 S845	F737-V841 HydrophobicContact CD2-CG2 3.76Å; F737-V841 HydrophobicContact CE2-CG2 3.78Å; W740-V841 HydrophobicContact CD2-CG1 4.48Å; W740-V841 HydrophobicContact CD2-CG2 3.96Å; W740-V841 HydrophobicContact CE3-CG2 3.77Å; W740-V841 HydrophobicContact CH2-CB 4.37Å; W740-V841 HydrophobicContact CH2-CG2 3.95Å; W740-V841 HydrophobicContact CZ2-CB 4.21Å; W740-V841 HydrophobicContact CZ2-CG1 4.16Å; W740-V841 HydrophobicContact CZ2-CG2 4.08Å; W740-V841 HydrophobicContact CZ3-CG2 3.77Å; T787-V841 HydrophobicContact CG2-CG1 3.86Å; V790-V841 HydrophobicContact CG1-CG1 4.28Å; V790-V841 HydrophobicContact CG1-CG2 3.92Å; L837-V841 VanDerWaalsContact O-CG2 3.3Å; L837-V841 WeakPolarHBondContact O-CG2 3.2Å; L837-V841 PolarHBondContact O-N 3.39Å; L838-V841 PolarHBondContact O-N 3.15Å; V841-Q843 VanDerWaalsContact C-N 3.33Å; V841-Q843 PolarHBondContact O-N 3.4Å; V841-S844 PolarHBondContact O-N 2.81Å; V841-S844 VanDerWaalsContact O-N 3.16Å; V841-S844 PolarHBondContact O-OG 3.18Å; V841-S845 PolarHBondContact O-N 2.94Å; V841-S845 PolarHBondContact O-OG 3.48Å
842	L	89	Confident	89	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-63.9	-34.4	-177.1	-64.7	174	0	0	0	112.9	K791 L838 S846 R847 E850 V851 L854	K791-L842 HydrophobicContact CD-CD2 4.15Å; L838-L842 HydrophobicContact CD1-CD1 3.99Å; L838-L842 HydrophobicContact CD1-CG 3.96Å; L838-L842 HydrophobicContact CG-CD1 3.95Å; L838-L842 HydrophobicContact CG-CG 4.34Å; L838-L842 WeakPolarHBondContact O-CB 3.49Å; L838-L842 WeakPolarHBondContact O-CG 3.41Å; L838-L842 PolarHBondContact O-N 3.35Å; L842-S846 PolarHBondContact O-N 3.42Å; L842-R847 HydrophobicContact CD2-CB 4.19Å; L842-R847 PolarHBondContact O-N 3.46Å; L842-E850 HydrophobicContact CD1-CB 4.05Å; L842-E850 HydrophobicContact CD2-CB 4.22Å; L842-V851 HydrophobicContact CB-CG2 3.48Å; L842-V851 VanDerWaalsContact CB-CG2 3.48Å; L842-V851 HydrophobicContact CD1-CG2 4.29Å; L842-L854 HydrophobicContact CD1-CD1 4.14Å
843	Q	88.4	Confident	88.7	Confident	34 Å²	34	37.6 Å²	37.6	16%	0.159	19%	0.191	C	C	.	.	H	α-helix	trans	-66.2	-44.1	173.5	-78.2	-171.8	-29.2	0	0	112.2	L839 V841 S846 V851 K880 S884	L839-Q843 WeakPolarHBondContact O-CB 3.27Å; L839-Q843 VanDerWaalsContact O-CG 3.22Å; L839-Q843 WeakPolarHBondContact O-CG 3.36Å; L839-Q843 PolarHBondContact O-N 3.44Å; V841-Q843 VanDerWaalsContact C-N 3.33Å; V841-Q843 PolarHBondContact O-N 3.4Å; Q843-S846 PolarHBondContact O-N 2.77Å; Q843-V851 HydrophobicContact CG-CG2 4.13Å; Q843-K880 PolarHBondContact NE2-O 3.38Å; Q843-S884 WeakPolarHBondContact CG-OG 3.42Å; Q843-S884 PolarHBondContact NE2-OG 3.31Å
844	S	86.1	Confident	88.6	Confident	71 Å²	71	34.1 Å²	34.1	50%	0.497	18%	0.177	S	C	.	.	H	α-helix	trans	-71	-35.6	-179.5	64.2	0	0	0	0	113	W740 S840 V841 S846	W740-S844 VanDerWaalsContact CH2-OG 3.27Å; W740-S844 WeakPolarHBondContact CH2-OG 3.47Å; W740-S844 WeakPolarHBondContact CZ2-OG 3.34Å; S840-S844 WeakPolarHBondContact O-CB 3.21Å; S840-S844 PolarHBondContact O-N 2.87Å; S840-S844 PolarHBondContact O-OG 3.2Å; V841-S844 PolarHBondContact O-N 2.81Å; V841-S844 VanDerWaalsContact O-N 3.16Å; V841-S844 PolarHBondContact O-OG 3.18Å; S844-S846 PolarHBondContact O-N 2.79Å
845	S	85.9	Confident	88.4	Confident	24 Å²	24	35.5 Å²	35.5	17%	0.168	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	11.1	171	-56.2	0	0	0	0	113.5	T787 V841 R847	T787-S845 PolarHBondContact OG1-OG 3.4Å; T787-S845 VanDerWaalsContact OG1-OG 3.11Å; V841-S845 PolarHBondContact O-N 2.94Å; V841-S845 PolarHBondContact O-OG 3.48Å; S845-R847 WeakPolarHBondContact O-CG 3.38Å; S845-R847 PolarHBondContact O-N 2.79Å
846	S	84.8	Confident	88.2	Confident	77 Å²	77	40.8 Å²	40.8	54%	0.538	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.4	17.1	177.6	-51.7	0	0	0	0	116.2	L842 Q843 S844 H848	L842-S846 PolarHBondContact O-N 3.42Å; Q843-S846 PolarHBondContact O-N 2.77Å; S844-S846 PolarHBondContact O-N 2.79Å; S846-H848 PolarHBondContact O-CD2 3Å; S846-H848 PolarHBondContact O-N 3.45Å
847	R	87	Confident	88	Confident	45 Å²	45	39.9 Å²	39.9	17%	0.17	22%	0.215	C	C	.	.			trans	-88.5	53	-172.3	-51.4	-163.4	-171.7	170.2	-2.6	112.4	D784 E788 L842 S845 Q849 E850 V851	D784-R847 IonicContact OD1-CZ 2.79Å; D784-R847 IonicContact OD1-NE 3.89Å; D784-R847 IonicContact OD1-NH2 2.8Å; D784-R847 PolarHBondContact OD1-NH2 3.33Å; E788-R847 IonicContact OE1-CZ 2.75Å; E788-R847 IonicContact OE1-NH1 3.94Å; E788-R847 PolarHBondContact OE1-NH1 3.27Å; E788-R847 IonicContact OE1-NH2 3.31Å; L842-R847 HydrophobicContact CD2-CB 4.19Å; L842-R847 PolarHBondContact O-N 3.46Å; S845-R847 WeakPolarHBondContact O-CG 3.38Å; S845-R847 PolarHBondContact O-N 2.79Å; R847-Q849 VanDerWaalsContact C-N 3.26Å; R847-Q849 PolarHBondContact O-N 2.71Å; R847-E850 WeakPolarHBondContact CD-OE1 3.27Å; R847-E850 IonicContact NH1-OE1 3.63Å; R847-E850 PolarHBondContact O-N 3.25Å; R847-V851 PolarHBondContact O-N 2.95Å
848	H	85.9	Confident	87.9	Confident	22 Å²	22	38.7 Å²	38.7	10%	0.102	21%	0.208	C	C	.	.	H	α-helix	trans	-63	-25.5	-169.3	-57.9	-68.1	0	0	0	114.4	S846 V851 L852 S884 L888	S846-H848 PolarHBondContact O-CD2 3Å; S846-H848 PolarHBondContact O-N 3.45Å; H848-V851 WeakPolarHBondContact O-CB 3.48Å; H848-V851 PolarHBondContact O-N 3.36Å; H848-L852 PolarHBondContact O-N 3.45Å; H848-S884 PolarHBondContact ND1-OG 3.18Å; H848-L888 HydrophobicContact CB-CD1 3.85Å; H848-L888 HydrophobicContact CB-CD2 3.86Å; H848-L888 HydrophobicContact CB-CG 3.61Å
849	Q	85.7	Confident	87.7	Confident	91 Å²	91	42.1 Å²	42.1	43%	0.425	23%	0.232	S	C	.	.	H	α-helix	trans	-62.8	-42.7	171.2	-76.5	179.8	2.1	0	0	112.5	R847 V851 L852 L888 G897	R847-Q849 VanDerWaalsContact C-N 3.26Å; R847-Q849 PolarHBondContact O-N 2.71Å; Q849-V851 VanDerWaalsContact C-N 3.33Å; Q849-L852 PolarHBondContact O-N 3.02Å; Q849-L888 HydrophobicContact CG-CD2 4.22Å; Q849-G897 PolarHBondContact NE2-O 2.94Å
850	E	85.4	Confident	87.7	Confident	42 Å²	42	43.8 Å²	43.8	20%	0.196	24%	0.244	C	C	.	.	H	α-helix	trans	-69.2	-34.2	179.2	-66	-176.6	-90.4	0	0	111.1	K791 L842 R847 L852 R853	K791-E850 VanDerWaalsContact CD-OE2 3.28Å; K791-E850 WeakPolarHBondContact CD-OE2 3.34Å; K791-E850 WeakPolarHBondContact CE-OE2 3.33Å; K791-E850 IonicContact NZ-OE1 2.73Å; K791-E850 IonicContact NZ-OE2 2.86Å; K791-E850 PolarHBondContact NZ-OE2 3.43Å; L842-E850 HydrophobicContact CD1-CB 4.05Å; L842-E850 HydrophobicContact CD2-CB 4.22Å; R847-E850 WeakPolarHBondContact CD-OE1 3.27Å; R847-E850 IonicContact NH1-OE1 3.63Å; R847-E850 PolarHBondContact O-N 3.25Å; E850-L852 VanDerWaalsContact C-N 3.27Å; E850-L852 PolarHBondContact O-N 3.33Å; E850-R853 PolarHBondContact O-N 3.1Å
851	V	87.4	Confident	87.4	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-55.2	-41.5	173	170.8	0	0	0	0	111.8	L839 L842 Q843 R847 H848 Q849 L854 L881 S884	L839-V851 HydrophobicContact CD2-CB 4.44Å; L839-V851 HydrophobicContact CD2-CG1 3.47Å; L839-V851 VanDerWaalsContact CD2-CG1 3.47Å; L842-V851 HydrophobicContact CB-CG2 3.48Å; L842-V851 VanDerWaalsContact CB-CG2 3.48Å; L842-V851 HydrophobicContact CD1-CG2 4.29Å; Q843-V851 HydrophobicContact CG-CG2 4.13Å; R847-V851 PolarHBondContact O-N 2.95Å; H848-V851 WeakPolarHBondContact O-CB 3.48Å; H848-V851 PolarHBondContact O-N 3.36Å; Q849-V851 VanDerWaalsContact C-N 3.33Å; V851-L854 WeakPolarHBondContact O-CB 3.48Å; V851-L854 PolarHBondContact O-N 2.84Å; V851-L881 HydrophobicContact CG1-CD2 3.68Å; V851-L881 WeakPolarHBondContact O-CD2 3.45Å; V851-S884 VanDerWaalsContact CG1-OG 3.28Å; V851-S884 WeakPolarHBondContact CG1-OG 3.36Å
852	L	86.6	Confident	87.1	Confident	23 Å²	23	53.6 Å²	53.6	12%	0.12	29%	0.287	C	S	.	.	H	α-helix	trans	-71.4	-32	-178	-62.6	180	0	0	0	112.7	H848 Q849 E850 L854 A855 L881 L888 P895 L896	H848-L852 PolarHBondContact O-N 3.45Å; Q849-L852 PolarHBondContact O-N 3.02Å; E850-L852 VanDerWaalsContact C-N 3.27Å; E850-L852 PolarHBondContact O-N 3.33Å; L852-L854 PolarHBondContact O-N 3.33Å; L852-A855 WeakPolarHBondContact O-CB 3.47Å; L852-A855 PolarHBondContact O-N 2.73Å; L852-L881 HydrophobicContact CD2-CB 4.15Å; L852-L881 HydrophobicContact CD2-CD2 4.25Å; L852-L888 HydrophobicContact CD1-CD1 3.68Å; L852-P895 VanDerWaalsContact CD1-O 3.3Å; L852-P895 WeakPolarHBondContact CD1-O 3.43Å; L852-L896 HydrophobicContact CD1-CD2 4.24Å
853	R	86.7	Confident	86.8	Confident	144 Å²	144	54.9 Å²	54.9	54%	0.543	29%	0.293	S	S	.	.	H	α-helix	trans	-65.7	-18.8	175.2	-62.9	-179.1	-172.6	171.8	4.4	113.6	E850 A855 D856 I857	E850-R853 PolarHBondContact O-N 3.1Å; R853-A855 PolarHBondContact O-N 2.75Å; R853-D856 PolarHBondContact O-N 3.48Å; R853-I857 PolarHBondContact O-N 2.92Å
854	L	88	Confident	86.8	Confident	0 Å²	0	58 Å²	58	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-63.8	-23.4	171.1	-65.1	172.5	0	0	0	112.4	Y795 L838 L839 L842 V851 L852 I858 F877	Y795-L854 HydrophobicContact CE1-CD2 3.69Å; Y795-L854 WeakPolarHBondContact OH-CD2 3.34Å; L838-L854 HydrophobicContact CD2-CD1 4.37Å; L838-L854 HydrophobicContact CD2-CD2 3.78Å; L838-L854 HydrophobicContact CG-CD1 4.36Å; L839-L854 HydrophobicContact CD2-CD1 3.82Å; L839-L854 HydrophobicContact CG-CD1 4.19Å; L842-L854 HydrophobicContact CD1-CD1 4.14Å; V851-L854 WeakPolarHBondContact O-CB 3.48Å; V851-L854 PolarHBondContact O-N 2.84Å; L852-L854 PolarHBondContact O-N 3.33Å; L854-I858 WeakPolarHBondContact O-CB 3.35Å; L854-I858 VanDerWaalsContact O-CG1 3.31Å; L854-I858 WeakPolarHBondContact O-CG1 3.36Å; L854-I858 PolarHBondContact O-N 3.3Å; L854-F877 HydrophobicContact CB-CE2 4.29Å; L854-F877 HydrophobicContact CB-CZ 4Å
855	A	87.7	Confident	86.9	Confident	30 Å²	30	54.9 Å²	54.9	25%	0.248	28%	0.284	C	S	.	.	H	α-helix	trans	-63.9	-44.6	173.5	0	0	0	0	0	111.5	L852 R853 I858 S859 L881	L852-A855 WeakPolarHBondContact O-CB 3.47Å; L852-A855 PolarHBondContact O-N 2.73Å; R853-A855 PolarHBondContact O-N 2.75Å; A855-I858 PolarHBondContact O-N 2.85Å; A855-S859 VanDerWaalsContact O-CB 3.32Å; A855-S859 WeakPolarHBondContact O-CB 3.25Å; A855-S859 PolarHBondContact O-N 3.39Å; A855-S859 PolarHBondContact O-OG 3.07Å; A855-L881 HydrophobicContact CB-CD1 3.8Å
856	D	88.4	Confident	87	Confident	111 Å²	111	57.5 Å²	57.5	59%	0.594	29%	0.29	S	S	*	.	H	α-helix	trans	-64.7	-42.6	178.3	-51.7	-43.2	0	0	0	110.6	R853 S859 S860	R853-D856 PolarHBondContact O-N 3.48Å; D856-S859 PolarHBondContact O-OG 3.01Å; D856-S860 WeakPolarHBondContact O-CB 3.25Å; D856-S860 PolarHBondContact O-N 3.1Å
857	I	88.5	Confident	87.2	Confident	33 Å²	33	59.9 Å²	59.9	17%	0.169	29%	0.293	C	S	.	.	H	α-helix	trans	-64.9	-44.6	179.4	-70.8	172	0	0	0	111.6	Y795 L799 R853 S860 L865	Y795-I857 HydrophobicContact CD1-CD1 4.21Å; Y795-I857 HydrophobicContact CE1-CD1 3.45Å; Y795-I857 VanDerWaalsContact CE1-CD1 3.45Å; L799-I857 HydrophobicContact CD2-CG2 3.92Å; R853-I857 PolarHBondContact O-N 2.92Å; I857-S860 WeakPolarHBondContact O-CB 3.37Å; I857-S860 PolarHBondContact O-N 3.44Å; I857-L865 HydrophobicContact CG2-CD1 4.1Å
858	I	89.1	Confident	87.3	Confident	6 Å²	6	58.7 Å²	58.7	3%	0.031	29%	0.291	C	S	.	.	H	α-helix	trans	-74.3	-35.2	-178.1	-66.9	167.4	0	0	0	112.1	T835 L854 A855 S860 L865 Y866 F869 F877	T835-I858 HydrophobicContact CG2-CD1 3.53Å; L854-I858 WeakPolarHBondContact O-CB 3.35Å; L854-I858 VanDerWaalsContact O-CG1 3.31Å; L854-I858 WeakPolarHBondContact O-CG1 3.36Å; L854-I858 PolarHBondContact O-N 3.3Å; A855-I858 PolarHBondContact O-N 2.85Å; I858-S860 VanDerWaalsContact C-N 3.3Å; I858-L865 HydrophobicContact CG2-CB 4.32Å; I858-Y866 WeakPolarHBondContact O-CB 3.37Å; I858-Y866 WeakPolarHBondContact O-CD1 3.35Å; I858-Y866 PolarHBondContact O-N 2.96Å; I858-F869 HydrophobicContact CD1-CE1 4.49Å; I858-F869 HydrophobicContact CD1-CZ 3.92Å; I858-F869 HydrophobicContact CG1-CZ 4.39Å; I858-F869 HydrophobicContact CG2-CD2 4.42Å; I858-F869 HydrophobicContact CG2-CE2 4.03Å; I858-F869 HydrophobicContact CG2-CZ 4.38Å; I858-F877 HydrophobicContact CD1-CD2 4.09Å; I858-F877 HydrophobicContact CD1-CE1 3.93Å; I858-F877 HydrophobicContact CD1-CE2 3.48Å; I858-F877 VanDerWaalsContact CD1-CE2 3.48Å; I858-F877 HydrophobicContact CD1-CZ 3.41Å; I858-F877 VanDerWaalsContact CD1-CZ 3.41Å
859	S	89.3	Confident	87.6	Confident	72 Å²	72	58.3 Å²	58.3	50%	0.503	29%	0.289	S	S	.	.	H	α-helix	trans	-78.6	-9.8	177.1	60.7	0	0	0	0	114.1	A855 D856 D861	A855-S859 VanDerWaalsContact O-CB 3.32Å; A855-S859 WeakPolarHBondContact O-CB 3.25Å; A855-S859 PolarHBondContact O-N 3.39Å; A855-S859 PolarHBondContact O-OG 3.07Å; D856-S859 PolarHBondContact O-OG 3.01Å; S859-D861 PolarHBondContact O-N 2.92Å
860	S	89.9	Confident	87.9	Confident	37 Å²	37	56.6 Å²	56.6	26%	0.259	29%	0.287	S	S	.	.			trans	-62.3	122.5	179.7	-178.8	0	0	0	0	113.4	D856 I857 I858 Q862 H863 K864	D856-S860 WeakPolarHBondContact O-CB 3.25Å; D856-S860 PolarHBondContact O-N 3.1Å; I857-S860 WeakPolarHBondContact O-CB 3.37Å; I857-S860 PolarHBondContact O-N 3.44Å; I858-S860 VanDerWaalsContact C-N 3.3Å; S860-Q862 PolarHBondContact O-N 2.77Å; S860-Q862 VanDerWaalsContact O-N 3.16Å; S860-Q862 WeakPolarHBondContact OG-CB 3.36Å; S860-Q862 PolarHBondContact OG-N 3.35Å; S860-H863 PolarHBondContact O-N 3.26Å; S860-K864 WeakPolarHBondContact O-CA 3.49Å; S860-K864 PolarHBondContact O-N 3.15Å
861	D	85.3	Confident	88.1	Confident	107 Å²	107	63.9 Å²	63.9	57%	0.572	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-7.8	172.8	-79.9	-45	0	0	0	114.3	S859 K864 Y866	S859-D861 PolarHBondContact O-N 2.92Å; D861-K864 WeakPolarHBondContact O-CE 3.15Å; D861-K864 WeakPolarHBondContact O-CG 3.38Å; D861-Y866 WeakPolarHBondContact OD1-CE1 3.41Å; D861-Y866 PolarHBondContact OD1-OH 3.08Å
862	Q	83.7	Confident	88.3	Confident	156 Å²	156	69.7 Å²	69.7	73%	0.729	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-42.9	174.5	-176.6	177.3	-10.4	0	0	112	S860	S860-Q862 PolarHBondContact O-N 2.77Å; S860-Q862 VanDerWaalsContact O-N 3.16Å; S860-Q862 WeakPolarHBondContact OG-CB 3.36Å; S860-Q862 PolarHBondContact OG-N 3.35Å
863	H	83.5	Confident	88.5	Confident	27 Å²	27	70.8 Å²	70.8	13%	0.125	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.1	-11.8	-179.8	-61	-84	0	0	0	112.9	S860 L865	S860-H863 PolarHBondContact O-N 3.26Å; H863-L865 HydrophobicContact CB-CD2 4.23Å; H863-L865 HydrophobicContact CB-CG 3.94Å; H863-L865 PolarHBondContact O-N 3.08Å; H863-L865 VanDerWaalsContact O-N 3.09Å
864	K	87.9	Confident	88.7	Confident	101 Å²	101	66.3 Å²	66.3	44%	0.439	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.6	31.3	175.8	-60.4	174.7	-177.9	167.7	0	113.9	S860 D861 Y866 Q867	S860-K864 WeakPolarHBondContact O-CA 3.49Å; S860-K864 PolarHBondContact O-N 3.15Å; D861-K864 WeakPolarHBondContact O-CE 3.15Å; D861-K864 WeakPolarHBondContact O-CG 3.38Å; K864-Y866 HydrophobicContact CB-CE1 4.34Å; K864-Y866 HydrophobicContact CG-CE1 4.47Å; K864-Y866 PolarHBondContact O-N 3.38Å; K864-Y866 VanDerWaalsContact O-N 3.13Å; K864-Q867 HydrophobicContact CB-CG 4.2Å; K864-Q867 WeakPolarHBondContact O-CB 3.34Å; K864-Q867 PolarHBondContact O-N 2.73Å
865	L	88.4	Confident	88.9	Confident	5 Å²	5	74.8 Å²	74.8	3%	0.026	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-55.9	-35.8	-174.4	-62.7	175.6	0	0	0	111.5	L798 L831 I857 I858 H863 Q867 V868 F869	L798-L865 HydrophobicContact CB-CD1 4.31Å; L798-L865 HydrophobicContact CD2-CD1 4.45Å; L831-L865 HydrophobicContact CD1-CD2 4.17Å; I857-L865 HydrophobicContact CG2-CD1 4.1Å; I858-L865 HydrophobicContact CG2-CB 4.32Å; H863-L865 HydrophobicContact CB-CD2 4.23Å; H863-L865 HydrophobicContact CB-CG 3.94Å; H863-L865 PolarHBondContact O-N 3.08Å; H863-L865 VanDerWaalsContact O-N 3.09Å; L865-Q867 PolarHBondContact O-N 2.77Å; L865-V868 WeakPolarHBondContact O-CB 3.22Å; L865-V868 PolarHBondContact O-N 2.68Å; L865-F869 VanDerWaalsContact O-CD2 3.28Å; L865-F869 WeakPolarHBondContact O-CD2 3.36Å
866	Y	87.3	Confident	89.1	Confident	79 Å²	79	79.4 Å²	79.4	31%	0.31	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-51.9	-23.8	174.5	66.5	-97.7	0	0	0	115.3	I858 D861 K864 V868	I858-Y866 WeakPolarHBondContact O-CB 3.37Å; I858-Y866 WeakPolarHBondContact O-CD1 3.35Å; I858-Y866 PolarHBondContact O-N 2.96Å; D861-Y866 WeakPolarHBondContact OD1-CE1 3.41Å; D861-Y866 PolarHBondContact OD1-OH 3.08Å; K864-Y866 HydrophobicContact CB-CE1 4.34Å; K864-Y866 HydrophobicContact CG-CE1 4.47Å; K864-Y866 PolarHBondContact O-N 3.38Å; K864-Y866 VanDerWaalsContact O-N 3.13Å; Y866-V868 VanDerWaalsContact C-N 3.3Å
867	Q	89.4	Confident	89.2	Confident	126 Å²	126	74.5 Å²	74.5	59%	0.589	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-78	-16.5	178.3	-56.6	-172.8	3.1	0	0	112.9	K864 L865	K864-Q867 HydrophobicContact CB-CG 4.2Å; K864-Q867 WeakPolarHBondContact O-CB 3.34Å; K864-Q867 PolarHBondContact O-N 2.73Å; L865-Q867 PolarHBondContact O-N 2.77Å
868	V	90.1	Very high	89.4	Confident	21 Å²	21	78.1 Å²	78.1	13%	0.127	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-21.8	-174.3	-176.6	0	0	0	0	112.3	R827 L831 L865 Y866	R827-V868 HydrophobicContact CB-CG1 4.01Å; R827-V868 WeakPolarHBondContact O-CG1 3.5Å; L831-V868 HydrophobicContact CB-CG1 4.33Å; L831-V868 HydrophobicContact CD1-CG1 4.28Å; L865-V868 WeakPolarHBondContact O-CB 3.22Å; L865-V868 PolarHBondContact O-N 2.68Å; Y866-V868 VanDerWaalsContact C-N 3.3Å
869	F	91.4	Very high	89.5	Confident	14 Å²	14	82 Å²	82	6%	0.061	39%	0.39	C	S	.	.	S	Bend	trans	-87.1	141.7	-178.8	-70	-117.2	0	0	0	111.3	P832 T835 I858 L865 E873 L874	P832-F869 HydrophobicContact CB-CD1 3.77Å; P832-F869 HydrophobicContact CB-CE1 3.77Å; P832-F869 HydrophobicContact CB-CG 4.27Å; P832-F869 HydrophobicContact CB-CZ 4.26Å; P832-F869 HydrophobicContact CG-CD1 3.97Å; P832-F869 HydrophobicContact CG-CD2 4.14Å; P832-F869 HydrophobicContact CG-CE1 4.19Å; P832-F869 HydrophobicContact CG-CE2 4.35Å; P832-F869 HydrophobicContact CG-CG 3.94Å; P832-F869 HydrophobicContact CG-CZ 4.37Å; T835-F869 HydrophobicContact CG2-CE1 4.12Å; T835-F869 HydrophobicContact CG2-CZ 3.98Å; I858-F869 HydrophobicContact CD1-CE1 4.49Å; I858-F869 HydrophobicContact CD1-CZ 3.92Å; I858-F869 HydrophobicContact CG1-CZ 4.39Å; I858-F869 HydrophobicContact CG2-CD2 4.42Å; I858-F869 HydrophobicContact CG2-CE2 4.03Å; I858-F869 HydrophobicContact CG2-CZ 4.38Å; L865-F869 VanDerWaalsContact O-CD2 3.28Å; L865-F869 WeakPolarHBondContact O-CD2 3.36Å; F869-E873 HydrophobicContact CB-CB 4.41Å; F869-E873 HydrophobicContact CD1-CB 4.05Å; F869-L874 HydrophobicContact CB-CD1 4.38Å; F869-L874 HydrophobicContact CB-CD2 3.68Å; F869-L874 HydrophobicContact CB-CG 3.67Å; F869-L874 HydrophobicContact CD1-CD2 4.2Å; F869-L874 HydrophobicContact CG-CD2 3.93Å; F869-L874 HydrophobicContact CG-CG 4.43Å
870	S	91.1	Very high	89.5	Confident	54 Å²	54	82.5 Å²	82.5	38%	0.378	38%	0.383	S	S	.	.			trans	-67.1	158.5	166.5	71.9	0	0	0	0	111.8	E872 E873 L874	S870-E872 PolarHBondContact O-N 3.02Å; S870-E872 VanDerWaalsContact O-N 3.17Å; S870-E873 WeakPolarHBondContact CB-OE2 3.33Å; S870-E873 PolarHBondContact N-OE2 3.15Å; S870-E873 PolarHBondContact O-N 3.07Å; S870-E873 VanDerWaalsContact O-N 3.1Å; S870-E873 VanDerWaalsContact OG-CD 3.32Å; S870-E873 WeakPolarHBondContact OG-CG 3.16Å; S870-E873 PolarHBondContact OG-N 2.9Å; S870-E873 PolarHBondContact OG-OE2 3.18Å; S870-L874 PolarHBondContact O-N 2.89Å
871	K	90.2	Very high	89.5	Confident	195 Å²	195	81.5 Å²	81.5	85%	0.848	37%	0.374	S	S	*	.	H	α-helix	trans	-60.2	-25.4	175.1	-66.2	-179.4	-178.8	175.1	0	113	R875	K871-R875 WeakPolarHBondContact O-CB 3.39Å; K871-R875 PolarHBondContact O-N 2.91Å
872	E	91.1	Very high	89.7	Confident	123 Å²	123	83.3 Å²	83.3	58%	0.575	37%	0.373	S	S	*	.	H	α-helix	trans	-75.8	-42.6	173.7	-70.9	-160.8	-162.5	0	0	112.3	S870 R875 R876	S870-E872 PolarHBondContact O-N 3.02Å; S870-E872 VanDerWaalsContact O-N 3.17Å; E872-R875 WeakPolarHBondContact O-CB 3.32Å; E872-R875 PolarHBondContact O-N 2.99Å; E872-R875 VanDerWaalsContact O-N 3.14Å; E872-R876 VanDerWaalsContact O-CG 3.32Å; E872-R876 WeakPolarHBondContact O-CG 3.43Å; E872-R876 PolarHBondContact O-N 2.64Å; E872-R876 IonicContact OE2-CZ 3.51Å; E872-R876 IonicContact OE2-NH2 3.77Å; E872-R876 PolarHBondContact OE2-NH2 3.35Å
873	E	91.3	Very high	90	Very high	45 Å²	45	78.8 Å²	78.8	21%	0.21	35%	0.354	C	S	.	.	H	α-helix	trans	-66	-43	177.9	-70.4	161.2	122.3	0	0	111.1	P832 F836 F869 S870 R875 R876 F877	P832-E873 WeakPolarHBondContact CB-OE1 3.4Å; F836-E873 HydrophobicContact CE2-CB 4.04Å; F836-E873 HydrophobicContact CE2-CG 4.16Å; F836-E873 HydrophobicContact CZ-CB 4.32Å; F869-E873 HydrophobicContact CB-CB 4.41Å; F869-E873 HydrophobicContact CD1-CB 4.05Å; S870-E873 WeakPolarHBondContact CB-OE2 3.33Å; S870-E873 PolarHBondContact N-OE2 3.15Å; S870-E873 PolarHBondContact O-N 3.07Å; S870-E873 VanDerWaalsContact O-N 3.1Å; S870-E873 VanDerWaalsContact OG-CD 3.32Å; S870-E873 WeakPolarHBondContact OG-CG 3.16Å; S870-E873 PolarHBondContact OG-N 2.9Å; S870-E873 PolarHBondContact OG-OE2 3.18Å; E873-R875 PolarHBondContact O-N 2.71Å; E873-R876 PolarHBondContact O-N 3.32Å; E873-R876 VanDerWaalsContact O-N 3.14Å; E873-F877 VanDerWaalsContact O-CB 3.25Å; E873-F877 WeakPolarHBondContact O-CB 3.25Å; E873-F877 PolarHBondContact O-N 2.92Å
874	L	91.3	Very high	90.2	Very high	50 Å²	50	77.5 Å²	77.5	26%	0.262	35%	0.348	S	S	.	.	H	α-helix	trans	-57.3	-37.4	171.3	-68.2	176.3	0	0	0	111.8	F869 S870 L878	F869-L874 HydrophobicContact CB-CD1 4.38Å; F869-L874 HydrophobicContact CB-CD2 3.68Å; F869-L874 HydrophobicContact CB-CG 3.67Å; F869-L874 HydrophobicContact CD1-CD2 4.2Å; F869-L874 HydrophobicContact CG-CD2 3.93Å; F869-L874 HydrophobicContact CG-CG 4.43Å; S870-L874 PolarHBondContact O-N 2.89Å; L874-L878 WeakPolarHBondContact O-CB 3.36Å; L874-L878 VanDerWaalsContact O-CG 3.25Å; L874-L878 WeakPolarHBondContact O-CG 3.48Å; L874-L878 PolarHBondContact O-N 3.35Å
875	R	91.3	Very high	90.2	Very high	178 Å²	178	73.8 Å²	73.8	67%	0.672	34%	0.335	S	S	*	.	H	α-helix	trans	-67.9	-42	175.6	-169.7	179.6	-172.6	179.4	3.2	112.5	K871 E872 E873 Q879	K871-R875 WeakPolarHBondContact O-CB 3.39Å; K871-R875 PolarHBondContact O-N 2.91Å; E872-R875 WeakPolarHBondContact O-CB 3.32Å; E872-R875 PolarHBondContact O-N 2.99Å; E872-R875 VanDerWaalsContact O-N 3.14Å; E873-R875 PolarHBondContact O-N 2.71Å; R875-Q879 VanDerWaalsContact O-CG 3.3Å; R875-Q879 WeakPolarHBondContact O-CG 3.38Å; R875-Q879 PolarHBondContact O-N 3.04Å; R875-Q879 VanDerWaalsContact O-N 3.07Å
876	R	91.9	Very high	90.2	Very high	127 Å²	127	77.7 Å²	77.7	48%	0.479	36%	0.355	S	S	.	.	H	α-helix	trans	-67.2	-38.1	175.8	-65.3	170.1	-157.2	176.6	6.6	111.3	F836 E872 E873 Q879 K880	F836-R876 HydrophobicContact CE1-CB 4.22Å; F836-R876 HydrophobicContact CZ-CB 3.99Å; E872-R876 VanDerWaalsContact O-CG 3.32Å; E872-R876 WeakPolarHBondContact O-CG 3.43Å; E872-R876 PolarHBondContact O-N 2.64Å; E872-R876 IonicContact OE2-CZ 3.51Å; E872-R876 IonicContact OE2-NH2 3.77Å; E872-R876 PolarHBondContact OE2-NH2 3.35Å; E873-R876 PolarHBondContact O-N 3.32Å; E873-R876 VanDerWaalsContact O-N 3.14Å; R876-Q879 WeakPolarHBondContact O-CB 3.45Å; R876-Q879 PolarHBondContact O-N 3.31Å; R876-K880 PolarHBondContact O-N 2.73Å
877	F	92.1	Very high	90.2	Very high	8 Å²	8	75.1 Å²	75.1	4%	0.035	35%	0.35	C	S	.	.	H	α-helix	trans	-62	-51.6	174.5	178.7	-99.1	0	0	0	111.1	T835 F836 L839 L854 I858 E873 Q879 K880 L881	T835-F877 HydrophobicContact CG2-CD2 3.82Å; T835-F877 HydrophobicContact CG2-CE2 3.68Å; F836-F877 HydrophobicContact CE1-CB 4.22Å; F836-F877 HydrophobicContact CZ-CB 4.14Å; L839-F877 HydrophobicContact CD1-CD2 3.49Å; L839-F877 VanDerWaalsContact CD1-CD2 3.49Å; L839-F877 HydrophobicContact CD1-CE2 3.76Å; L839-F877 HydrophobicContact CD2-CE2 4.18Å; L839-F877 HydrophobicContact CG-CD2 4.37Å; L839-F877 HydrophobicContact CG-CE2 4.15Å; L854-F877 HydrophobicContact CB-CE2 4.29Å; L854-F877 HydrophobicContact CB-CZ 4Å; I858-F877 HydrophobicContact CD1-CD2 4.09Å; I858-F877 HydrophobicContact CD1-CE1 3.93Å; I858-F877 HydrophobicContact CD1-CE2 3.48Å; I858-F877 VanDerWaalsContact CD1-CE2 3.48Å; I858-F877 HydrophobicContact CD1-CZ 3.41Å; I858-F877 VanDerWaalsContact CD1-CZ 3.41Å; E873-F877 VanDerWaalsContact O-CB 3.25Å; E873-F877 WeakPolarHBondContact O-CB 3.25Å; E873-F877 PolarHBondContact O-N 2.92Å; F877-Q879 VanDerWaalsContact C-N 3.29Å; F877-Q879 PolarHBondContact O-N 2.73Å; F877-K880 WeakPolarHBondContact O-CB 3.44Å; F877-K880 PolarHBondContact O-N 3.2Å; F877-K880 VanDerWaalsContact O-N 3.07Å; F877-L881 HydrophobicContact CD1-CD1 4.03Å; F877-L881 HydrophobicContact CD1-CG 4.29Å; F877-L881 HydrophobicContact CE1-CD1 3.43Å; F877-L881 VanDerWaalsContact CE1-CD1 3.43Å; F877-L881 HydrophobicContact CE1-CD2 4.26Å; F877-L881 HydrophobicContact CE1-CG 3.89Å; F877-L881 HydrophobicContact CE2-CD2 4.35Å; F877-L881 HydrophobicContact CZ-CD1 3.88Å; F877-L881 HydrophobicContact CZ-CD2 3.86Å; F877-L881 HydrophobicContact CZ-CG 3.99Å; F877-L881 WeakPolarHBondContact O-CG 3.38Å; F877-L881 PolarHBondContact O-N 2.96Å
878	L	91.1	Very high	90	Very high	110 Å²	110	69.2 Å²	69.2	58%	0.576	32%	0.323	S	S	*	.	H	α-helix	trans	-60.7	-34.5	175.8	-71.3	168	0	0	0	113	L874 L881 R882	L874-L878 WeakPolarHBondContact O-CB 3.36Å; L874-L878 VanDerWaalsContact O-CG 3.25Å; L874-L878 WeakPolarHBondContact O-CG 3.48Å; L874-L878 PolarHBondContact O-N 3.35Å; L878-L881 HydrophobicContact CD2-CD1 4.39Å; L878-R882 PolarHBondContact O-N 3.49Å; L878-R882 VanDerWaalsContact O-N 3.08Å
879	Q	91.3	Very high	89.8	Confident	88 Å²	88	71.9 Å²	71.9	41%	0.411	34%	0.336	S	S	.	.	H	α-helix	trans	-63	-48.3	171.2	-74.9	168.7	-23.7	0	0	111.3	R875 R876 F877 L881 R882 D883	R875-Q879 VanDerWaalsContact O-CG 3.3Å; R875-Q879 WeakPolarHBondContact O-CG 3.38Å; R875-Q879 PolarHBondContact O-N 3.04Å; R875-Q879 VanDerWaalsContact O-N 3.07Å; R876-Q879 WeakPolarHBondContact O-CB 3.45Å; R876-Q879 PolarHBondContact O-N 3.31Å; F877-Q879 VanDerWaalsContact C-N 3.29Å; F877-Q879 PolarHBondContact O-N 2.73Å; Q879-L881 VanDerWaalsContact C-N 3.35Å; Q879-L881 PolarHBondContact O-N 2.61Å; Q879-R882 WeakPolarHBondContact O-CB 3.26Å; Q879-R882 PolarHBondContact O-N 3.16Å; Q879-D883 PolarHBondContact O-N 2.91Å
880	K	89.7	Confident	89.6	Confident	81 Å²	81	78.3 Å²	78.3	35%	0.352	37%	0.371	S	S	.	.	H	α-helix	trans	-60.9	-38.5	176.5	-77.3	-62.1	-154.1	158.9	0	113.4	L839 Q843 R876 F877 D883 S884	L839-K880 HydrophobicContact CD1-CB 3.94Å; L839-K880 HydrophobicContact CD1-CG 4.4Å; Q843-K880 PolarHBondContact NE2-O 3.38Å; R876-K880 PolarHBondContact O-N 2.73Å; F877-K880 WeakPolarHBondContact O-CB 3.44Å; F877-K880 PolarHBondContact O-N 3.2Å; F877-K880 VanDerWaalsContact O-N 3.07Å; K880-D883 PolarHBondContact O-N 3.22Å; K880-S884 PolarHBondContact O-N 3.31Å; K880-S884 VanDerWaalsContact O-N 3.13Å
881	L	89.3	Confident	89.3	Confident	16 Å²	16	81 Å²	81	8%	0.084	38%	0.377	C	S	.	.	H	α-helix	trans	-61.8	-46.5	172.9	-67.1	-173.4	0	0	0	112	L839 V851 L852 A855 F877 L878 Q879 D883 S884 S885	L839-L881 HydrophobicContact CD2-CD2 4.34Å; V851-L881 HydrophobicContact CG1-CD2 3.68Å; V851-L881 WeakPolarHBondContact O-CD2 3.45Å; L852-L881 HydrophobicContact CD2-CB 4.15Å; L852-L881 HydrophobicContact CD2-CD2 4.25Å; A855-L881 HydrophobicContact CB-CD1 3.8Å; F877-L881 HydrophobicContact CD1-CD1 4.03Å; F877-L881 HydrophobicContact CD1-CG 4.29Å; F877-L881 HydrophobicContact CE1-CD1 3.43Å; F877-L881 VanDerWaalsContact CE1-CD1 3.43Å; F877-L881 HydrophobicContact CE1-CD2 4.26Å; F877-L881 HydrophobicContact CE1-CG 3.89Å; F877-L881 HydrophobicContact CE2-CD2 4.35Å; F877-L881 HydrophobicContact CZ-CD1 3.88Å; F877-L881 HydrophobicContact CZ-CD2 3.86Å; F877-L881 HydrophobicContact CZ-CG 3.99Å; F877-L881 WeakPolarHBondContact O-CG 3.38Å; F877-L881 PolarHBondContact O-N 2.96Å; L878-L881 HydrophobicContact CD2-CD1 4.39Å; Q879-L881 VanDerWaalsContact C-N 3.35Å; Q879-L881 PolarHBondContact O-N 2.61Å; L881-D883 VanDerWaalsContact C-N 3.28Å; L881-D883 PolarHBondContact O-N 2.72Å; L881-S884 PolarHBondContact O-N 3.22Å; L881-S885 PolarHBondContact O-N 2.96Å
882	R	90.5	Very high	88.8	Confident	145 Å²	145	74 Å²	74	55%	0.547	36%	0.361	S	S	.	.	H	α-helix	trans	-58.3	-41.6	175.6	-179.4	-154	65.4	178.3	-2.6	111.4	L878 Q879 S884 S885 L886	L878-R882 PolarHBondContact O-N 3.49Å; L878-R882 VanDerWaalsContact O-N 3.08Å; Q879-R882 WeakPolarHBondContact O-CB 3.26Å; Q879-R882 PolarHBondContact O-N 3.16Å; R882-S884 VanDerWaalsContact C-N 3.34Å; R882-S884 PolarHBondContact O-N 2.76Å; R882-S885 WeakPolarHBondContact O-CB 3.37Å; R882-S885 PolarHBondContact O-N 3.46Å; R882-S885 VanDerWaalsContact O-N 3.1Å; R882-L886 WeakPolarHBondContact O-CG 3.39Å; R882-L886 PolarHBondContact O-N 2.88Å
883	D	88.9	Confident	88.5	Confident	62 Å²	62	69.7 Å²	69.7	33%	0.332	34%	0.342	S	S	.	.	H	α-helix	trans	-66.1	-36.6	-179.3	-57.8	-17.8	0	0	0	111.5	Q879 K880 L881 A887	Q879-D883 PolarHBondContact O-N 2.91Å; K880-D883 PolarHBondContact O-N 3.22Å; L881-D883 VanDerWaalsContact C-N 3.28Å; L881-D883 PolarHBondContact O-N 2.72Å; D883-A887 PolarHBondContact O-N 2.84Å
884	S	89.1	Confident	88.1	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-67.1	-35.3	168.4	-73.4	0	0	0	0	113.5	Q843 H848 V851 K880 L881 R882 A887 L888	Q843-S884 WeakPolarHBondContact CG-OG 3.42Å; Q843-S884 PolarHBondContact NE2-OG 3.31Å; H848-S884 PolarHBondContact ND1-OG 3.18Å; V851-S884 VanDerWaalsContact CG1-OG 3.28Å; V851-S884 WeakPolarHBondContact CG1-OG 3.36Å; K880-S884 PolarHBondContact O-N 3.31Å; K880-S884 VanDerWaalsContact O-N 3.13Å; L881-S884 PolarHBondContact O-N 3.22Å; R882-S884 VanDerWaalsContact C-N 3.34Å; R882-S884 PolarHBondContact O-N 2.76Å; S884-A887 PolarHBondContact O-N 3.44Å; S884-L888 WeakPolarHBondContact O-CG 3.31Å; S884-L888 PolarHBondContact O-N 3.42Å; S884-L888 VanDerWaalsContact O-N 3.12Å
885	S	87.2	Confident	87.4	Confident	23 Å²	23	68.9 Å²	68.9	16%	0.161	35%	0.345	C	S	.	.	H	α-helix	trans	-66.5	-37	176.7	-172.4	0	0	0	0	112	L881 R882 L888 L889 P895	L881-S885 PolarHBondContact O-N 2.96Å; R882-S885 WeakPolarHBondContact O-CB 3.37Å; R882-S885 PolarHBondContact O-N 3.46Å; R882-S885 VanDerWaalsContact O-N 3.1Å; S885-L888 PolarHBondContact O-N 2.9Å; S885-L889 WeakPolarHBondContact O-CG 3.32Å; S885-L889 PolarHBondContact O-N 3.28Å; S885-L889 VanDerWaalsContact O-N 3.13Å; S885-P895 WeakPolarHBondContact OG-CA 3.44Å; S885-P895 PolarHBondContact OG-O 3.06Å
886	L	88.6	Confident	86.9	Confident	87 Å²	87	65.9 Å²	65.9	46%	0.455	34%	0.341	S	S	.	.	H	α-helix	trans	-64	-44	171.1	-68.7	170.7	0	0	0	111.6	R882 L888 L889 D890	R882-L886 WeakPolarHBondContact O-CG 3.39Å; R882-L886 PolarHBondContact O-N 2.88Å; L886-L888 VanDerWaalsContact C-N 3.25Å; L886-L888 PolarHBondContact O-N 3.43Å; L886-L889 HydrophobicContact CD2-CD1 4.49Å; L886-L889 WeakPolarHBondContact O-CB 3.26Å; L886-L889 PolarHBondContact O-N 3.33Å; L886-L889 VanDerWaalsContact O-N 3.09Å; L886-D890 PolarHBondContact O-N 3.49Å
887	A	86.4	Confident	86.2	Confident	24 Å²	24	59.9 Å²	59.9	20%	0.198	32%	0.319	C	S	.	.	H	α-helix	trans	-61.6	-30.4	176.4	0	0	0	0	0	113.4	D883 S884 Q891	D883-A887 PolarHBondContact O-N 2.84Å; S884-A887 PolarHBondContact O-N 3.44Å; A887-Q891 VanDerWaalsContact O-CG 3.23Å; A887-Q891 WeakPolarHBondContact O-CG 3.43Å; A887-Q891 PolarHBondContact O-N 3.12Å
888	L	86.6	Confident	85.8	Confident	3 Å²	3	67.7 Å²	67.7	2%	0.016	35%	0.349	C	S	.	.	H	α-helix	trans	-72.7	-37.9	172.8	-72.1	163.4	0	0	0	112.5	H848 Q849 L852 S884 S885 L886 Q891 G892 L893	H848-L888 HydrophobicContact CB-CD1 3.85Å; H848-L888 HydrophobicContact CB-CD2 3.86Å; H848-L888 HydrophobicContact CB-CG 3.61Å; Q849-L888 HydrophobicContact CG-CD2 4.22Å; L852-L888 HydrophobicContact CD1-CD1 3.68Å; S884-L888 WeakPolarHBondContact O-CG 3.31Å; S884-L888 PolarHBondContact O-N 3.42Å; S884-L888 VanDerWaalsContact O-N 3.12Å; S885-L888 PolarHBondContact O-N 2.9Å; L886-L888 VanDerWaalsContact C-N 3.25Å; L886-L888 PolarHBondContact O-N 3.43Å; L888-Q891 CarbonylContact O-C 3.57Å; L888-Q891 WeakPolarHBondContact O-CB 3.49Å; L888-Q891 PolarHBondContact O-N 3.28Å; L888-G892 PolarHBondContact O-N 2.89Å; L888-L893 HydrophobicContact CB-CB 4.47Å; L888-L893 HydrophobicContact CD2-CD1 3.81Å; L888-L893 PolarHBondContact O-N 2.89Å
889	L	86.3	Confident	85.4	Confident	77 Å²	77	69 Å²	69	40%	0.403	36%	0.357	S	S	.	.	H	α-helix	trans	-65.6	-40	174.4	-73.2	162.1	0	0	0	111.9	S885 L886 Q891 G892 P895	S885-L889 WeakPolarHBondContact O-CG 3.32Å; S885-L889 PolarHBondContact O-N 3.28Å; S885-L889 VanDerWaalsContact O-N 3.13Å; L886-L889 HydrophobicContact CD2-CD1 4.49Å; L886-L889 WeakPolarHBondContact O-CB 3.26Å; L886-L889 PolarHBondContact O-N 3.33Å; L886-L889 VanDerWaalsContact O-N 3.09Å; L889-Q891 PolarHBondContact O-N 3.29Å; L889-G892 PolarHBondContact O-N 3.48Å; L889-P895 HydrophobicContact CD1-CG 4.45Å; L889-P895 HydrophobicContact CD2-CG 4.14Å
890	D	86.8	Confident	84.5	Confident	148 Å²	148	70.1 Å²	70.1	79%	0.791	37%	0.365	S	S	*	.	H	α-helix	trans	-64.4	-23.6	173	-71.4	-26	0	0	0	112.6	L886 G892	L886-D890 PolarHBondContact O-N 3.49Å; D890-G892 VanDerWaalsContact C-N 3.33Å
891	Q	83.5	Confident	83.5	Confident	111 Å²	111	75.2 Å²	75.2	52%	0.519	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-1	172.4	-69.4	168.6	20.6	0	0	113.4	A887 L888 L889	A887-Q891 VanDerWaalsContact O-CG 3.23Å; A887-Q891 WeakPolarHBondContact O-CG 3.43Å; A887-Q891 PolarHBondContact O-N 3.12Å; L888-Q891 CarbonylContact O-C 3.57Å; L888-Q891 WeakPolarHBondContact O-CB 3.49Å; L888-Q891 PolarHBondContact O-N 3.28Å; L889-Q891 PolarHBondContact O-N 3.29Å
892	G	80.8	Confident	82	Confident	49 Å²	49	84 Å²	84	51%	0.505	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.7	9.4	-179.6	0	0	0	0	0	115.2	L888 L889 D890 L900	L888-G892 PolarHBondContact O-N 2.89Å; L889-G892 PolarHBondContact O-N 3.48Å; D890-G892 VanDerWaalsContact C-N 3.33Å; G892-L900 WeakPolarHBondContact O-CD1 3.38Å
893	L	83.8	Confident	81.6	Confident	32 Å²	32	81 Å²	81	17%	0.168	44%	0.443	C	S	.	.			trans	-90	164.7	173.6	-63	169.2	0	0	0	110.5	L888	L888-L893 HydrophobicContact CB-CB 4.47Å; L888-L893 HydrophobicContact CD2-CD1 3.81Å; L888-L893 PolarHBondContact O-N 2.89Å
894	G	83	Confident	81.2	Confident	7 Å²	7	81.9 Å²	81.9	7%	0.072	45%	0.449	C	S	.	.			trans	-67.2	169.6	172	0	0	0	0	0	112.8	L896 G897 Y898	G894-L896 PolarHBondContact O-N 3.42Å; G894-G897 WeakPolarHBondContact O-CA 3.47Å; G894-G897 PolarHBondContact O-N 3.41Å; G894-Y898 PolarHBondContact N-O 3.43Å
895	P	78.3	Confident	80.8	Confident	71 Å²	71	86.5 Å²	86.5	46%	0.461	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-21.2	-178.1	-24.9	33.4	0	0	0	115.3	L852 S885 L889	L852-P895 VanDerWaalsContact CD1-O 3.3Å; L852-P895 WeakPolarHBondContact CD1-O 3.43Å; S885-P895 WeakPolarHBondContact OG-CA 3.44Å; S885-P895 PolarHBondContact OG-O 3.06Å; L889-P895 HydrophobicContact CD1-CG 4.45Å; L889-P895 HydrophobicContact CD2-CG 4.14Å
896	L	79.4	Confident	80.4	Confident	115 Å²	115	90.2 Å²	90.2	60%	0.602	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.3	6.5	176.3	-61.8	178.2	0	0	0	113.4	L852 G894 Y898	L852-L896 HydrophobicContact CD1-CD2 4.24Å; G894-L896 PolarHBondContact O-N 3.42Å; L896-Y898 VanDerWaalsContact C-N 3.32Å; L896-Y898 HydrophobicContact CB-CD2 3.77Å; L896-Y898 HydrophobicContact CB-CE2 3.81Å; L896-Y898 HydrophobicContact CD1-CE2 4.29Å; L896-Y898 PolarHBondContact O-N 3.15Å
897	G	78.4	Confident	79.9	Confident	1 Å²	1	90.4 Å²	90.4	1%	0.01	50%	0.495	C	S	.	.	S	Bend	trans	78.9	4.3	178.4	0	0	0	0	0	115.9	Q849 G894	Q849-G897 PolarHBondContact NE2-O 2.94Å; G894-G897 WeakPolarHBondContact O-CA 3.47Å; G894-G897 PolarHBondContact O-N 3.41Å
898	Y	83.6	Confident	79.5	Confident	171 Å²	171	94.9 Å²	94.9	67%	0.671	52%	0.515	S	S	*	.			trans	-71.6	152.5	166.8	-58.5	-69.5	0	0	0	111.1	G894 L896 L900	G894-Y898 PolarHBondContact N-O 3.43Å; L896-Y898 VanDerWaalsContact C-N 3.32Å; L896-Y898 HydrophobicContact CB-CD2 3.77Å; L896-Y898 HydrophobicContact CB-CE2 3.81Å; L896-Y898 HydrophobicContact CD1-CE2 4.29Å; L896-Y898 PolarHBondContact O-N 3.15Å; Y898-L900 PolarHBondContact O-N 3.39Å
899	D	81.1	Confident	79	Confident	137 Å²	137	101.4 Å²	101.4	73%	0.733	55%	0.55	S	S	*	*			trans	-56.8	137.2	170.5	-62.9	-55	0	0	0	111.1	Q901	D899-Q901 PolarHBondContact O-N 2.91Å
900	L	72.9	Confident	78.4	Confident	112 Å²	112	103.3 Å²	103.3	59%	0.586	56%	0.562	S	S	*	*			trans	-68.8	111.8	171.3	-68.6	173.7	0	0	0	108.9	G892 Y898	G892-L900 WeakPolarHBondContact O-CD1 3.38Å; Y898-L900 PolarHBondContact O-N 3.39Å
901	Q	68.6	Low	77.7	Confident	188 Å²	188	99.6 Å²	99.6	88%	0.879	54%	0.543	S	S	*	.			trans	-64	136	169.2	-69.2	-172.2	-12.7	0	0	109.5	D899	D899-Q901 PolarHBondContact O-N 2.91Å
902	P	59.4	Low	77.2	Confident	201 Å²	201	98.5 Å²	98.5	100%	1.305	55%	0.545	S	S	*	.			trans	-76.9	0	-168.6	32.1	-37.7	0	0	0	114.7

Retrieved 902 of 902 residues in 1173 ms (Link to these results)

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