Q99NU2_RAT Loading...

Cannabinoid receptor 1

AlphaFold DB , UniProt , Accession Q99NU2, Species RAT (Rattus norvegicus, Rat), Gene Cnr1, Length 331 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	F	33.3	Very low	29.4	Very low	256 Å²	256	169.2 Å²	169.2	100%	1.123	86%	0.855	S	S	*	*				0	93.2	0	-80.3	-95.4	0	0	0	107.2
2	R	31.4	Very low	29.2	Very low	248 Å²	248	164 Å²	164	94%	0.936	86%	0.857	S	S	*	*				92.5	116.6	99	-168	-169.3	-111.6	-166.5	-1.4	108.1
3	G	30.2	Very low	29	Very low	73 Å²	73	157.7 Å²	157.7	75%	0.753	86%	0.856	S	S	*	*			cis	-177.4	156.1	4	0	0	0	0	0	109.1
4	S	27.7	Very low	29.1	Very low	118 Å²	118	157.1 Å²	157.1	83%	0.825	85%	0.853	S	S	*	*			trans	-59.3	-173.6	172.6	-19.1	0	0	0	0	113.1
5	P	40.9	Very low	28.9	Very low	117 Å²	117	157 Å²	157	76%	0.76	85%	0.851	S	S	*	*			cis	-137.2	166.2	-2.7	32.9	-11.7	0	0	0	114.9
6	F	26.9	Very low	29.2	Very low	219 Å²	219	153.9 Å²	153.9	96%	0.961	85%	0.845	S	S	*	*			trans	-116.4	134.1	151.8	-144	-95.5	0	0	0	108.5
7	Q	28.8	Very low	29.4	Very low	182 Å²	182	150.9 Å²	150.9	85%	0.85	83%	0.834	S	S	*	*			trans	-89.1	136.3	-155.5	-161.3	175.5	-9.2	0	0	111.6
8	E	25.8	Very low	29.3	Very low	147 Å²	147	151.2 Å²	151.2	69%	0.687	83%	0.833	S	S	*	*			trans	-69	138.8	172.2	-170.6	175	-167.5	0	0	111.5
9	K	26.3	Very low	29.6	Very low	214 Å²	214	150.4 Å²	150.4	93%	0.93	83%	0.833	S	S	*	*			trans	-141.8	103.4	150.6	-116	-176.1	-177.5	-177	0	109.7
10	M	25.6	Very low	29.5	Very low	150 Å²	150	148.8 Å²	148.8	74%	0.739	83%	0.829	S	S	*	*			trans	-68.2	144.1	163.5	-80	174.9	169.5	0	0	111.6
11	T	27.1	Very low	29.9	Very low	137 Å²	137	146.4 Å²	146.4	84%	0.84	83%	0.829	S	S	*	*				-171.3	100.9	128.7	34.9	0	0	0	0	106.3
12	A	26.9	Very low	30.4	Very low	107 Å²	107	137.5 Å²	137.5	88%	0.884	81%	0.81	S	S	*	*				78.4	115.8	88.6	0	0	0	0	0	113.2
13	G	26	Very low	30.4	Very low	82 Å²	82	133.2 Å²	133.2	85%	0.845	81%	0.805	S	S	*	*			trans	157.1	58.8	171.6	0	0	0	0	0	114.2
14	D	30.2	Very low	30.9	Very low	150 Å²	150	135.7 Å²	135.7	80%	0.802	81%	0.806	S	S	*	*			trans	-71	128.6	167.7	-156.2	5.2	0	0	0	108.9
15	N	27.3	Very low	31.7	Very low	155 Å²	155	136.1 Å²	136.1	83%	0.829	80%	0.804	S	S	*	*			trans	-168.7	97	161.6	-98.6	-15.2	0	0	0	109.4
16	S	32.2	Very low	31.9	Very low	107 Å²	107	135.2 Å²	135.2	75%	0.748	79%	0.792	S	S	*	*			trans	-65.9	141.7	150.6	-58.7	0	0	0	0	108.6
17	P	33.2	Very low	33.2	Very low	103 Å²	103	131.7 Å²	131.7	67%	0.669	78%	0.782	S	S	*	*				-142.6	135.7	124.7	23.5	-3.3	0	0	0	114.7
18	L	27.2	Very low	34	Very low	156 Å²	156	127.3 Å²	127.3	82%	0.817	77%	0.768	S	S	*	*			trans	59.8	115.5	133	-74.2	127.7	0	0	0	119.7	P20	L18-P20 VanDerWaalsContact O-CD 3.31Å; L18-P20 WeakPolarHBondContact O-CD 3.43Å
19	V	34.8	Very low	34.8	Very low	136 Å²	136	126.9 Å²	126.9	82%	0.824	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-54.7	123.3	152.6	174.9	0	0	0	0	109.8
20	P	29.3	Very low	35.8	Very low	118 Å²	118	124.8 Å²	124.8	77%	0.766	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-90.6	122.6	155.4	5.7	15.1	0	0	0	108.5	L18	L18-P20 VanDerWaalsContact O-CD 3.31Å; L18-P20 WeakPolarHBondContact O-CD 3.43Å
21	A	37.4	Very low	36.5	Very low	99 Å²	99	121.6 Å²	121.6	82%	0.818	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-69.8	135	160.6	0	0	0	0	0	109.1
22	G	42.8	Very low	37.2	Very low	70 Å²	70	119.4 Å²	119.4	72%	0.722	72%	0.721	S	S	*	*			trans	95	94.1	163.9	0	0	0	0	0	114.7
23	D	32.5	Very low	37.8	Very low	158 Å²	158	121.8 Å²	121.8	85%	0.845	71%	0.711	S	S	*	*			trans	-128.6	98	147.8	-95.5	-29.3	0	0	0	107.8	T25	D23-T25 PolarHBondContact O-N 3.49Å
24	T	40.5	Very low	38.7	Very low	124 Å²	124	120.6 Å²	120.6	76%	0.761	69%	0.69	S	S	*	*			trans	-56.3	93.7	150.3	33.9	0	0	0	0	106.9	N26	T24-N26 PolarHBondContact O-N 3.27Å
25	T	44.7	Very low	39.4	Very low	127 Å²	127	116.1 Å²	116.1	78%	0.779	67%	0.666	S	S	*	*			trans	-49.3	106.4	161.8	28.7	0	0	0	0	107	D23 I27	D23-T25 PolarHBondContact O-N 3.49Å; T25-I27 PolarHBondContact O-N 3.14Å
26	N	45.6	Very low	40.1	Very low	98 Å²	98	111.7 Å²	111.7	52%	0.524	65%	0.647	S	S	.	*			trans	-59.9	112.7	-178.1	-91.2	-34.8	0	0	0	107.2	T24 T28 E29 F30	T24-N26 PolarHBondContact O-N 3.27Å; N26-T28 PolarHBondContact O-N 2.88Å; N26-E29 HydrophobicContact CB-CB 4.14Å; N26-E29 WeakPolarHBondContact O-CA 3.35Å; N26-E29 WeakPolarHBondContact O-CB 3.41Å; N26-E29 PolarHBondContact O-N 3.11Å; N26-F30 PolarHBondContact O-N 2.94Å
27	I	52.5	Low	40.4	Very low	146 Å²	146	109.6 Å²	109.6	75%	0.749	63%	0.632	S	S	*	*	H	α-helix	trans	-51.1	-31.9	173.2	-65.3	168.9	0	0	0	109.8	T25 E29 F30 Y31	T25-I27 PolarHBondContact O-N 3.14Å; I27-E29 VanDerWaalsContact C-N 3.3Å; I27-E29 PolarHBondContact O-N 2.95Å; I27-F30 PolarHBondContact O-N 3.25Å; I27-Y31 WeakPolarHBondContact O-CB 3.49Å; I27-Y31 PolarHBondContact O-N 3.47Å
28	T	45.3	Very low	41	Very low	89 Å²	89	107.8 Å²	107.8	55%	0.546	61%	0.614	S	S	.	*	H	α-helix	trans	-58.7	-35.2	173	-29.3	0	0	0	0	113.5	N26 N32	N26-T28 PolarHBondContact O-N 2.88Å; T28-N32 VanDerWaalsContact O-CB 3.27Å; T28-N32 WeakPolarHBondContact O-CB 3.49Å; T28-N32 PolarHBondContact O-N 3.28Å; T28-N32 PolarHBondContact O-ND2 2.92Å; T28-N32 PolarHBondContact O-OD1 3.47Å
29	E	42.8	Very low	41.8	Very low	138 Å²	138	106.9 Å²	106.9	65%	0.645	60%	0.603	S	S	*	*	H	α-helix	trans	-79.4	-37.1	-178.9	-158.7	170.6	-161.1	0	0	111.4	N26 I27 Y31 N32 K33	N26-E29 HydrophobicContact CB-CB 4.14Å; N26-E29 WeakPolarHBondContact O-CA 3.35Å; N26-E29 WeakPolarHBondContact O-CB 3.41Å; N26-E29 PolarHBondContact O-N 3.11Å; I27-E29 VanDerWaalsContact C-N 3.3Å; I27-E29 PolarHBondContact O-N 2.95Å; E29-Y31 VanDerWaalsContact C-N 3.33Å; E29-N32 PolarHBondContact O-N 3.09Å; E29-K33 VanDerWaalsContact O-CB 3.29Å; E29-K33 WeakPolarHBondContact O-CB 3.39Å; E29-K33 PolarHBondContact O-N 3.38Å
30	F	47.9	Very low	42.1	Very low	170 Å²	170	107.6 Å²	107.6	75%	0.746	60%	0.598	S	S	*	*	H	α-helix	trans	-62.4	-42.1	167.9	-168	-92.5	0	0	0	111.2	N26 I27 K33 S34	N26-F30 PolarHBondContact O-N 2.94Å; I27-F30 PolarHBondContact O-N 3.25Å; F30-K33 PolarHBondContact O-N 2.94Å; F30-S34 PolarHBondContact O-N 3.46Å; F30-S34 PolarHBondContact O-OG 3.31Å
31	Y	40.3	Very low	42.8	Very low	83 Å²	83	106.2 Å²	106.2	33%	0.325	58%	0.584	S	S	.	*	H	α-helix	trans	-66.9	-39.1	177.2	-161.2	-90.7	0	0	0	112.6	I27 E29 K33 S34 L35 P62 S63	I27-Y31 WeakPolarHBondContact O-CB 3.49Å; I27-Y31 PolarHBondContact O-N 3.47Å; E29-Y31 VanDerWaalsContact C-N 3.33Å; Y31-K33 VanDerWaalsContact C-N 3.35Å; Y31-S34 WeakPolarHBondContact CA-OG 3.35Å; Y31-S34 PolarHBondContact O-N 2.95Å; Y31-S34 PolarHBondContact O-OG 3.36Å; Y31-L35 WeakPolarHBondContact O-CB 3.26Å; Y31-L35 PolarHBondContact O-N 3.37Å; Y31-P62 HydrophobicContact CE1-CB 4.19Å; Y31-P62 HydrophobicContact CE2-CB 4.49Å; Y31-P62 WeakPolarHBondContact OH-CB 3.47Å; Y31-P62 PolarHBondContact OH-O 2.93Å; Y31-S63 PolarHBondContact OH-N 3.23Å
32	N	40.8	Very low	43.2	Very low	91 Å²	91	106.8 Å²	106.8	49%	0.487	57%	0.57	S	S	.	*	H	α-helix	trans	-69.3	-35.6	176.5	-74.6	-17.1	0	0	0	111.6	T28 E29 L35 S36	T28-N32 VanDerWaalsContact O-CB 3.27Å; T28-N32 WeakPolarHBondContact O-CB 3.49Å; T28-N32 PolarHBondContact O-N 3.28Å; T28-N32 PolarHBondContact O-ND2 2.92Å; T28-N32 PolarHBondContact O-OD1 3.47Å; E29-N32 PolarHBondContact O-N 3.09Å; N32-L35 PolarHBondContact O-N 2.91Å; N32-S36 WeakPolarHBondContact O-CB 3.29Å; N32-S36 PolarHBondContact O-N 3.47Å; N32-S36 PolarHBondContact O-OG 2.97Å
33	K	39.5	Very low	43.2	Very low	158 Å²	158	112 Å²	112	69%	0.687	58%	0.575	S	S	*	*	H	α-helix	trans	-70.8	-36.3	175.1	-167.8	172.5	-177	175.6	0	112.4	E29 F30 Y31 S36 S37	E29-K33 VanDerWaalsContact O-CB 3.29Å; E29-K33 WeakPolarHBondContact O-CB 3.39Å; E29-K33 PolarHBondContact O-N 3.38Å; F30-K33 PolarHBondContact O-N 2.94Å; Y31-K33 VanDerWaalsContact C-N 3.35Å; K33-S36 PolarHBondContact O-OG 2.93Å; K33-S37 WeakPolarHBondContact O-CB 3.4Å; K33-S37 PolarHBondContact O-N 2.66Å; K33-S37 VanDerWaalsContact O-N 3.14Å
34	S	47	Very low	43.4	Very low	57 Å²	57	111.4 Å²	111.4	40%	0.399	57%	0.572	S	S	.	*	H	α-helix	trans	-68.9	-38.7	170.8	67.2	0	0	0	0	111.4	F30 Y31 S37 F38	F30-S34 PolarHBondContact O-N 3.46Å; F30-S34 PolarHBondContact O-OG 3.31Å; Y31-S34 WeakPolarHBondContact CA-OG 3.35Å; Y31-S34 PolarHBondContact O-N 2.95Å; Y31-S34 PolarHBondContact O-OG 3.36Å; S34-S37 PolarHBondContact O-N 3.36Å; S34-F38 WeakPolarHBondContact O-CB 3.3Å; S34-F38 PolarHBondContact O-N 3.25Å
35	L	44.4	Very low	43.6	Very low	56 Å²	56	109.2 Å²	109.2	29%	0.293	56%	0.555	S	S	.	*	H	α-helix	trans	-67	-37.7	177.8	-173.9	71.5	0	0	0	112.5	Y31 N32 F38 K39 P62	Y31-L35 WeakPolarHBondContact O-CB 3.26Å; Y31-L35 PolarHBondContact O-N 3.37Å; N32-L35 PolarHBondContact O-N 2.91Å; L35-F38 PolarHBondContact O-N 2.99Å; L35-K39 PolarHBondContact O-N 2.89Å; L35-P62 HydrophobicContact CD1-CB 4.48Å; L35-P62 HydrophobicContact CD1-CG 3.72Å
36	S	41.8	Very low	43.1	Very low	62 Å²	62	112 Å²	112	43%	0.434	56%	0.559	S	S	.	*	H	α-helix	trans	-70.5	-41.7	176	64.8	0	0	0	0	111.6	N32 K33 F38 K39 E40	N32-S36 WeakPolarHBondContact O-CB 3.29Å; N32-S36 PolarHBondContact O-N 3.47Å; N32-S36 PolarHBondContact O-OG 2.97Å; K33-S36 PolarHBondContact O-OG 2.93Å; S36-F38 VanDerWaalsContact C-N 3.25Å; S36-F38 PolarHBondContact O-N 3.44Å; S36-K39 PolarHBondContact O-N 2.95Å; S36-E40 PolarHBondContact O-N 3.26Å
37	S	39.1	Very low	43.2	Very low	63 Å²	63	111.7 Å²	111.7	44%	0.441	56%	0.563	S	S	.	*	H	α-helix	trans	-62.5	-32.7	171.9	177.4	0	0	0	0	112.4	K33 S34 N41	K33-S37 WeakPolarHBondContact O-CB 3.4Å; K33-S37 PolarHBondContact O-N 2.66Å; K33-S37 VanDerWaalsContact O-N 3.14Å; S34-S37 PolarHBondContact O-N 3.36Å; S37-N41 PolarHBondContact O-N 3.1Å
38	F	45.5	Very low	42.5	Very low	64 Å²	64	106.7 Å²	106.7	28%	0.281	55%	0.548	S	S	.	.	H	α-helix	trans	-70.9	-41.5	176.2	-156.4	-91.3	0	0	0	111.6	S34 L35 S36 N41 E42	S34-F38 WeakPolarHBondContact O-CB 3.3Å; S34-F38 PolarHBondContact O-N 3.25Å; L35-F38 PolarHBondContact O-N 2.99Å; S36-F38 VanDerWaalsContact C-N 3.25Å; S36-F38 PolarHBondContact O-N 3.44Å; F38-N41 PolarHBondContact O-N 3.49Å; F38-E42 PolarHBondContact O-N 3.19Å; F38-E42 VanDerWaalsContact O-N 3.16Å
39	K	43.3	Very low	42.5	Very low	138 Å²	138	111.7 Å²	111.7	60%	0.6	57%	0.565	S	S	*	*	H	α-helix	trans	-67.6	-38	177.4	-81.7	-175.7	173.6	-175.9	0	113.7	L35 S36 N41 E42	L35-K39 PolarHBondContact O-N 2.89Å; S36-K39 PolarHBondContact O-N 2.95Å; K39-N41 VanDerWaalsContact C-N 3.28Å; K39-N41 PolarHBondContact O-N 3.25Å; K39-E42 PolarHBondContact O-N 3.33Å
40	E	41.3	Very low	42.6	Very low	151 Å²	151	112.8 Å²	112.8	71%	0.706	58%	0.575	S	S	*	*	H	α-helix	trans	-67.9	-27.5	175.7	-85.8	-178.7	151.9	0	0	112.8	S36	S36-E40 PolarHBondContact O-N 3.26Å
41	N	44.6	Very low	42.2	Very low	88 Å²	88	112 Å²	112	47%	0.471	57%	0.572	S	S	.	*	H	α-helix	trans	-81.6	-26.6	176	-78.2	-10.6	0	0	0	113.1	S37 F38 K39 E43 N44 I45	S37-N41 PolarHBondContact O-N 3.1Å; F38-N41 PolarHBondContact O-N 3.49Å; K39-N41 VanDerWaalsContact C-N 3.28Å; K39-N41 PolarHBondContact O-N 3.25Å; N41-E43 VanDerWaalsContact C-N 3.27Å; N41-E43 PolarHBondContact O-N 3.47Å; N41-N44 PolarHBondContact O-N 3.42Å; N41-I45 HydrophobicContact CB-CD1 4.23Å; N41-I45 VanDerWaalsContact O-CD1 3.28Å; N41-I45 WeakPolarHBondContact O-CD1 3.3Å; N41-I45 WeakPolarHBondContact O-CG1 3.44Å; N41-I45 PolarHBondContact O-N 2.88Å
42	E	45.2	Very low	42.8	Very low	112 Å²	112	113.6 Å²	113.6	52%	0.523	58%	0.584	S	S	.	*	H	α-helix	trans	-65.5	-27.1	-177.5	-135.7	175.4	177.9	0	0	113.1	F38 K39	F38-E42 PolarHBondContact O-N 3.19Å; F38-E42 VanDerWaalsContact O-N 3.16Å; K39-E42 PolarHBondContact O-N 3.33Å
43	E	42	Very low	43.4	Very low	179 Å²	179	111.8 Å²	111.8	84%	0.836	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	-9.8	-178.8	-71.4	-173.6	169.1	0	0	114.5	N41	N41-E43 VanDerWaalsContact C-N 3.27Å; N41-E43 PolarHBondContact O-N 3.47Å
44	N	36.7	Very low	44.2	Very low	145 Å²	145	105.8 Å²	105.8	78%	0.775	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125	3	-175.5	-85.6	-35.8	0	0	0	115.9	N41 Q46	N41-N44 PolarHBondContact O-N 3.42Å; N44-Q46 PolarHBondContact O-N 2.91Å
45	I	45	Very low	44.6	Very low	79 Å²	79	106.2 Å²	106.2	41%	0.405	54%	0.544	S	S	.	.			trans	-81.7	91.4	177.8	-63.9	158.9	0	0	0	109.9	N41 C47	N41-I45 HydrophobicContact CB-CD1 4.23Å; N41-I45 VanDerWaalsContact O-CD1 3.28Å; N41-I45 WeakPolarHBondContact O-CD1 3.3Å; N41-I45 WeakPolarHBondContact O-CG1 3.44Å; N41-I45 PolarHBondContact O-N 2.88Å; I45-C47 PolarHBondContact O-N 2.82Å
46	Q	35.3	Very low	45.3	Very low	186 Å²	186	105.4 Å²	105.4	87%	0.869	54%	0.543	S	S	*	.			trans	-82.1	95.5	166.6	-161.6	159.6	2.1	0	0	108.1	N44 G48	N44-Q46 PolarHBondContact O-N 2.91Å; Q46-G48 VanDerWaalsContact C-N 3.3Å; Q46-G48 PolarHBondContact O-N 3.49Å
47	C	46.4	Very low	46.3	Very low	90 Å²	90	104.7 Å²	104.7	61%	0.608	53%	0.532	S	S	*	.			trans	-62.9	91.4	174.3	-57.6	0	0	0	0	108.7	I45 C56	I45-C47 PolarHBondContact O-N 2.82Å; C47-C56 HydrophobicContact CB-CB 4.35Å; C47-C56 WeakPolarHBondContact CB-SG 3.47Å; C47-C56 WeakPolarHBondContact SG-CB 3.29Å; C47-C56 CovalentContact SG-SG 2.06Å; C47-C56 PolarHBondContact SG-SG 3.25Å
48	G	37.6	Very low	47.3	Very low	41 Å²	41	103.4 Å²	103.4	42%	0.423	52%	0.52	S	S	.	.			trans	-112.4	149.7	-173.3	0	0	0	0	0	112.9	Q46 N50 F51	Q46-G48 VanDerWaalsContact C-N 3.3Å; Q46-G48 PolarHBondContact O-N 3.49Å; G48-N50 PolarHBondContact O-N 2.96Å; G48-F51 PolarHBondContact O-N 3.11Å
49	E	46	Very low	48.4	Very low	194 Å²	194	101.9 Å²	101.9	91%	0.907	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	1.2	-159.2	-65.4	-176.1	142.9	0	0	119.4
50	N	44	Very low	49.7	Very low	161 Å²	161	96.2 Å²	96.2	86%	0.861	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.6	9	-175.2	-76.8	-55.7	0	0	0	117.4	G48	G48-N50 PolarHBondContact O-N 2.96Å
51	F	41.3	Very low	51.5	Low	154 Å²	154	92.8 Å²	92.8	68%	0.675	48%	0.477	S	S	*	.			trans	-147.2	96.1	159.8	-158.9	-107.9	0	0	0	106.9	G48 D53	G48-F51 PolarHBondContact O-N 3.11Å; F51-D53 VanDerWaalsContact CD1-CG 3.48Å; F51-D53 WeakPolarHBondContact CD1-OD1 3.27Å; F51-D53 WeakPolarHBondContact CE1-OD1 3.3Å; F51-D53 PolarHBondContact O-N 3.18Å
52	M	51	Low	53.1	Low	117 Å²	117	89.9 Å²	89.9	58%	0.576	46%	0.462	S	S	*	.			trans	-66	85	169.8	-75.3	-71.3	-141.2	0	0	107.2	M54	M52-M54 PolarHBondContact O-N 3.16Å
53	D	53.5	Low	54.9	Low	52 Å²	52	88.3 Å²	88.3	28%	0.278	46%	0.464	S	S	.	.			trans	-60.8	117.6	169.5	-88.6	-47.7	0	0	0	107.1	F51 E55 C56	F51-D53 VanDerWaalsContact CD1-CG 3.48Å; F51-D53 WeakPolarHBondContact CD1-OD1 3.27Å; F51-D53 WeakPolarHBondContact CE1-OD1 3.3Å; F51-D53 PolarHBondContact O-N 3.18Å; D53-E55 HydrophobicContact CB-CB 4.26Å; D53-E55 PolarHBondContact O-N 2.77Å; D53-C56 WeakPolarHBondContact O-CB 3.44Å; D53-C56 PolarHBondContact O-N 3.31Å
54	M	57	Low	56.7	Low	32 Å²	32	82.3 Å²	82.3	16%	0.158	44%	0.436	C	S	.	.	G	3₁₀ helix	trans	-47.6	-25.4	169.1	-101.3	166.6	154.8	0	0	113	M52 C56 F57 F126 D133 F138	M52-M54 PolarHBondContact O-N 3.16Å; M54-C56 PolarHBondContact O-N 2.96Å; M54-F57 PolarHBondContact O-N 3.4Å; M54-F126 HydrophobicContact CB-CE2 4.31Å; M54-F126 HydrophobicContact SD-CE2 4.3Å; M54-D133 HydrophobicContact CE-CB 4.4Å; M54-D133 HydrophobicContact SD-CB 4.26Å; M54-F138 HydrophobicContact CE-CB 3.31Å; M54-F138 HydrophobicContact CE-CD1 3.67Å; M54-F138 HydrophobicContact CE-CD2 2.89Å; M54-F138 HydrophobicContact CE-CE1 4.18Å; M54-F138 HydrophobicContact CE-CE2 3.46Å; M54-F138 VanDerWaalsContact CE-CE2 3.46Å; M54-F138 HydrophobicContact CE-CG 2.97Å; M54-F138 HydrophobicContact CE-CZ 4.07Å
55	E	56.4	Low	58.8	Low	67 Å²	67	76.7 Å²	76.7	31%	0.313	41%	0.405	S	S	.	.	G	3₁₀ helix	trans	-59	-30.6	174.6	-60.3	179	178	0	0	112.3	D53 F57 M58 K132	D53-E55 HydrophobicContact CB-CB 4.26Å; D53-E55 PolarHBondContact O-N 2.77Å; E55-F57 PolarHBondContact O-N 3.11Å; E55-M58 HydrophobicContact CG-SD 4.4Å; E55-M58 WeakPolarHBondContact O-CB 3.13Å; E55-M58 PolarHBondContact O-N 3.36Å; E55-K132 WeakPolarHBondContact OE1-CE 3.35Å; E55-K132 IonicContact OE1-NZ 2.88Å; E55-K132 PolarHBondContact OE1-NZ 3.43Å
56	C	58.9	Low	60.6	Low	38 Å²	38	77.8 Å²	77.8	26%	0.257	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-66.3	-17.2	174.4	-70.4	0	0	0	0	113.3	C47 D53 M54	C47-C56 HydrophobicContact CB-CB 4.35Å; C47-C56 WeakPolarHBondContact CB-SG 3.47Å; C47-C56 WeakPolarHBondContact SG-CB 3.29Å; C47-C56 CovalentContact SG-SG 2.06Å; C47-C56 PolarHBondContact SG-SG 3.25Å; D53-C56 WeakPolarHBondContact O-CB 3.44Å; D53-C56 PolarHBondContact O-N 3.31Å; M54-C56 PolarHBondContact O-N 2.96Å
57	F	61.1	Low	63	Low	48 Å²	48	71 Å²	71	21%	0.211	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-94.9	-6.7	174.8	-65.1	-96.9	0	0	0	112.6	M54 E55 I59 D215 P218	M54-F57 PolarHBondContact O-N 3.4Å; E55-F57 PolarHBondContact O-N 3.11Å; F57-I59 PolarHBondContact O-N 3.47Å; F57-D215 WeakPolarHBondContact CE1-O 3.32Å; F57-P218 HydrophobicContact CB-CG 4.34Å; F57-P218 HydrophobicContact CD1-CG 3.96Å; F57-P218 HydrophobicContact CD2-CB 4.27Å; F57-P218 HydrophobicContact CD2-CG 3.72Å; F57-P218 HydrophobicContact CE1-CG 4.14Å; F57-P218 HydrophobicContact CE2-CB 4.02Å; F57-P218 HydrophobicContact CE2-CG 3.91Å; F57-P218 HydrophobicContact CG-CG 3.74Å; F57-P218 HydrophobicContact CZ-CB 4.24Å; F57-P218 HydrophobicContact CZ-CG 4.12Å
58	M	62.1	Low	64.7	Low	36 Å²	36	67.1 Å²	67.1	18%	0.177	36%	0.36	C	S	.	.			trans	-79.7	70	175	-63.3	-179.7	65.6	0	0	110.5	E55 L60 F126	E55-M58 HydrophobicContact CG-SD 4.4Å; E55-M58 WeakPolarHBondContact O-CB 3.13Å; E55-M58 PolarHBondContact O-N 3.36Å; M58-L60 VanDerWaalsContact C-N 3.3Å; M58-L60 PolarHBondContact O-N 3.43Å; M58-F126 HydrophobicContact CE-CE1 4.36Å; M58-F126 HydrophobicContact CG-CE1 3.7Å; M58-F126 HydrophobicContact CG-CZ 3.56Å; M58-F126 HydrophobicContact SD-CE1 4Å; M58-F126 HydrophobicContact SD-CZ 3.71Å
59	I	67.4	Low	66.9	Low	31 Å²	31	66.2 Å²	66.2	16%	0.159	35%	0.348	C	S	.	.			trans	-82.7	-8.2	-172.8	-70.4	169	0	0	0	112.9	F57 K322 K325	F57-I59 PolarHBondContact O-N 3.47Å; I59-K322 HydrophobicContact CG2-CD 4.1Å; I59-K322 HydrophobicContact CG2-CG 3.34Å; I59-K325 HydrophobicContact CD1-CB 3.77Å; I59-K325 HydrophobicContact CD1-CD 3.38Å; I59-K325 HydrophobicContact CD1-CG 4.16Å
60	L	71	Confident	68.8	Low	19 Å²	19	60.9 Å²	60.9	10%	0.099	33%	0.329	C	S	.	.			trans	-82.8	140.1	-172.1	-67.8	108.7	0	0	0	113	M58 Q64 I68 A329 F330	M58-L60 VanDerWaalsContact C-N 3.3Å; M58-L60 PolarHBondContact O-N 3.43Å; L60-Q64 HydrophobicContact CB-CB 4.35Å; L60-Q64 HydrophobicContact CD2-CB 3.97Å; L60-I68 HydrophobicContact CD2-CD1 3.24Å; L60-I68 HydrophobicContact CD2-CG1 4.34Å; L60-A329 HydrophobicContact CD1-CB 4.01Å; L60-A329 HydrophobicContact CD2-CB 4.17Å; L60-A329 HydrophobicContact CG-CB 4.48Å; L60-F330 HydrophobicContact CD2-CE2 4.22Å
61	N	78.5	Confident	71	Confident	80 Å²	80	57.3 Å²	57.3	43%	0.428	31%	0.309	S	S	.	.			trans	-70.1	154.3	170	-64.2	-24.6	0	0	0	110.5	S63 Q64 Q65	N61-S63 VanDerWaalsContact C-N 3.26Å; N61-S63 PolarHBondContact O-N 3.26Å; N61-S63 VanDerWaalsContact O-N 3.13Å; N61-Q64 HydrophobicContact CB-CG 4.26Å; N61-Q64 WeakPolarHBondContact O-CA 3.34Å; N61-Q64 WeakPolarHBondContact O-CB 3.42Å; N61-Q64 PolarHBondContact O-N 3.28Å; N61-Q65 PolarHBondContact O-N 3.34Å
62	P	78.4	Confident	73.1	Confident	26 Å²	26	50.8 Å²	50.8	17%	0.169	28%	0.283	C	S	.	.	H	α-helix	trans	-55.1	-36.8	-179.3	-32.4	40.3	0	0	0	114.6	Y31 L35 Q65 L66	Y31-P62 HydrophobicContact CE1-CB 4.19Å; Y31-P62 HydrophobicContact CE2-CB 4.49Å; Y31-P62 WeakPolarHBondContact OH-CB 3.47Å; Y31-P62 PolarHBondContact OH-O 2.93Å; L35-P62 HydrophobicContact CD1-CB 4.48Å; L35-P62 HydrophobicContact CD1-CG 3.72Å; P62-Q65 PolarHBondContact O-N 3.19Å; P62-L66 WeakPolarHBondContact O-CB 3.49Å; P62-L66 PolarHBondContact O-N 3.24Å
63	S	82.2	Confident	74.9	Confident	80 Å²	80	49.5 Å²	49.5	56%	0.559	28%	0.278	S	S	*	.	H	α-helix	trans	-66.9	-37	174.8	54.6	0	0	0	0	113.1	Y31 N61 A67	Y31-S63 PolarHBondContact OH-N 3.23Å; N61-S63 VanDerWaalsContact C-N 3.26Å; N61-S63 PolarHBondContact O-N 3.26Å; N61-S63 VanDerWaalsContact O-N 3.13Å; S63-A67 WeakPolarHBondContact O-CB 3.37Å; S63-A67 PolarHBondContact O-N 2.77Å
64	Q	81.6	Confident	76.7	Confident	53 Å²	53	50.7 Å²	50.7	25%	0.248	29%	0.287	C	S	.	.	H	α-helix	trans	-72.2	-41.4	176.8	-65.5	173	-41.2	0	0	110.8	L60 N61 L66 A67 I68 F330	L60-Q64 HydrophobicContact CB-CB 4.35Å; L60-Q64 HydrophobicContact CD2-CB 3.97Å; N61-Q64 HydrophobicContact CB-CG 4.26Å; N61-Q64 WeakPolarHBondContact O-CA 3.34Å; N61-Q64 WeakPolarHBondContact O-CB 3.42Å; N61-Q64 PolarHBondContact O-N 3.28Å; Q64-L66 VanDerWaalsContact C-N 3.34Å; Q64-L66 PolarHBondContact O-N 2.95Å; Q64-A67 PolarHBondContact O-N 2.98Å; Q64-I68 WeakPolarHBondContact O-CG1 3.26Å; Q64-I68 PolarHBondContact O-N 3.44Å; Q64-F330 HydrophobicContact CB-CE2 4.4Å; Q64-F330 HydrophobicContact CB-CZ 4.02Å; Q64-F330 HydrophobicContact CG-CZ 4.3Å
65	Q	79.1	Confident	78.4	Confident	27 Å²	27	54.3 Å²	54.3	13%	0.126	31%	0.306	C	S	.	.	H	α-helix	trans	-58.4	-45.8	174	-179.9	175.3	-3.2	0	0	111.3	N61 P62 A69 H127	N61-Q65 PolarHBondContact O-N 3.34Å; P62-Q65 PolarHBondContact O-N 3.19Å; Q65-A69 VanDerWaalsContact O-CB 3.27Å; Q65-A69 WeakPolarHBondContact O-CB 3.22Å; Q65-A69 PolarHBondContact O-N 3.46Å; Q65-H127 HydrophobicContact CG-CB 4.24Å; Q65-H127 PolarHBondContact NE2-ND1 3.28Å; Q65-H127 PolarHBondContact NE2-O 3.38Å
66	L	82.9	Confident	80.1	Confident	101 Å²	101	51.4 Å²	51.4	53%	0.529	30%	0.295	S	S	.	.	H	α-helix	trans	-62.4	-43.6	175.4	-179	63	0	0	0	111.9	P62 Q64 A69 V70	P62-L66 WeakPolarHBondContact O-CB 3.49Å; P62-L66 PolarHBondContact O-N 3.24Å; Q64-L66 VanDerWaalsContact C-N 3.34Å; Q64-L66 PolarHBondContact O-N 2.95Å; L66-A69 PolarHBondContact O-N 2.91Å; L66-V70 HydrophobicContact CD1-CG2 4.33Å; L66-V70 WeakPolarHBondContact O-CG2 3.44Å; L66-V70 PolarHBondContact O-N 3.17Å
67	A	85.9	Confident	81.6	Confident	43 Å²	43	53 Å²	53	36%	0.355	30%	0.303	S	S	.	.	H	α-helix	trans	-61.2	-48.3	178.9	0	0	0	0	0	111.8	S63 Q64 A69 V70 L71	S63-A67 WeakPolarHBondContact O-CB 3.37Å; S63-A67 PolarHBondContact O-N 2.77Å; Q64-A67 PolarHBondContact O-N 2.98Å; A67-A69 VanDerWaalsContact C-N 3.33Å; A67-A69 PolarHBondContact O-N 3.48Å; A67-V70 PolarHBondContact O-N 3.38Å; A67-L71 WeakPolarHBondContact O-CB 3.39Å; A67-L71 VanDerWaalsContact O-CG 3.27Å; A67-L71 WeakPolarHBondContact O-CG 3.37Å; A67-L71 PolarHBondContact O-N 3.02Å
68	I	82.8	Confident	83.2	Confident	10 Å²	10	56.2 Å²	56.2	5%	0.051	32%	0.317	C	S	.	.	H	α-helix	trans	-64.1	-41.1	176.6	-61.5	-178.5	0	0	0	110.3	L60 Q64 V70 L71 S72 F123 A329 F330	L60-I68 HydrophobicContact CD2-CD1 3.24Å; L60-I68 HydrophobicContact CD2-CG1 4.34Å; Q64-I68 WeakPolarHBondContact O-CG1 3.26Å; Q64-I68 PolarHBondContact O-N 3.44Å; I68-V70 VanDerWaalsContact C-N 3.34Å; I68-V70 PolarHBondContact O-N 3.24Å; I68-L71 PolarHBondContact O-N 3.39Å; I68-S72 VanDerWaalsContact O-CB 3.31Å; I68-S72 WeakPolarHBondContact O-CB 3.5Å; I68-S72 PolarHBondContact O-N 3.18Å; I68-S72 PolarHBondContact O-OG 3.44Å; I68-F123 HydrophobicContact CB-CE2 4.36Å; I68-F123 HydrophobicContact CB-CZ 3.96Å; I68-F123 HydrophobicContact CG2-CD2 4.5Å; I68-F123 HydrophobicContact CG2-CE2 3.41Å; I68-F123 VanDerWaalsContact CG2-CE2 3.41Å; I68-F123 HydrophobicContact CG2-CZ 3.45Å; I68-F123 VanDerWaalsContact CG2-CZ 3.45Å; I68-A329 HydrophobicContact CD1-CB 4.18Å; I68-F330 HydrophobicContact CD1-CD1 3.82Å; I68-F330 HydrophobicContact CD1-CD2 3.88Å; I68-F330 HydrophobicContact CD1-CE1 3.73Å; I68-F330 HydrophobicContact CD1-CE2 3.77Å; I68-F330 HydrophobicContact CD1-CG 3.9Å; I68-F330 HydrophobicContact CD1-CZ 3.69Å; I68-F330 HydrophobicContact CG1-CD1 3.54Å; I68-F330 HydrophobicContact CG1-CD2 4.45Å; I68-F330 HydrophobicContact CG1-CE1 3.23Å; I68-F330 HydrophobicContact CG1-CE2 4.19Å; I68-F330 HydrophobicContact CG1-CG 4.15Å; I68-F330 HydrophobicContact CG1-CZ 3.58Å
69	A	83.1	Confident	84.8	Confident	21 Å²	21	56.8 Å²	56.8	17%	0.174	32%	0.323	C	S	.	.	H	α-helix	trans	-57.1	-47.3	177.4	0	0	0	0	0	112.5	Q65 L66 A67 L73 F123	Q65-A69 VanDerWaalsContact O-CB 3.27Å; Q65-A69 WeakPolarHBondContact O-CB 3.22Å; Q65-A69 PolarHBondContact O-N 3.46Å; L66-A69 PolarHBondContact O-N 2.91Å; A67-A69 VanDerWaalsContact C-N 3.33Å; A67-A69 PolarHBondContact O-N 3.48Å; A69-L73 VanDerWaalsContact O-CB 3.22Å; A69-L73 WeakPolarHBondContact O-CB 3.45Å; A69-L73 PolarHBondContact O-N 3.27Å; A69-F123 HydrophobicContact CB-CE1 3.64Å; A69-F123 HydrophobicContact CB-CZ 4.36Å
70	V	87.4	Confident	86.1	Confident	82 Å²	82	56.7 Å²	56.7	50%	0.497	32%	0.324	S	S	.	.	H	α-helix	trans	-65.3	-44.8	177.6	173.7	0	0	0	0	110.7	L66 A67 I68 T74	L66-V70 HydrophobicContact CD1-CG2 4.33Å; L66-V70 WeakPolarHBondContact O-CG2 3.44Å; L66-V70 PolarHBondContact O-N 3.17Å; A67-V70 PolarHBondContact O-N 3.38Å; I68-V70 VanDerWaalsContact C-N 3.34Å; I68-V70 PolarHBondContact O-N 3.24Å; V70-T74 HydrophobicContact CG1-CG2 4.3Å; V70-T74 WeakPolarHBondContact O-CB 3.41Å; V70-T74 VanDerWaalsContact O-CG2 3.25Å; V70-T74 WeakPolarHBondContact O-CG2 3.29Å; V70-T74 PolarHBondContact O-N 2.88Å; V70-T74 PolarHBondContact O-OG1 3.19Å
71	L	88.4	Confident	87.3	Confident	86 Å²	86	60.9 Å²	60.9	45%	0.45	35%	0.346	S	S	.	.	H	α-helix	trans	-61.5	-50.6	177.9	-73	169.2	0	0	0	112	A67 I68 L73 T74 L75	A67-L71 WeakPolarHBondContact O-CB 3.39Å; A67-L71 VanDerWaalsContact O-CG 3.27Å; A67-L71 WeakPolarHBondContact O-CG 3.37Å; A67-L71 PolarHBondContact O-N 3.02Å; I68-L71 PolarHBondContact O-N 3.39Å; L71-L73 PolarHBondContact O-N 2.94Å; L71-T74 PolarHBondContact O-N 3.05Å; L71-T74 PolarHBondContact O-OG1 2.92Å; L71-T74 VanDerWaalsContact O-OG1 3.06Å; L71-L75 WeakPolarHBondContact O-CB 3.48Å; L71-L75 VanDerWaalsContact O-CG 3.27Å; L71-L75 WeakPolarHBondContact O-CG 3.24Å; L71-L75 PolarHBondContact O-N 3.38Å
72	S	86.5	Confident	88.2	Confident	17 Å²	17	61.7 Å²	61.7	12%	0.119	35%	0.347	C	S	.	.	H	α-helix	trans	-62.9	-41.3	179.8	-60.3	0	0	0	0	112.1	I68 G76	I68-S72 VanDerWaalsContact O-CB 3.31Å; I68-S72 WeakPolarHBondContact O-CB 3.5Å; I68-S72 PolarHBondContact O-N 3.18Å; I68-S72 PolarHBondContact O-OG 3.44Å; S72-G76 VanDerWaalsContact O-CA 3.3Å; S72-G76 WeakPolarHBondContact O-CA 3.32Å; S72-G76 PolarHBondContact O-N 2.91Å
73	L	88.9	Confident	89.1	Confident	90 Å²	90	61.5 Å²	61.5	47%	0.471	34%	0.344	S	S	.	.	H	α-helix	trans	-67.7	-44.6	178.2	-175.7	63.7	0	0	0	111.6	A69 L71 T77 V120	A69-L73 VanDerWaalsContact O-CB 3.22Å; A69-L73 WeakPolarHBondContact O-CB 3.45Å; A69-L73 PolarHBondContact O-N 3.27Å; L71-L73 PolarHBondContact O-N 2.94Å; L73-T77 VanDerWaalsContact O-CB 3.28Å; L73-T77 WeakPolarHBondContact O-CB 3.32Å; L73-T77 PolarHBondContact O-N 2.66Å; L73-T77 PolarHBondContact O-OG1 3.32Å; L73-V120 HydrophobicContact CD1-CG1 3.98Å
74	T	91.3	Very high	89.8	Confident	77 Å²	77	61.1 Å²	61.1	47%	0.472	34%	0.336	S	S	.	.	H	α-helix	trans	-69.4	-53	-178.9	52	0	0	0	0	111.9	V70 L71 T77 F78	V70-T74 HydrophobicContact CG1-CG2 4.3Å; V70-T74 WeakPolarHBondContact O-CB 3.41Å; V70-T74 VanDerWaalsContact O-CG2 3.25Å; V70-T74 WeakPolarHBondContact O-CG2 3.29Å; V70-T74 PolarHBondContact O-N 2.88Å; V70-T74 PolarHBondContact O-OG1 3.19Å; L71-T74 PolarHBondContact O-N 3.05Å; L71-T74 PolarHBondContact O-OG1 2.92Å; L71-T74 VanDerWaalsContact O-OG1 3.06Å; T74-T77 PolarHBondContact O-N 3.31Å; T74-F78 PolarHBondContact O-N 3.21Å
75	L	92.2	Very high	90.5	Very high	108 Å²	108	64.1 Å²	64.1	57%	0.565	35%	0.353	S	S	*	.	H	α-helix	trans	-63.4	-44	178.1	-64.9	176	0	0	0	110.9	L71 T77 F78 T79	L71-L75 WeakPolarHBondContact O-CB 3.48Å; L71-L75 VanDerWaalsContact O-CG 3.27Å; L71-L75 WeakPolarHBondContact O-CG 3.24Å; L71-L75 PolarHBondContact O-N 3.38Å; L75-T77 PolarHBondContact O-N 3.13Å; L75-F78 PolarHBondContact O-N 3.39Å; L75-T79 WeakPolarHBondContact O-CB 3.17Å; L75-T79 PolarHBondContact O-N 3.42Å; L75-T79 PolarHBondContact O-OG1 2.71Å
76	G	91.9	Very high	91.4	Very high	7 Å²	7	65.6 Å²	65.6	7%	0.072	36%	0.363	C	S	.	.	H	α-helix	trans	-60.7	-46	178.1	0	0	0	0	0	112.5	S72 F78 T79 V80 S116	S72-G76 VanDerWaalsContact O-CA 3.3Å; S72-G76 WeakPolarHBondContact O-CA 3.32Å; S72-G76 PolarHBondContact O-N 2.91Å; G76-F78 VanDerWaalsContact C-N 3.31Å; G76-F78 PolarHBondContact O-N 2.83Å; G76-T79 PolarHBondContact O-N 3.01Å; G76-V80 WeakPolarHBondContact O-CG2 3.49Å; G76-V80 PolarHBondContact O-N 2.92Å; G76-S116 VanDerWaalsContact CA-OG 3.31Å; G76-S116 WeakPolarHBondContact CA-OG 3.45Å; G76-S116 PolarHBondContact O-OG 3.05Å
77	T	91.1	Very high	92	Very high	71 Å²	71	62.5 Å²	62.5	44%	0.436	35%	0.347	S	S	.	.	H	α-helix	trans	-60.3	-43.3	176.2	-56.8	0	0	0	0	111.3	L73 T74 L75 V80 L81	L73-T77 VanDerWaalsContact O-CB 3.28Å; L73-T77 WeakPolarHBondContact O-CB 3.32Å; L73-T77 PolarHBondContact O-N 2.66Å; L73-T77 PolarHBondContact O-OG1 3.32Å; T74-T77 PolarHBondContact O-N 3.31Å; L75-T77 PolarHBondContact O-N 3.13Å; T77-V80 PolarHBondContact O-N 2.91Å; T77-L81 HydrophobicContact CG2-CD1 4.27Å; T77-L81 WeakPolarHBondContact O-CG 3.42Å; T77-L81 PolarHBondContact O-N 3.49Å
78	F	95.6	Very high	92.5	Very high	116 Å²	116	64.1 Å²	64.1	51%	0.509	36%	0.355	S	S	.	.	H	α-helix	trans	-63	-46.3	177.4	-170.5	-104.1	0	0	0	111.8	T74 L75 G76 V80 L81 E82	T74-F78 PolarHBondContact O-N 3.21Å; L75-F78 PolarHBondContact O-N 3.39Å; G76-F78 VanDerWaalsContact C-N 3.31Å; G76-F78 PolarHBondContact O-N 2.83Å; F78-V80 VanDerWaalsContact C-N 3.3Å; F78-V80 PolarHBondContact O-N 3.41Å; F78-L81 PolarHBondContact O-N 2.89Å; F78-L81 VanDerWaalsContact O-N 3.16Å; F78-E82 HydrophobicContact CD1-CG 4.14Å; F78-E82 HydrophobicContact CE1-CG 3.83Å; F78-E82 WeakPolarHBondContact CE1-OE1 3.17Å; F78-E82 VanDerWaalsContact CE1-OE2 3.29Å; F78-E82 WeakPolarHBondContact CE1-OE2 3.36Å; F78-E82 HydrophobicContact CE2-CG 4.45Å; F78-E82 HydrophobicContact CZ-CG 3.97Å; F78-E82 WeakPolarHBondContact CZ-OE1 3.33Å; F78-E82 WeakPolarHBondContact O-CG 3.34Å; F78-E82 PolarHBondContact O-N 3.3Å
79	T	95	Very high	93.1	Very high	47 Å²	47	67.3 Å²	67.3	29%	0.288	38%	0.375	S	S	.	.	H	α-helix	trans	-57.2	-41.9	175.2	-60	0	0	0	0	112.1	L75 G76 N83	L75-T79 WeakPolarHBondContact O-CB 3.17Å; L75-T79 PolarHBondContact O-N 3.42Å; L75-T79 PolarHBondContact O-OG1 2.71Å; G76-T79 PolarHBondContact O-N 3.01Å; T79-N83 WeakPolarHBondContact CG2-ND2 3.3Å; T79-N83 WeakPolarHBondContact O-CB 3.33Å; T79-N83 PolarHBondContact O-N 3.15Å; T79-N83 PolarHBondContact O-ND2 3.18Å
80	V	95	Very high	93.7	Very high	29 Å²	29	67 Å²	67	18%	0.176	37%	0.37	C	S	.	.	H	α-helix	trans	-63	-47.4	176.2	169.6	0	0	0	0	110.9	G76 T77 F78 N83 L84 V117	G76-V80 WeakPolarHBondContact O-CG2 3.49Å; G76-V80 PolarHBondContact O-N 2.92Å; T77-V80 PolarHBondContact O-N 2.91Å; F78-V80 VanDerWaalsContact C-N 3.3Å; F78-V80 PolarHBondContact O-N 3.41Å; V80-N83 PolarHBondContact O-N 3.28Å; V80-L84 HydrophobicContact CG1-CD1 3.71Å; V80-L84 HydrophobicContact CG1-CG 4.26Å; V80-L84 VanDerWaalsContact O-CB 3.23Å; V80-L84 WeakPolarHBondContact O-CB 3.43Å; V80-L84 VanDerWaalsContact O-CG 3.23Å; V80-L84 WeakPolarHBondContact O-CG 3.22Å; V80-L84 PolarHBondContact O-N 3.39Å; V80-V117 HydrophobicContact CG2-CG2 3.78Å
81	L	96.2	Very high	93.9	Very high	108 Å²	108	67.6 Å²	67.6	57%	0.565	37%	0.37	S	S	*	.	H	α-helix	trans	-62.4	-44.9	-179.5	-69.6	173.5	0	0	0	112.2	T77 F78 L85	T77-L81 HydrophobicContact CG2-CD1 4.27Å; T77-L81 WeakPolarHBondContact O-CG 3.42Å; T77-L81 PolarHBondContact O-N 3.49Å; F78-L81 PolarHBondContact O-N 2.89Å; F78-L81 VanDerWaalsContact O-N 3.16Å; L81-L85 WeakPolarHBondContact O-CB 3.37Å; L81-L85 PolarHBondContact O-N 3.25Å
82	E	97.1	Very high	94.2	Very high	97 Å²	97	71.7 Å²	71.7	45%	0.453	39%	0.387	S	S	.	.	H	α-helix	trans	-64	-47.3	178.7	-71.2	-171.4	134	0	0	112	F78 L85 V86	F78-E82 HydrophobicContact CD1-CG 4.14Å; F78-E82 HydrophobicContact CE1-CG 3.83Å; F78-E82 WeakPolarHBondContact CE1-OE1 3.17Å; F78-E82 VanDerWaalsContact CE1-OE2 3.29Å; F78-E82 WeakPolarHBondContact CE1-OE2 3.36Å; F78-E82 HydrophobicContact CE2-CG 4.45Å; F78-E82 HydrophobicContact CZ-CG 3.97Å; F78-E82 WeakPolarHBondContact CZ-OE1 3.33Å; F78-E82 WeakPolarHBondContact O-CG 3.34Å; F78-E82 PolarHBondContact O-N 3.3Å; E82-L85 WeakPolarHBondContact O-CB 3.49Å; E82-L85 PolarHBondContact O-N 3.41Å; E82-V86 WeakPolarHBondContact O-CG2 3.46Å; E82-V86 PolarHBondContact O-N 2.86Å
83	N	96.9	Very high	94.6	Very high	22 Å²	22	72.8 Å²	72.8	12%	0.118	39%	0.394	C	S	.	.	H	α-helix	trans	-69.9	-34.4	-179.4	-77.8	-68.2	0	0	0	112.5	T79 V80 V86 L87 A109 L113	T79-N83 WeakPolarHBondContact CG2-ND2 3.3Å; T79-N83 WeakPolarHBondContact O-CB 3.33Å; T79-N83 PolarHBondContact O-N 3.15Å; T79-N83 PolarHBondContact O-ND2 3.18Å; V80-N83 PolarHBondContact O-N 3.28Å; N83-V86 PolarHBondContact O-N 3.46Å; N83-L87 WeakPolarHBondContact O-CB 3.47Å; N83-L87 PolarHBondContact O-N 2.77Å; N83-A109 HydrophobicContact CB-CB 4.34Å; N83-A109 WeakPolarHBondContact OD1-CA 3.35Å; N83-L113 HydrophobicContact CB-CB 4.35Å
84	L	96.9	Very high	94.6	Very high	72 Å²	72	78.2 Å²	78.2	38%	0.377	41%	0.408	S	S	.	.	H	α-helix	trans	-60.5	-46.2	169.7	-82.1	173.8	0	0	0	111.4	V80 V86 L87 C88 L113	V80-L84 HydrophobicContact CG1-CD1 3.71Å; V80-L84 HydrophobicContact CG1-CG 4.26Å; V80-L84 VanDerWaalsContact O-CB 3.23Å; V80-L84 WeakPolarHBondContact O-CB 3.43Å; V80-L84 VanDerWaalsContact O-CG 3.23Å; V80-L84 WeakPolarHBondContact O-CG 3.22Å; V80-L84 PolarHBondContact O-N 3.39Å; L84-V86 PolarHBondContact O-N 3.37Å; L84-L87 PolarHBondContact O-N 2.85Å; L84-C88 WeakPolarHBondContact O-CB 3.42Å; L84-C88 PolarHBondContact O-N 3.24Å; L84-C88 PolarHBondContact O-SG 3.14Å; L84-L113 HydrophobicContact CD2-CD1 3.4Å; L84-L113 HydrophobicContact CG-CD1 3.58Å
85	L	97.1	Very high	94.5	Very high	115 Å²	115	78.1 Å²	78.1	60%	0.602	41%	0.411	S	S	*	.	H	α-helix	trans	-60.4	-47.4	178	178.2	64.7	0	0	0	111.2	L81 E82 L87 C88 V89	L81-L85 WeakPolarHBondContact O-CB 3.37Å; L81-L85 PolarHBondContact O-N 3.25Å; E82-L85 WeakPolarHBondContact O-CB 3.49Å; E82-L85 PolarHBondContact O-N 3.41Å; L85-L87 VanDerWaalsContact C-N 3.33Å; L85-L87 PolarHBondContact O-N 2.86Å; L85-C88 PolarHBondContact O-N 2.95Å; L85-V89 HydrophobicContact CD1-CG2 4.39Å; L85-V89 WeakPolarHBondContact O-CG2 3.48Å; L85-V89 PolarHBondContact O-N 3.47Å
86	V	96.5	Very high	94.3	Very high	58 Å²	58	74.5 Å²	74.5	35%	0.352	39%	0.392	S	S	.	.	H	α-helix	trans	-57.2	-47.7	176.7	170.9	0	0	0	0	110.7	E82 N83 L84 V89 I90 I105 A109	E82-V86 WeakPolarHBondContact O-CG2 3.46Å; E82-V86 PolarHBondContact O-N 2.86Å; N83-V86 PolarHBondContact O-N 3.46Å; L84-V86 PolarHBondContact O-N 3.37Å; V86-V89 PolarHBondContact O-N 3.42Å; V86-I90 HydrophobicContact CG1-CD1 3.83Å; V86-I90 VanDerWaalsContact O-CG1 3.32Å; V86-I90 WeakPolarHBondContact O-CG1 3.37Å; V86-I90 PolarHBondContact O-N 3.49Å; V86-I105 HydrophobicContact CG1-CG2 4.32Å; V86-A109 HydrophobicContact CG1-CB 4.15Å
87	L	95.9	Very high	94.2	Very high	37 Å²	37	79.4 Å²	79.4	19%	0.194	41%	0.408	C	S	.	.	H	α-helix	trans	-63.1	-44.9	179.6	-171.9	62.5	0	0	0	111.4	N83 L84 L85 V89 I90 L91 V110	N83-L87 WeakPolarHBondContact O-CB 3.47Å; N83-L87 PolarHBondContact O-N 2.77Å; L84-L87 PolarHBondContact O-N 2.85Å; L85-L87 VanDerWaalsContact C-N 3.33Å; L85-L87 PolarHBondContact O-N 2.86Å; L87-V89 PolarHBondContact O-N 3.35Å; L87-I90 PolarHBondContact O-N 3.32Å; L87-L91 HydrophobicContact CD1-CD1 4.12Å; L87-L91 HydrophobicContact CD1-CG 4.18Å; L87-L91 HydrophobicContact CD2-CD1 4.45Å; L87-L91 HydrophobicContact CG-CD1 3.83Å; L87-L91 HydrophobicContact CG-CG 4.28Å; L87-L91 WeakPolarHBondContact O-CB 3.33Å; L87-L91 VanDerWaalsContact O-CG 3.26Å; L87-L91 WeakPolarHBondContact O-CG 3.37Å; L87-L91 PolarHBondContact O-N 2.91Å; L87-V110 HydrophobicContact CD1-CG2 4.08Å; L87-V110 HydrophobicContact CD2-CG2 4Å
88	C	96.1	Very high	94.1	Very high	77 Å²	77	78.9 Å²	78.9	52%	0.52	41%	0.407	S	S	.	.	H	α-helix	trans	-57.2	-45.4	175.5	-78	0	0	0	0	112	L84 L85 L91 H92	L84-C88 WeakPolarHBondContact O-CB 3.42Å; L84-C88 PolarHBondContact O-N 3.24Å; L84-C88 PolarHBondContact O-SG 3.14Å; L85-C88 PolarHBondContact O-N 2.95Å; C88-L91 PolarHBondContact O-N 3.19Å; C88-H92 WeakPolarHBondContact O-CB 3.35Å; C88-H92 PolarHBondContact O-N 2.92Å
89	V	96.6	Very high	93.8	Very high	76 Å²	76	80.2 Å²	80.2	46%	0.461	41%	0.409	S	S	.	.	H	α-helix	trans	-63.6	-43.8	178.5	170.6	0	0	0	0	111.6	L85 V86 L87 S93 L96	L85-V89 HydrophobicContact CD1-CG2 4.39Å; L85-V89 WeakPolarHBondContact O-CG2 3.48Å; L85-V89 PolarHBondContact O-N 3.47Å; V86-V89 PolarHBondContact O-N 3.42Å; L87-V89 PolarHBondContact O-N 3.35Å; V89-S93 WeakPolarHBondContact O-CB 3.44Å; V89-S93 PolarHBondContact O-N 2.88Å; V89-L96 HydrophobicContact CG1-CD1 3.95Å
90	I	94.7	Very high	93.5	Very high	14 Å²	14	79 Å²	79	7%	0.072	40%	0.402	C	S	.	.	H	α-helix	trans	-65.7	-43.3	178.5	-67.2	171	0	0	0	111	V86 L87 Y102 I105	V86-I90 HydrophobicContact CG1-CD1 3.83Å; V86-I90 VanDerWaalsContact O-CG1 3.32Å; V86-I90 WeakPolarHBondContact O-CG1 3.37Å; V86-I90 PolarHBondContact O-N 3.49Å; L87-I90 PolarHBondContact O-N 3.32Å; I90-Y102 HydrophobicContact CD1-CD1 4.38Å; I90-Y102 HydrophobicContact CG1-CD1 4.17Å; I90-I105 HydrophobicContact CD1-CB 4.38Å; I90-I105 HydrophobicContact CD1-CG2 4Å
91	L	92.3	Very high	93.2	Very high	95 Å²	95	78.3 Å²	78.3	50%	0.497	40%	0.398	S	S	.	.	H	α-helix	trans	-71.5	-35.5	179.6	-69.1	178.7	0	0	0	111.7	L87 C88 R97	L87-L91 HydrophobicContact CD1-CD1 4.12Å; L87-L91 HydrophobicContact CD1-CG 4.18Å; L87-L91 HydrophobicContact CD2-CD1 4.45Å; L87-L91 HydrophobicContact CG-CD1 3.83Å; L87-L91 HydrophobicContact CG-CG 4.28Å; L87-L91 WeakPolarHBondContact O-CB 3.33Å; L87-L91 VanDerWaalsContact O-CG 3.26Å; L87-L91 WeakPolarHBondContact O-CG 3.37Å; L87-L91 PolarHBondContact O-N 2.91Å; C88-L91 PolarHBondContact O-N 3.19Å; L91-R97 VanDerWaalsContact O-CZ 3.32Å; L91-R97 PolarHBondContact O-NE 2.88Å; L91-R97 PolarHBondContact O-NH2 3.25Å
92	H	94.4	Very high	93.1	Very high	173 Å²	173	76.5 Å²	76.5	80%	0.801	38%	0.384	S	S	*	.	H	α-helix	trans	-74.5	-38.8	179.1	-167.3	74.2	0	0	0	112	C88 R94	C88-H92 WeakPolarHBondContact O-CB 3.35Å; C88-H92 PolarHBondContact O-N 2.92Å; H92-R94 PolarHBondContact O-N 3.26Å
93	S	94.5	Very high	92.9	Very high	40 Å²	40	73.9 Å²	73.9	28%	0.28	37%	0.372	S	S	.	.			trans	-84.1	108	-176.2	-173.7	0	0	0	0	113.3	V89 S95 L96 R97	V89-S93 WeakPolarHBondContact O-CB 3.44Å; V89-S93 PolarHBondContact O-N 2.88Å; S93-S95 PolarHBondContact O-N 2.96Å; S93-L96 PolarHBondContact O-N 3.39Å; S93-R97 PolarHBondContact O-N 3.47Å
94	R	89.4	Confident	92.7	Very high	203 Å²	203	73.4 Å²	73.4	77%	0.766	37%	0.369	S	S	*	.	H	α-helix	trans	-57.1	-36.2	173.2	-172.8	178.2	-179.4	-175.9	1.1	112.3	H92 L96 R97 C98	H92-R94 PolarHBondContact O-N 3.26Å; R94-L96 VanDerWaalsContact C-N 3.34Å; R94-L96 PolarHBondContact O-N 2.95Å; R94-R97 PolarHBondContact O-N 3.28Å; R94-C98 PolarHBondContact O-N 3.35Å; R94-C98 VanDerWaalsContact O-N 3.11Å; R94-C98 PolarHBondContact O-SG 3.38Å
95	S	89.2	Confident	92.6	Very high	75 Å²	75	72.5 Å²	72.5	52%	0.524	36%	0.364	S	S	.	.	H	α-helix	trans	-61.7	-41.4	179	-176.5	0	0	0	0	112	S93	S93-S95 PolarHBondContact O-N 2.96Å
96	L	88.6	Confident	92.5	Very high	33 Å²	33	67.4 Å²	67.4	17%	0.173	34%	0.339	C	S	.	.	H	α-helix	trans	-72.1	-45.9	177.5	-58.6	-175.1	0	0	0	111.2	V89 S93 R94 C98 R99 Y102	V89-L96 HydrophobicContact CG1-CD1 3.95Å; S93-L96 PolarHBondContact O-N 3.39Å; R94-L96 VanDerWaalsContact C-N 3.34Å; R94-L96 PolarHBondContact O-N 2.95Å; L96-C98 PolarHBondContact O-N 3.43Å; L96-C98 VanDerWaalsContact O-N 3.17Å; L96-R99 WeakPolarHBondContact O-CB 3.29Å; L96-R99 PolarHBondContact O-N 3.2Å; L96-Y102 HydrophobicContact CB-CD1 4.13Å; L96-Y102 HydrophobicContact CB-CE1 4.37Å; L96-Y102 HydrophobicContact CB-CG 4.2Å; L96-Y102 HydrophobicContact CD1-CD1 4.46Å; L96-Y102 HydrophobicContact CD1-CE1 4.17Å; L96-Y102 HydrophobicContact CD2-CD1 4.38Å; L96-Y102 HydrophobicContact CD2-CE1 3.78Å; L96-Y102 HydrophobicContact CD2-CE2 3.96Å; L96-Y102 HydrophobicContact CG-CE1 4.32Å
97	R	89.3	Confident	92.5	Very high	109 Å²	109	65 Å²	65	41%	0.411	33%	0.325	S	S	.	.	H	α-helix	trans	-62.9	-23.5	-178.7	-150.8	-168.2	-48.6	158.4	9.4	114.2	L91 S93 R94 R99 H103 R179	L91-R97 VanDerWaalsContact O-CZ 3.32Å; L91-R97 PolarHBondContact O-NE 2.88Å; L91-R97 PolarHBondContact O-NH2 3.25Å; S93-R97 PolarHBondContact O-N 3.47Å; R94-R97 PolarHBondContact O-N 3.28Å; R97-R99 VanDerWaalsContact C-N 3.28Å; R97-H103 PolarHBondContact O-NE2 3.05Å; R97-R179 PolarHBondContact O-NE 3.4Å; R97-R179 PolarHBondContact O-NH2 3.14Å
98	C	87.9	Confident	92.5	Very high	61 Å²	61	64.8 Å²	64.8	41%	0.412	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-15.9	174.8	-75.4	0	0	0	0	113.2	R94 L96 R179	R94-C98 PolarHBondContact O-N 3.35Å; R94-C98 VanDerWaalsContact O-N 3.11Å; R94-C98 PolarHBondContact O-SG 3.38Å; L96-C98 PolarHBondContact O-N 3.43Å; L96-C98 VanDerWaalsContact O-N 3.17Å; C98-R179 VanDerWaalsContact O-CD 3.26Å; C98-R179 WeakPolarHBondContact O-CD 3.35Å
99	R	89.5	Confident	92.5	Very high	143 Å²	143	61.3 Å²	61.3	54%	0.54	30%	0.3	S	S	.	.	S	Bend	trans	-94.1	125.1	-177.4	-69.2	-174.6	-176.9	-166.9	2.6	110.8	L96 R97 S101 Y102	L96-R99 WeakPolarHBondContact O-CB 3.29Å; L96-R99 PolarHBondContact O-N 3.2Å; R97-R99 VanDerWaalsContact C-N 3.28Å; R99-S101 VanDerWaalsContact C-N 3.32Å; R99-S101 PolarHBondContact O-N 3.37Å; R99-Y102 HydrophobicContact CB-CD2 3.67Å; R99-Y102 HydrophobicContact CB-CE2 4.24Å; R99-Y102 PolarHBondContact O-N 2.97Å
100	P	88.9	Confident	92.6	Very high	22 Å²	22	60 Å²	60	14%	0.143	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-42.6	-177.8	-28.1	34.8	0	0	0	114.6	Y102 H103 V177 R179 A182	P100-Y102 PolarHBondContact O-N 2.59Å; P100-H103 WeakPolarHBondContact O-CB 3.24Å; P100-H103 PolarHBondContact O-N 3.32Å; P100-V177 HydrophobicContact CB-CG1 3.71Å; P100-V177 HydrophobicContact CG-CG1 4.26Å; P100-R179 HydrophobicContact CG-CG 3.98Å; P100-A182 HydrophobicContact CB-CB 3.95Å
101	S	90.3	Very high	92.6	Very high	15 Å²	15	59.3 Å²	59.3	11%	0.105	29%	0.289	C	S	.	.	H	α-helix	trans	-59.6	-30.1	-177.4	-44.5	0	0	0	0	113.9	R99 H103 F104 I105 D162 Y173	R99-S101 VanDerWaalsContact C-N 3.32Å; R99-S101 PolarHBondContact O-N 3.37Å; S101-H103 PolarHBondContact O-N 3.43Å; S101-F104 PolarHBondContact O-N 3.17Å; S101-I105 PolarHBondContact O-N 2.93Å; S101-D162 VanDerWaalsContact CB-OD2 3.26Å; S101-D162 WeakPolarHBondContact CB-OD2 3.4Å; S101-D162 VanDerWaalsContact OG-CG 3.29Å; S101-D162 PolarHBondContact OG-OD1 3.33Å; S101-D162 PolarHBondContact OG-OD2 2.84Å; S101-Y173 PolarHBondContact OG-OH 3.16Å; S101-Y173 VanDerWaalsContact OG-OH 3.1Å
102	Y	92.9	Very high	92.8	Very high	69 Å²	69	57.1 Å²	57.1	27%	0.271	28%	0.278	S	S	.	.	H	α-helix	trans	-73.6	-16.6	179.5	-76.5	-90.8	0	0	0	112.7	I90 L96 R99 P100 I105 G106	I90-Y102 HydrophobicContact CD1-CD1 4.38Å; I90-Y102 HydrophobicContact CG1-CD1 4.17Å; L96-Y102 HydrophobicContact CB-CD1 4.13Å; L96-Y102 HydrophobicContact CB-CE1 4.37Å; L96-Y102 HydrophobicContact CB-CG 4.2Å; L96-Y102 HydrophobicContact CD1-CD1 4.46Å; L96-Y102 HydrophobicContact CD1-CE1 4.17Å; L96-Y102 HydrophobicContact CD2-CD1 4.38Å; L96-Y102 HydrophobicContact CD2-CE1 3.78Å; L96-Y102 HydrophobicContact CD2-CE2 3.96Å; L96-Y102 HydrophobicContact CG-CE1 4.32Å; R99-Y102 HydrophobicContact CB-CD2 3.67Å; R99-Y102 HydrophobicContact CB-CE2 4.24Å; R99-Y102 PolarHBondContact O-N 2.97Å; P100-Y102 PolarHBondContact O-N 2.59Å; Y102-I105 HydrophobicContact CD1-CD1 4.27Å; Y102-I105 HydrophobicContact CE1-CD1 4.46Å; Y102-G106 PolarHBondContact O-N 3.29Å
103	H	92.3	Very high	92.9	Very high	42 Å²	42	50.3 Å²	50.3	19%	0.194	25%	0.247	C	C	.	.	H	α-helix	trans	-69.7	-34.8	169.8	-70.5	-78.6	0	0	0	111.7	R97 P100 S101 S107 F186	R97-H103 PolarHBondContact O-NE2 3.05Å; P100-H103 WeakPolarHBondContact O-CB 3.24Å; P100-H103 PolarHBondContact O-N 3.32Å; S101-H103 PolarHBondContact O-N 3.43Å; H103-S107 VanDerWaalsContact O-CB 3.24Å; H103-S107 WeakPolarHBondContact O-CB 3.38Å; H103-S107 PolarHBondContact O-N 2.81Å; H103-F186 HydrophobicContact CB-CD1 4.31Å; H103-F186 HydrophobicContact CB-CE1 4.45Å
104	F	94	Very high	92.9	Very high	12 Å²	12	51.9 Å²	51.9	5%	0.053	25%	0.252	C	S	.	.	H	α-helix	trans	-70.6	-39.5	174.9	-53.4	-47.2	0	0	0	111.7	S101 S107 L108 L158 T159 D162 A182 F186	S101-F104 PolarHBondContact O-N 3.17Å; F104-S107 WeakPolarHBondContact O-CB 3.37Å; F104-S107 PolarHBondContact O-N 3.34Å; F104-L108 PolarHBondContact O-N 3.03Å; F104-L158 HydrophobicContact CD1-CB 3.76Å; F104-L158 HydrophobicContact CD1-CD1 3.91Å; F104-L158 HydrophobicContact CD1-CG 4.44Å; F104-L158 HydrophobicContact CE1-CB 4Å; F104-L158 HydrophobicContact CE1-CD1 3.94Å; F104-L158 HydrophobicContact CE1-CG 4.42Å; F104-L158 HydrophobicContact CG-CB 4.06Å; F104-L158 HydrophobicContact CZ-CB 4.49Å; F104-T159 WeakPolarHBondContact CB-OG1 3.24Å; F104-D162 HydrophobicContact CD2-CB 4.13Å; F104-D162 HydrophobicContact CE2-CB 3.98Å; F104-A182 HydrophobicContact CE1-CB 4.09Å; F104-A182 HydrophobicContact CE2-CB 4.41Å; F104-A182 HydrophobicContact CZ-CB 3.7Å; F104-F186 HydrophobicContact CD1-CB 4.39Å; F104-F186 HydrophobicContact CE1-CB 4.49Å
105	I	94.5	Very high	93	Very high	53 Å²	53	42.5 Å²	42.5	27%	0.272	22%	0.219	S	C	.	.	H	α-helix	trans	-66	-42	174.3	-59.4	172.4	0	0	0	110.8	V86 I90 S101 Y102 S107 L108 A109	V86-I105 HydrophobicContact CG1-CG2 4.32Å; I90-I105 HydrophobicContact CD1-CB 4.38Å; I90-I105 HydrophobicContact CD1-CG2 4Å; S101-I105 PolarHBondContact O-N 2.93Å; Y102-I105 HydrophobicContact CD1-CD1 4.27Å; Y102-I105 HydrophobicContact CE1-CD1 4.46Å; I105-S107 VanDerWaalsContact C-N 3.34Å; I105-L108 WeakPolarHBondContact O-CB 3.42Å; I105-L108 PolarHBondContact O-N 2.94Å; I105-A109 PolarHBondContact O-N 3.33Å
106	G	95.5	Very high	93.2	Very high	8 Å²	8	39.7 Å²	39.7	8%	0.082	20%	0.199	C	C	.	.	H	α-helix	trans	-64.2	-39.1	174.4	0	0	0	0	0	112.5	Y102 A109 V110	Y102-G106 PolarHBondContact O-N 3.29Å; G106-A109 PolarHBondContact O-N 3.46Å; G106-V110 WeakPolarHBondContact O-CG2 3.32Å; G106-V110 PolarHBondContact O-N 2.81Å
107	S	96.1	Very high	93.4	Very high	8 Å²	8	41.5 Å²	41.5	6%	0.056	21%	0.212	C	C	.	.	H	α-helix	trans	-59.7	-45.7	173.1	175.3	0	0	0	0	111.8	H103 F104 I105 V110 A111 S155 W190	H103-S107 VanDerWaalsContact O-CB 3.24Å; H103-S107 WeakPolarHBondContact O-CB 3.38Å; H103-S107 PolarHBondContact O-N 2.81Å; F104-S107 WeakPolarHBondContact O-CB 3.37Å; F104-S107 PolarHBondContact O-N 3.34Å; I105-S107 VanDerWaalsContact C-N 3.34Å; S107-V110 PolarHBondContact O-N 3.22Å; S107-A111 PolarHBondContact O-N 3.17Å; S107-S155 PolarHBondContact OG-OG 2.86Å; S107-W190 PolarHBondContact OG-NE1 3.25Å
108	L	95.5	Very high	93.4	Very high	33 Å²	33	38.6 Å²	38.6	17%	0.173	20%	0.204	C	C	.	.	H	α-helix	trans	-58.2	-49.5	174.3	-179.8	62.2	0	0	0	111.1	F104 I105 V110 A111 D112 S152 L156	F104-L108 PolarHBondContact O-N 3.03Å; I105-L108 WeakPolarHBondContact O-CB 3.42Å; I105-L108 PolarHBondContact O-N 2.94Å; L108-V110 VanDerWaalsContact C-N 3.29Å; L108-V110 PolarHBondContact O-N 3.1Å; L108-A111 WeakPolarHBondContact O-CB 3.42Å; L108-A111 PolarHBondContact O-N 3.08Å; L108-A111 VanDerWaalsContact O-N 3.1Å; L108-D112 PolarHBondContact O-N 2.88Å; L108-S152 WeakPolarHBondContact CD1-OG 3.35Å; L108-L156 HydrophobicContact CD1-CD2 4.39Å; L108-L156 HydrophobicContact CD1-CG 4.14Å; L108-L156 HydrophobicContact CD2-CD2 3.81Å; L108-L156 HydrophobicContact CD2-CG 4.44Å
109	A	97.1	Very high	93.3	Very high	3 Å²	3	39.7 Å²	39.7	3%	0.025	20%	0.201	C	C	.	.	H	α-helix	trans	-60.7	-36.7	179.9	0	0	0	0	0	113.1	N83 V86 I105 G106 L113	N83-A109 HydrophobicContact CB-CB 4.34Å; N83-A109 WeakPolarHBondContact OD1-CA 3.35Å; V86-A109 HydrophobicContact CG1-CB 4.15Å; I105-A109 PolarHBondContact O-N 3.33Å; G106-A109 PolarHBondContact O-N 3.46Å; A109-L113 VanDerWaalsContact O-CB 3.25Å; A109-L113 WeakPolarHBondContact O-CB 3.32Å; A109-L113 PolarHBondContact O-N 3.01Å
110	V	96.9	Very high	93.1	Very high	49 Å²	49	34 Å²	34	30%	0.297	18%	0.183	S	C	.	.	H	α-helix	trans	-68.9	-42.2	174.7	172.1	0	0	0	0	111.2	L87 G106 S107 L108 L113 L114 W190	L87-V110 HydrophobicContact CD1-CG2 4.08Å; L87-V110 HydrophobicContact CD2-CG2 4Å; G106-V110 WeakPolarHBondContact O-CG2 3.32Å; G106-V110 PolarHBondContact O-N 2.81Å; S107-V110 PolarHBondContact O-N 3.22Å; L108-V110 VanDerWaalsContact C-N 3.29Å; L108-V110 PolarHBondContact O-N 3.1Å; V110-L113 PolarHBondContact O-N 3.38Å; V110-L114 HydrophobicContact CG1-CD1 3.94Å; V110-L114 HydrophobicContact CG1-CG 4.35Å; V110-L114 WeakPolarHBondContact O-CB 3.31Å; V110-L114 WeakPolarHBondContact O-CG 3.48Å; V110-L114 PolarHBondContact O-N 3.42Å; V110-W190 HydrophobicContact CB-CZ2 4.28Å; V110-W190 HydrophobicContact CG1-CH2 3.94Å; V110-W190 HydrophobicContact CG1-CZ2 4Å
111	A	96.6	Very high	92.9	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-62.1	-45.2	177.4	0	0	0	0	0	111.6	S107 L108 L114 G115 A151 W190	S107-A111 PolarHBondContact O-N 3.17Å; L108-A111 WeakPolarHBondContact O-CB 3.42Å; L108-A111 PolarHBondContact O-N 3.08Å; L108-A111 VanDerWaalsContact O-N 3.1Å; A111-L114 PolarHBondContact O-N 3.04Å; A111-G115 PolarHBondContact O-N 3.44Å; A111-A151 HydrophobicContact CB-CB 4.01Å; A111-W190 HydrophobicContact CB-CH2 3.97Å; A111-W190 HydrophobicContact CB-CZ2 3.94Å
112	D	95.6	Very high	92.5	Very high	48 Å²	48	39.9 Å²	39.9	26%	0.257	21%	0.205	S	C	.	.	H	α-helix	trans	-68.4	-37.5	179.9	-63.6	-15.9	0	0	0	111.5	L108 S116 S152	L108-D112 PolarHBondContact O-N 2.88Å; D112-S116 WeakPolarHBondContact O-CB 3.25Å; D112-S116 PolarHBondContact O-N 3.37Å; D112-S152 WeakPolarHBondContact OD1-CB 3.43Å; D112-S152 PolarHBondContact OD1-OG 3.36Å
113	L	95.7	Very high	91.6	Very high	31 Å²	31	37.8 Å²	37.8	16%	0.162	20%	0.197	C	C	.	.	H	α-helix	trans	-63.5	-50.7	173.9	-174	160.4	0	0	0	111.5	N83 L84 A109 V110 S116 V117	N83-L113 HydrophobicContact CB-CB 4.35Å; L84-L113 HydrophobicContact CD2-CD1 3.4Å; L84-L113 HydrophobicContact CG-CD1 3.58Å; A109-L113 VanDerWaalsContact O-CB 3.25Å; A109-L113 WeakPolarHBondContact O-CB 3.32Å; A109-L113 PolarHBondContact O-N 3.01Å; V110-L113 PolarHBondContact O-N 3.38Å; L113-S116 PolarHBondContact O-N 3.32Å; L113-V117 HydrophobicContact CD2-CG2 4.12Å; L113-V117 WeakPolarHBondContact O-CG2 3.39Å; L113-V117 PolarHBondContact O-N 3.44Å
114	L	94.9	Very high	90.9	Very high	72 Å²	72	37.8 Å²	37.8	38%	0.377	20%	0.199	S	C	.	.	H	α-helix	trans	-61.6	-46.6	178.6	-72.8	176	0	0	0	110.9	V110 A111 S116 V117 I118 W190	V110-L114 HydrophobicContact CG1-CD1 3.94Å; V110-L114 HydrophobicContact CG1-CG 4.35Å; V110-L114 WeakPolarHBondContact O-CB 3.31Å; V110-L114 WeakPolarHBondContact O-CG 3.48Å; V110-L114 PolarHBondContact O-N 3.42Å; A111-L114 PolarHBondContact O-N 3.04Å; L114-S116 VanDerWaalsContact C-N 3.34Å; L114-S116 PolarHBondContact O-N 3.38Å; L114-V117 PolarHBondContact O-N 3.42Å; L114-I118 HydrophobicContact CB-CD1 4.5Å; L114-I118 WeakPolarHBondContact O-CB 3.04Å; L114-I118 WeakPolarHBondContact O-CD1 3.49Å; L114-I118 WeakPolarHBondContact O-CG1 3.45Å; L114-I118 PolarHBondContact O-N 2.99Å; L114-W190 HydrophobicContact CD1-CH2 3.95Å; L114-W190 HydrophobicContact CD1-CZ3 4.11Å
115	G	92.4	Very high	90.1	Very high	7 Å²	7	37.7 Å²	37.7	7%	0.072	20%	0.2	C	C	.	.	H	α-helix	trans	-58.4	-46.4	177.6	0	0	0	0	0	111.8	A111 F119 S148	A111-G115 PolarHBondContact O-N 3.44Å; G115-F119 WeakPolarHBondContact O-CB 3.45Å; G115-F119 PolarHBondContact O-N 3.46Å; G115-S148 PolarHBondContact N-OG 3.04Å
116	S	92.6	Very high	88.9	Confident	15 Å²	15	37.2 Å²	37.2	11%	0.105	20%	0.196	C	C	.	.	H	α-helix	trans	-64.7	-46.5	179.2	-171.2	0	0	0	0	112.5	G76 D112 L113 L114 F119 V120	G76-S116 VanDerWaalsContact CA-OG 3.31Å; G76-S116 WeakPolarHBondContact CA-OG 3.45Å; G76-S116 PolarHBondContact O-OG 3.05Å; D112-S116 WeakPolarHBondContact O-CB 3.25Å; D112-S116 PolarHBondContact O-N 3.37Å; L113-S116 PolarHBondContact O-N 3.32Å; L114-S116 VanDerWaalsContact C-N 3.34Å; L114-S116 PolarHBondContact O-N 3.38Å; S116-F119 PolarHBondContact O-N 3.5Å; S116-V120 WeakPolarHBondContact O-CB 3.47Å; S116-V120 VanDerWaalsContact O-CG2 3.25Å; S116-V120 WeakPolarHBondContact O-CG2 3.48Å; S116-V120 PolarHBondContact O-N 3.18Å
117	V	92.3	Very high	87.5	Confident	72 Å²	72	38.1 Å²	38.1	44%	0.436	20%	0.198	S	C	.	.	H	α-helix	trans	-63.9	-46.6	178.6	172.1	0	0	0	0	111.4	V80 L113 L114 F119 Y121	V80-V117 HydrophobicContact CG2-CG2 3.78Å; L113-V117 HydrophobicContact CD2-CG2 4.12Å; L113-V117 WeakPolarHBondContact O-CG2 3.39Å; L113-V117 PolarHBondContact O-N 3.44Å; L114-V117 PolarHBondContact O-N 3.42Å; V117-F119 VanDerWaalsContact C-N 3.34Å; V117-Y121 VanDerWaalsContact O-CB 3.23Å; V117-Y121 WeakPolarHBondContact O-CB 3.42Å; V117-Y121 PolarHBondContact O-N 3.41Å
118	I	90.8	Very high	86.1	Confident	48 Å²	48	41.6 Å²	41.6	25%	0.246	22%	0.218	C	C	.	.	H	α-helix	trans	-63.4	-43.9	179	-65.6	166.4	0	0	0	110	L114 Y121 S122 V145	L114-I118 HydrophobicContact CB-CD1 4.5Å; L114-I118 WeakPolarHBondContact O-CB 3.04Å; L114-I118 WeakPolarHBondContact O-CD1 3.49Å; L114-I118 WeakPolarHBondContact O-CG1 3.45Å; L114-I118 PolarHBondContact O-N 2.99Å; I118-Y121 PolarHBondContact O-N 2.93Å; I118-S122 VanDerWaalsContact O-CB 3.23Å; I118-S122 WeakPolarHBondContact O-CB 3.47Å; I118-S122 PolarHBondContact O-N 3.31Å; I118-V145 HydrophobicContact CG2-CG2 3.78Å
119	F	84.4	Confident	85	Confident	83 Å²	83	46.6 Å²	46.6	36%	0.364	24%	0.239	S	C	.	.	H	α-helix	trans	-63.3	-51.3	179.5	-177.9	-96.8	0	0	0	111.6	G115 S116 V117 Y121 S122 F123	G115-F119 WeakPolarHBondContact O-CB 3.45Å; G115-F119 PolarHBondContact O-N 3.46Å; S116-F119 PolarHBondContact O-N 3.5Å; V117-F119 VanDerWaalsContact C-N 3.34Å; F119-Y121 VanDerWaalsContact C-N 3.33Å; F119-Y121 PolarHBondContact O-N 2.75Å; F119-S122 PolarHBondContact O-N 2.85Å; F119-F123 HydrophobicContact CZ-CD2 4.49Å; F119-F123 WeakPolarHBondContact O-CB 3.48Å; F119-F123 PolarHBondContact O-N 2.87Å
120	V	85.6	Confident	83.6	Confident	25 Å²	25	52 Å²	52	15%	0.152	26%	0.264	C	S	.	.	H	α-helix	trans	-60	-44.2	178	172.4	0	0	0	0	110.8	L73 S116 F123 V124	L73-V120 HydrophobicContact CD1-CG1 3.98Å; S116-V120 WeakPolarHBondContact O-CB 3.47Å; S116-V120 VanDerWaalsContact O-CG2 3.25Å; S116-V120 WeakPolarHBondContact O-CG2 3.48Å; S116-V120 PolarHBondContact O-N 3.18Å; V120-F123 PolarHBondContact O-N 2.94Å; V120-V124 HydrophobicContact CG1-CG2 4.36Å; V120-V124 WeakPolarHBondContact O-CB 3.37Å; V120-V124 VanDerWaalsContact O-CG2 3.28Å; V120-V124 WeakPolarHBondContact O-CG2 3.39Å; V120-V124 PolarHBondContact O-N 3.49Å
121	Y	85.8	Confident	82.2	Confident	136 Å²	136	56.9 Å²	56.9	53%	0.533	28%	0.277	S	S	.	.	H	α-helix	trans	-62.1	-50.8	177.7	175.9	-101.2	0	0	0	112	V117 I118 F119 F123 V124 D125	V117-Y121 VanDerWaalsContact O-CB 3.23Å; V117-Y121 WeakPolarHBondContact O-CB 3.42Å; V117-Y121 PolarHBondContact O-N 3.41Å; I118-Y121 PolarHBondContact O-N 2.93Å; F119-Y121 VanDerWaalsContact C-N 3.33Å; F119-Y121 PolarHBondContact O-N 2.75Å; Y121-F123 PolarHBondContact O-N 3.24Å; Y121-V124 PolarHBondContact O-N 2.79Å; Y121-D125 VanDerWaalsContact O-CB 3.31Å; Y121-D125 WeakPolarHBondContact O-CB 3.38Å; Y121-D125 PolarHBondContact O-N 2.96Å
122	S	80.8	Confident	80.9	Confident	24 Å²	24	64.4 Å²	64.4	17%	0.168	31%	0.309	C	S	.	.	H	α-helix	trans	-59.4	-39.3	178.8	-170.5	0	0	0	0	111.3	I118 F119 F126	I118-S122 VanDerWaalsContact O-CB 3.23Å; I118-S122 WeakPolarHBondContact O-CB 3.47Å; I118-S122 PolarHBondContact O-N 3.31Å; F119-S122 PolarHBondContact O-N 2.85Å; S122-F126 VanDerWaalsContact O-CB 3.25Å; S122-F126 WeakPolarHBondContact O-CB 3.34Å; S122-F126 PolarHBondContact O-N 3.4Å
123	F	75.4	Confident	79.9	Confident	24 Å²	24	63.4 Å²	63.4	11%	0.105	30%	0.304	C	S	.	.	H	α-helix	trans	-67.5	-47	179.5	-168.6	-79.8	0	0	0	111.8	I68 A69 F119 V120 Y121 F126 H127	I68-F123 HydrophobicContact CB-CE2 4.36Å; I68-F123 HydrophobicContact CB-CZ 3.96Å; I68-F123 HydrophobicContact CG2-CD2 4.5Å; I68-F123 HydrophobicContact CG2-CE2 3.41Å; I68-F123 VanDerWaalsContact CG2-CE2 3.41Å; I68-F123 HydrophobicContact CG2-CZ 3.45Å; I68-F123 VanDerWaalsContact CG2-CZ 3.45Å; A69-F123 HydrophobicContact CB-CE1 3.64Å; A69-F123 HydrophobicContact CB-CZ 4.36Å; F119-F123 HydrophobicContact CZ-CD2 4.49Å; F119-F123 WeakPolarHBondContact O-CB 3.48Å; F119-F123 PolarHBondContact O-N 2.87Å; V120-F123 PolarHBondContact O-N 2.94Å; Y121-F123 PolarHBondContact O-N 3.24Å; F123-F126 PolarHBondContact O-N 3.36Å; F123-H127 HydrophobicContact CD1-CB 4.32Å; F123-H127 AromaticContact CD1-CD2 3.92Å; F123-H127 AromaticContact CD2-CD2 3.56Å; F123-H127 HydrophobicContact CE1-CB 3.88Å; F123-H127 AromaticContact CE1-CD2 3.58Å; F123-H127 AromaticContact CE1-CG 3.94Å; F123-H127 AromaticContact CE2-CD2 3.24Å; F123-H127 WeakPolarHBondContact CE2-CD2 3.3Å; F123-H127 AromaticContact CE2-NE2 3.53Å; F123-H127 AromaticContact CG-CD2 3.88Å; F123-H127 HydrophobicContact CZ-CB 4.28Å; F123-H127 AromaticContact CZ-CD2 3.25Å; F123-H127 WeakPolarHBondContact CZ-CD2 3.44Å; F123-H127 AromaticContact CZ-CG 3.84Å; F123-H127 AromaticContact CZ-NE2 3.81Å; F123-H127 WeakPolarHBondContact O-CB 3.32Å; F123-H127 PolarHBondContact O-N 3.28Å
124	V	76.8	Confident	79.2	Confident	42 Å²	42	64.8 Å²	64.8	26%	0.255	32%	0.316	S	S	.	.	H	α-helix	trans	-64.6	-44.5	178	170.3	0	0	0	0	111	V120 Y121 F126 V128 F129	V120-V124 HydrophobicContact CG1-CG2 4.36Å; V120-V124 WeakPolarHBondContact O-CB 3.37Å; V120-V124 VanDerWaalsContact O-CG2 3.28Å; V120-V124 WeakPolarHBondContact O-CG2 3.39Å; V120-V124 PolarHBondContact O-N 3.49Å; Y121-V124 PolarHBondContact O-N 2.79Å; V124-F126 VanDerWaalsContact C-N 3.32Å; V124-F126 PolarHBondContact O-N 2.92Å; V124-V128 HydrophobicContact CB-CG2 4.5Å; V124-V128 HydrophobicContact CG1-CB 4.18Å; V124-V128 HydrophobicContact CG1-CG2 4.15Å; V124-V128 WeakPolarHBondContact O-CA 3.47Å; V124-V128 WeakPolarHBondContact O-CB 3.4Å; V124-V128 PolarHBondContact O-N 2.85Å; V124-F129 HydrophobicContact CG1-CD2 3.94Å; V124-F129 HydrophobicContact CG1-CE2 3.6Å; V124-F129 PolarHBondContact O-N 2.83Å
125	D	77.4	Confident	78.6	Confident	11 Å²	11	64.1 Å²	64.1	6%	0.059	32%	0.316	C	S	.	.	H	α-helix	trans	-61.9	-40.3	179.8	-164.8	67.7	0	0	0	111.8	Y121 R131 K141	Y121-D125 VanDerWaalsContact O-CB 3.31Å; Y121-D125 WeakPolarHBondContact O-CB 3.38Å; Y121-D125 PolarHBondContact O-N 2.96Å; D125-R131 PolarHBondContact O-N 3.09Å; D125-R131 WeakPolarHBondContact OD1-CD 3.25Å; D125-R131 IonicContact OD1-NH1 3.64Å; D125-K141 IonicContact OD2-NZ 2.81Å; D125-K141 PolarHBondContact OD2-NZ 3.11Å
126	F	68.9	Low	78.3	Confident	42 Å²	42	69 Å²	69	18%	0.184	34%	0.341	C	S	.	.	H	α-helix	trans	-77.7	-50.8	179.4	-171.5	-103	0	0	0	113.1	M54 M58 S122 F123 V124 H130	M54-F126 HydrophobicContact CB-CE2 4.31Å; M54-F126 HydrophobicContact SD-CE2 4.3Å; M58-F126 HydrophobicContact CE-CE1 4.36Å; M58-F126 HydrophobicContact CG-CE1 3.7Å; M58-F126 HydrophobicContact CG-CZ 3.56Å; M58-F126 HydrophobicContact SD-CE1 4Å; M58-F126 HydrophobicContact SD-CZ 3.71Å; S122-F126 VanDerWaalsContact O-CB 3.25Å; S122-F126 WeakPolarHBondContact O-CB 3.34Å; S122-F126 PolarHBondContact O-N 3.4Å; F123-F126 PolarHBondContact O-N 3.36Å; V124-F126 VanDerWaalsContact C-N 3.32Å; V124-F126 PolarHBondContact O-N 2.92Å; F126-H130 WeakPolarHBondContact O-CA 3.25Å; F126-H130 PolarHBondContact O-N 3.28Å
127	H	66.8	Low	78	Confident	28 Å²	28	71.2 Å²	71.2	13%	0.13	35%	0.353	C	S	.	.	H	α-helix	trans	-90.7	-25.3	-171	-74.2	-68.7	0	0	0	115.3	Q65 F123 H130	Q65-H127 HydrophobicContact CG-CB 4.24Å; Q65-H127 PolarHBondContact NE2-ND1 3.28Å; Q65-H127 PolarHBondContact NE2-O 3.38Å; F123-H127 HydrophobicContact CD1-CB 4.32Å; F123-H127 AromaticContact CD1-CD2 3.92Å; F123-H127 AromaticContact CD2-CD2 3.56Å; F123-H127 HydrophobicContact CE1-CB 3.88Å; F123-H127 AromaticContact CE1-CD2 3.58Å; F123-H127 AromaticContact CE1-CG 3.94Å; F123-H127 AromaticContact CE2-CD2 3.24Å; F123-H127 WeakPolarHBondContact CE2-CD2 3.3Å; F123-H127 AromaticContact CE2-NE2 3.53Å; F123-H127 AromaticContact CG-CD2 3.88Å; F123-H127 HydrophobicContact CZ-CB 4.28Å; F123-H127 AromaticContact CZ-CD2 3.25Å; F123-H127 WeakPolarHBondContact CZ-CD2 3.44Å; F123-H127 AromaticContact CZ-CG 3.84Å; F123-H127 AromaticContact CZ-NE2 3.81Å; F123-H127 WeakPolarHBondContact O-CB 3.32Å; F123-H127 PolarHBondContact O-N 3.28Å; H127-H130 PolarHBondContact O-CE1 3.27Å
128	V	66.9	Low	77.6	Confident	80 Å²	80	69.3 Å²	69.3	49%	0.485	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-50.3	-179.6	-177	0	0	0	0	109.7	V124 H130	V124-V128 HydrophobicContact CB-CG2 4.5Å; V124-V128 HydrophobicContact CG1-CB 4.18Å; V124-V128 HydrophobicContact CG1-CG2 4.15Å; V124-V128 WeakPolarHBondContact O-CA 3.47Å; V124-V128 WeakPolarHBondContact O-CB 3.4Å; V124-V128 PolarHBondContact O-N 2.85Å; V128-H130 PolarHBondContact O-ND1 3.42Å
129	F	71.5	Confident	77.5	Confident	139 Å²	139	67.3 Å²	67.3	61%	0.61	33%	0.329	S	S	*	.	S	Bend	trans	-89.9	-3.6	-175.1	-62.9	-64.1	0	0	0	114.4	V124 R131	V124-F129 HydrophobicContact CG1-CD2 3.94Å; V124-F129 HydrophobicContact CG1-CE2 3.6Å; V124-F129 PolarHBondContact O-N 2.83Å; F129-R131 PolarHBondContact O-N 3.01Å; F129-R131 VanDerWaalsContact O-N 3.08Å
130	H	66.7	Low	77.8	Confident	117 Å²	117	70.3 Å²	70.3	54%	0.542	34%	0.342	S	S	.	.			trans	48.2	37.4	178.4	-64.1	80	0	0	0	112.7	F126 H127 V128 K132	F126-H130 WeakPolarHBondContact O-CA 3.25Å; F126-H130 PolarHBondContact O-N 3.28Å; H127-H130 PolarHBondContact O-CE1 3.27Å; V128-H130 PolarHBondContact O-ND1 3.42Å; H130-K132 PolarHBondContact O-N 2.93Å
131	R	68.4	Low	78	Confident	151 Å²	151	70 Å²	70	57%	0.57	34%	0.339	S	S	*	.			trans	-74.2	127.3	179.9	-95.8	-167.3	171	164.7	-3	110.4	D125 F129 D133	D125-R131 PolarHBondContact O-N 3.09Å; D125-R131 WeakPolarHBondContact OD1-CD 3.25Å; D125-R131 IonicContact OD1-NH1 3.64Å; F129-R131 PolarHBondContact O-N 3.01Å; F129-R131 VanDerWaalsContact O-N 3.08Å; R131-D133 PolarHBondContact O-N 3.22Å
132	K	68.8	Low	78.1	Confident	158 Å²	158	64.8 Å²	64.8	69%	0.687	32%	0.32	S	S	*	.			trans	-78.7	101.5	170.8	-59.9	-168.2	179.6	-153.4	0	108.8	E55 H130	E55-K132 WeakPolarHBondContact OE1-CE 3.35Å; E55-K132 IonicContact OE1-NZ 2.88Å; E55-K132 PolarHBondContact OE1-NZ 3.43Å; H130-K132 PolarHBondContact O-N 2.93Å
133	D	74.1	Confident	78.7	Confident	27 Å²	27	64 Å²	64	14%	0.144	32%	0.315	C	S	.	.			trans	-70.7	142.8	176.4	-79.4	-34.4	0	0	0	111.2	M54 R131 V137 F138 K141	M54-D133 HydrophobicContact CE-CB 4.4Å; M54-D133 HydrophobicContact SD-CB 4.26Å; R131-D133 PolarHBondContact O-N 3.22Å; D133-V137 HydrophobicContact CB-CB 4.41Å; D133-V137 HydrophobicContact CB-CG1 4.28Å; D133-V137 WeakPolarHBondContact OD1-CG1 3.34Å; D133-F138 HydrophobicContact CB-CB 4.34Å; D133-K141 IonicContact OD1-NZ 2.68Å; D133-K141 PolarHBondContact OD1-NZ 3.47Å; D133-K141 WeakPolarHBondContact OD2-CD 3.37Å; D133-K141 IonicContact OD2-NZ 2.66Å; D133-K141 PolarHBondContact OD2-NZ 3.47Å
134	S	82.6	Confident	79.5	Confident	59 Å²	59	63.7 Å²	63.7	41%	0.413	32%	0.32	S	S	.	.			trans	-68.5	151.3	163.7	74.4	0	0	0	0	110.1	N136 V137 F138	S134-N136 PolarHBondContact O-N 3.41Å; S134-V137 PolarHBondContact O-N 3.31Å; S134-V137 VanDerWaalsContact OG-CG2 3.28Å; S134-V137 WeakPolarHBondContact OG-CG2 3.3Å; S134-V137 PolarHBondContact OG-N 2.97Å; S134-F138 PolarHBondContact O-N 2.97Å
135	P	81.9	Confident	80.2	Confident	58 Å²	58	62.8 Å²	62.8	38%	0.377	31%	0.314	S	S	.	.	H	α-helix	trans	-42	-44.4	174.6	-39	41.4	0	0	0	115.3	L139 L219	P135-L139 WeakPolarHBondContact O-CG 3.21Å; P135-L139 PolarHBondContact O-N 3.24Å; P135-L219 HydrophobicContact CB-CD2 3.59Å; P135-L219 HydrophobicContact CG-CD2 4.32Å
136	N	85.8	Confident	81	Confident	111 Å²	111	63.2 Å²	63.2	59%	0.594	32%	0.317	S	S	*	.	H	α-helix	trans	-73.1	-36.1	-177.8	-66.7	-20.4	0	0	0	112.3	S134 F140	S134-N136 PolarHBondContact O-N 3.41Å; N136-F140 VanDerWaalsContact O-CB 3.28Å; N136-F140 WeakPolarHBondContact O-CB 3.5Å; N136-F140 PolarHBondContact O-N 3.18Å
137	V	86.6	Confident	82.3	Confident	61 Å²	61	61.9 Å²	61.9	37%	0.37	31%	0.314	S	S	.	.	H	α-helix	trans	-67.6	-41.9	176.5	172.3	0	0	0	0	110	D133 S134 F140 K141	D133-V137 HydrophobicContact CB-CB 4.41Å; D133-V137 HydrophobicContact CB-CG1 4.28Å; D133-V137 WeakPolarHBondContact OD1-CG1 3.34Å; S134-V137 PolarHBondContact O-N 3.31Å; S134-V137 VanDerWaalsContact OG-CG2 3.28Å; S134-V137 WeakPolarHBondContact OG-CG2 3.3Å; S134-V137 PolarHBondContact OG-N 2.97Å; V137-F140 WeakPolarHBondContact O-CB 3.39Å; V137-F140 PolarHBondContact O-N 3.47Å; V137-K141 HydrophobicContact CG1-CD 4.26Å; V137-K141 WeakPolarHBondContact O-CG 3.43Å; V137-K141 PolarHBondContact O-N 3.48Å
138	F	84.5	Confident	83.7	Confident	32 Å²	32	60.9 Å²	60.9	14%	0.14	31%	0.31	C	S	.	.	H	α-helix	trans	-61.5	-52.2	175	177.3	-113.6	0	0	0	112.4	M54 D133 S134 F140 K141 L142 P218	M54-F138 HydrophobicContact CE-CB 3.31Å; M54-F138 HydrophobicContact CE-CD1 3.67Å; M54-F138 HydrophobicContact CE-CD2 2.89Å; M54-F138 HydrophobicContact CE-CE1 4.18Å; M54-F138 HydrophobicContact CE-CE2 3.46Å; M54-F138 VanDerWaalsContact CE-CE2 3.46Å; M54-F138 HydrophobicContact CE-CG 2.97Å; M54-F138 HydrophobicContact CE-CZ 4.07Å; D133-F138 HydrophobicContact CB-CB 4.34Å; S134-F138 PolarHBondContact O-N 2.97Å; F138-F140 PolarHBondContact O-N 3.37Å; F138-K141 PolarHBondContact O-N 2.95Å; F138-K141 VanDerWaalsContact O-N 3.13Å; F138-L142 HydrophobicContact CE1-CD2 3.97Å; F138-L142 HydrophobicContact CZ-CD2 4.17Å; F138-L142 WeakPolarHBondContact O-CB 3.32Å; F138-L142 PolarHBondContact O-N 3.41Å; F138-P218 HydrophobicContact CE1-CB 3.85Å; F138-P218 HydrophobicContact CE1-CG 4.04Å; F138-P218 WeakPolarHBondContact CE1-O 3.24Å; F138-P218 HydrophobicContact CZ-CB 4.28Å; F138-P218 HydrophobicContact CZ-CG 3.94Å
139	L	88.4	Confident	84.9	Confident	5 Å²	5	61.2 Å²	61.2	3%	0.026	31%	0.305	C	S	.	.	H	α-helix	trans	-60.8	-32	178.9	-70.1	174.3	0	0	0	111.2	P135 G143 P200 L201 N205 L219 I220	P135-L139 WeakPolarHBondContact O-CG 3.21Å; P135-L139 PolarHBondContact O-N 3.24Å; L139-G143 WeakPolarHBondContact O-CA 3.37Å; L139-G143 PolarHBondContact O-N 3.46Å; L139-P200 HydrophobicContact CD2-CB 4.17Å; L139-L201 HydrophobicContact CB-CD1 4.38Å; L139-L201 HydrophobicContact CB-CD2 4.36Å; L139-L201 HydrophobicContact CB-CG 3.84Å; L139-L201 WeakPolarHBondContact O-CD1 3.38Å; L139-N205 HydrophobicContact CD1-CB 4.34Å; L139-L219 HydrophobicContact CD1-CB 4.47Å; L139-L219 HydrophobicContact CD1-CD2 4.1Å; L139-L219 HydrophobicContact CD2-CB 3.97Å; L139-L219 HydrophobicContact CG-CB 4.41Å; L139-L219 HydrophobicContact CG-CD2 4.2Å; L139-I220 HydrophobicContact CD2-CD1 3.87Å
140	F	90.9	Very high	86.1	Confident	147 Å²	147	55.2 Å²	55.2	65%	0.645	28%	0.279	S	S	*	.	H	α-helix	trans	-66.2	-47.9	173.8	-175.7	-100.2	0	0	0	112.3	N136 V137 F138 G143 G144 L201	N136-F140 VanDerWaalsContact O-CB 3.28Å; N136-F140 WeakPolarHBondContact O-CB 3.5Å; N136-F140 PolarHBondContact O-N 3.18Å; V137-F140 WeakPolarHBondContact O-CB 3.39Å; V137-F140 PolarHBondContact O-N 3.47Å; F138-F140 PolarHBondContact O-N 3.37Å; F140-G143 PolarHBondContact O-N 3.13Å; F140-G144 PolarHBondContact O-N 3.31Å; F140-L201 HydrophobicContact CB-CD2 3.87Å; F140-L201 HydrophobicContact CD2-CD2 4.24Å
141	K	88.8	Confident	87.6	Confident	17 Å²	17	49.6 Å²	49.6	7%	0.074	25%	0.254	C	S	.	.	H	α-helix	trans	-59.7	-50	175.6	-72.3	171.8	174.7	177.8	0	110.7	D125 D133 V137 F138 G143 G144 V145	D125-K141 IonicContact OD2-NZ 2.81Å; D125-K141 PolarHBondContact OD2-NZ 3.11Å; D133-K141 IonicContact OD1-NZ 2.68Å; D133-K141 PolarHBondContact OD1-NZ 3.47Å; D133-K141 WeakPolarHBondContact OD2-CD 3.37Å; D133-K141 IonicContact OD2-NZ 2.66Å; D133-K141 PolarHBondContact OD2-NZ 3.47Å; V137-K141 HydrophobicContact CG1-CD 4.26Å; V137-K141 WeakPolarHBondContact O-CG 3.43Å; V137-K141 PolarHBondContact O-N 3.48Å; F138-K141 PolarHBondContact O-N 2.95Å; F138-K141 VanDerWaalsContact O-N 3.13Å; K141-G143 PolarHBondContact O-N 3.35Å; K141-G144 PolarHBondContact O-N 3.47Å; K141-V145 PolarHBondContact O-N 3.26Å; K141-V145 VanDerWaalsContact O-N 3.08Å
142	L	88.3	Confident	88.9	Confident	27 Å²	27	43.1 Å²	43.1	14%	0.141	23%	0.231	C	C	.	.	H	α-helix	trans	-61	-44.8	177.4	-178	59.6	0	0	0	111.4	F138 G144 V145 T146 F217 I220	F138-L142 HydrophobicContact CE1-CD2 3.97Å; F138-L142 HydrophobicContact CZ-CD2 4.17Å; F138-L142 WeakPolarHBondContact O-CB 3.32Å; F138-L142 PolarHBondContact O-N 3.41Å; L142-G144 VanDerWaalsContact C-N 3.3Å; L142-G144 PolarHBondContact O-N 3.42Å; L142-V145 WeakPolarHBondContact O-CB 3.21Å; L142-V145 PolarHBondContact O-N 3.02Å; L142-V145 VanDerWaalsContact O-N 3.12Å; L142-T146 PolarHBondContact O-N 3.14Å; L142-T146 PolarHBondContact O-OG1 2.97Å; L142-F217 HydrophobicContact CD1-CD1 4.19Å; L142-F217 HydrophobicContact CD1-CE1 4.22Å; L142-F217 HydrophobicContact CD2-CD1 4.37Å; L142-I220 HydrophobicContact CD2-CD1 3.78Å; L142-I220 HydrophobicContact CD2-CG1 3.67Å
143	G	92.3	Very high	90.2	Very high	7 Å²	7	35.6 Å²	35.6	7%	0.072	20%	0.199	C	C	.	.	H	α-helix	trans	-60.1	-37.6	175.1	0	0	0	0	0	112.6	L139 F140 K141 T146 A147 A197	L139-G143 WeakPolarHBondContact O-CA 3.37Å; L139-G143 PolarHBondContact O-N 3.46Å; F140-G143 PolarHBondContact O-N 3.13Å; K141-G143 PolarHBondContact O-N 3.35Å; G143-T146 PolarHBondContact O-N 3.4Å; G143-A147 WeakPolarHBondContact O-CB 3.26Å; G143-A147 PolarHBondContact O-N 2.91Å; G143-A197 WeakPolarHBondContact O-CB 3.16Å
144	G	93.6	Very high	91.3	Very high	19 Å²	19	34.5 Å²	34.5	20%	0.196	19%	0.193	C	C	.	.	H	α-helix	trans	-62.7	-42.7	172.7	0	0	0	0	0	113	F140 K141 L142 S148	F140-G144 PolarHBondContact O-N 3.31Å; K141-G144 PolarHBondContact O-N 3.47Å; L142-G144 VanDerWaalsContact C-N 3.3Å; L142-G144 PolarHBondContact O-N 3.42Å; G144-S148 WeakPolarHBondContact O-CB 3.36Å; G144-S148 PolarHBondContact O-N 3.3Å; G144-S148 VanDerWaalsContact O-N 3.09Å; G144-S148 PolarHBondContact O-OG 3.42Å
145	V	91.3	Very high	92	Very high	23 Å²	23	31.7 Å²	31.7	14%	0.139	17%	0.174	C	C	.	.	H	α-helix	trans	-63.4	-53.8	173.8	176.3	0	0	0	0	110	I118 K141 L142 A147 S148 F149	I118-V145 HydrophobicContact CG2-CG2 3.78Å; K141-V145 PolarHBondContact O-N 3.26Å; K141-V145 VanDerWaalsContact O-N 3.08Å; L142-V145 WeakPolarHBondContact O-CB 3.21Å; L142-V145 PolarHBondContact O-N 3.02Å; L142-V145 VanDerWaalsContact O-N 3.12Å; V145-A147 VanDerWaalsContact C-N 3.33Å; V145-A147 PolarHBondContact O-N 2.82Å; V145-S148 WeakPolarHBondContact O-CB 3.34Å; V145-S148 PolarHBondContact O-N 3.47Å; V145-S148 VanDerWaalsContact O-N 3.1Å; V145-F149 HydrophobicContact CG1-CD2 3.59Å; V145-F149 HydrophobicContact CG1-CE2 3.62Å; V145-F149 WeakPolarHBondContact O-CD2 3.32Å; V145-F149 PolarHBondContact O-N 3.37Å
146	T	93.5	Very high	92.6	Very high	20 Å²	20	30.7 Å²	30.7	12%	0.123	17%	0.165	C	C	.	.	H	α-helix	trans	-56.8	-44.2	178.9	-56.3	0	0	0	0	112	L142 G143 S148 F149 T150 A197 W228	L142-T146 PolarHBondContact O-N 3.14Å; L142-T146 PolarHBondContact O-OG1 2.97Å; G143-T146 PolarHBondContact O-N 3.4Å; T146-S148 VanDerWaalsContact C-N 3.33Å; T146-S148 PolarHBondContact O-N 3Å; T146-F149 PolarHBondContact O-N 2.92Å; T146-T150 WeakPolarHBondContact O-CB 3.33Å; T146-T150 PolarHBondContact O-N 2.94Å; T146-T150 PolarHBondContact O-OG1 3.3Å; T146-A197 HydrophobicContact CG2-CB 4.07Å; T146-W228 VanDerWaalsContact CG2-NE1 3.3Å
147	A	96.2	Very high	93.1	Very high	13 Å²	13	27.7 Å²	27.7	11%	0.107	15%	0.147	C	C	.	.	H	α-helix	trans	-60.3	-44	177.1	0	0	0	0	0	111.5	G143 V145 A151 A197	G143-A147 WeakPolarHBondContact O-CB 3.26Å; G143-A147 PolarHBondContact O-N 2.91Å; V145-A147 VanDerWaalsContact C-N 3.33Å; V145-A147 PolarHBondContact O-N 2.82Å; A147-A151 WeakPolarHBondContact O-CB 3.33Å; A147-A151 PolarHBondContact O-N 3.34Å; A147-A197 HydrophobicContact CB-CB 3.58Å
148	S	95.9	Very high	93.6	Very high	7 Å²	7	25.8 Å²	25.8	5%	0.049	13%	0.134	C	C	.	.	H	α-helix	trans	-65.9	-46	179.9	-57.3	0	0	0	0	111.5	G115 G144 V145 T146 A151 S152	G115-S148 PolarHBondContact N-OG 3.04Å; G144-S148 WeakPolarHBondContact O-CB 3.36Å; G144-S148 PolarHBondContact O-N 3.3Å; G144-S148 VanDerWaalsContact O-N 3.09Å; G144-S148 PolarHBondContact O-OG 3.42Å; V145-S148 WeakPolarHBondContact O-CB 3.34Å; V145-S148 PolarHBondContact O-N 3.47Å; V145-S148 VanDerWaalsContact O-N 3.1Å; T146-S148 VanDerWaalsContact C-N 3.33Å; T146-S148 PolarHBondContact O-N 3Å; S148-A151 PolarHBondContact O-N 2.83Å; S148-S152 WeakPolarHBondContact O-CB 3.36Å; S148-S152 PolarHBondContact O-N 2.89Å
149	F	94	Very high	94.1	Very high	88 Å²	88	25.1 Å²	25.1	39%	0.386	13%	0.133	S	C	.	.	H	α-helix	trans	-62.7	-46.8	175.3	-87.5	-83.7	0	0	0	112	V145 T146 A151 S152 V153 W305	V145-F149 HydrophobicContact CG1-CD2 3.59Å; V145-F149 HydrophobicContact CG1-CE2 3.62Å; V145-F149 WeakPolarHBondContact O-CD2 3.32Å; V145-F149 PolarHBondContact O-N 3.37Å; T146-F149 PolarHBondContact O-N 2.92Å; F149-A151 VanDerWaalsContact C-N 3.32Å; F149-A151 PolarHBondContact O-N 2.95Å; F149-S152 WeakPolarHBondContact O-CB 3.46Å; F149-S152 PolarHBondContact O-N 2.9Å; F149-V153 WeakPolarHBondContact O-CG2 3.36Å; F149-V153 PolarHBondContact O-N 2.92Å; F149-W305 HydrophobicContact CB-CH2 4.35Å; F149-W305 AromaticContact CD1-CH2 3.76Å; F149-W305 HydrophobicContact CD1-CH2 3.76Å; F149-W305 AromaticContact CD1-CZ2 3.99Å; F149-W305 HydrophobicContact CD1-CZ2 3.99Å
150	T	96.1	Very high	94.4	Very high	12 Å²	12	24.9 Å²	24.9	7%	0.074	13%	0.132	C	C	.	.	H	α-helix	trans	-62.8	-39.4	177.2	-61	0	0	0	0	111.6	T146 G154 A193 W228	T146-T150 WeakPolarHBondContact O-CB 3.33Å; T146-T150 PolarHBondContact O-N 2.94Å; T146-T150 PolarHBondContact O-OG1 3.3Å; T150-G154 PolarHBondContact O-N 3Å; T150-A193 HydrophobicContact CG2-CB 3.73Å; T150-W228 PolarHBondContact OG1-NE1 3.31Å
151	A	96.8	Very high	94.6	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-67.7	-34.9	174.9	0	0	0	0	0	112.7	A111 A147 S148 F149 G154 S155 M189 W190 A193	A111-A151 HydrophobicContact CB-CB 4.01Å; A147-A151 WeakPolarHBondContact O-CB 3.33Å; A147-A151 PolarHBondContact O-N 3.34Å; S148-A151 PolarHBondContact O-N 2.83Å; F149-A151 VanDerWaalsContact C-N 3.32Å; F149-A151 PolarHBondContact O-N 2.95Å; A151-G154 PolarHBondContact O-N 2.98Å; A151-S155 WeakPolarHBondContact O-CB 3.48Å; A151-S155 PolarHBondContact O-N 3.08Å; A151-S155 PolarHBondContact O-OG 2.87Å; A151-M189 HydrophobicContact CB-SD 4.3Å; A151-M189 WeakPolarHBondContact O-CE 3.25Å; A151-W190 HydrophobicContact CB-CD2 4.16Å; A151-W190 HydrophobicContact CB-CE3 4.11Å; A151-W190 HydrophobicContact CB-CH2 4.12Å; A151-W190 HydrophobicContact CB-CZ2 4.18Å; A151-W190 HydrophobicContact CB-CZ3 4.1Å; A151-A193 HydrophobicContact CB-CB 4.08Å
152	S	96.5	Very high	94.8	Very high	14 Å²	14	19.5 Å²	19.5	10%	0.098	11%	0.11	C	C	.	.	H	α-helix	trans	-64.8	-51	174.8	-175.7	0	0	0	0	110.8	L108 D112 S148 F149 G154 S155 L156	L108-S152 WeakPolarHBondContact CD1-OG 3.35Å; D112-S152 WeakPolarHBondContact OD1-CB 3.43Å; D112-S152 PolarHBondContact OD1-OG 3.36Å; S148-S152 WeakPolarHBondContact O-CB 3.36Å; S148-S152 PolarHBondContact O-N 2.89Å; F149-S152 WeakPolarHBondContact O-CB 3.46Å; F149-S152 PolarHBondContact O-N 2.9Å; S152-G154 VanDerWaalsContact C-N 3.34Å; S152-G154 PolarHBondContact O-N 2.91Å; S152-S155 WeakPolarHBondContact O-CB 3.18Å; S152-S155 PolarHBondContact O-N 3.42Å; S152-S155 VanDerWaalsContact O-N 3.11Å; S152-L156 PolarHBondContact O-N 2.8Å
153	V	96.6	Very high	95	Very high	1 Å²	1	23.1 Å²	23.1	1%	0.006	12%	0.122	C	C	.	.	H	α-helix	trans	-60.1	-43.1	173.7	-180	0	0	0	0	111.8	F149 S155 L156 F157 T232 L235 L236 I239 W305	F149-V153 WeakPolarHBondContact O-CG2 3.36Å; F149-V153 PolarHBondContact O-N 2.92Å; V153-S155 VanDerWaalsContact C-N 3.29Å; V153-S155 PolarHBondContact O-N 2.84Å; V153-L156 WeakPolarHBondContact O-CB 3.47Å; V153-L156 PolarHBondContact O-N 2.95Å; V153-F157 WeakPolarHBondContact O-CB 3.36Å; V153-F157 PolarHBondContact O-N 3.32Å; V153-T232 HydrophobicContact CG2-CG2 4.43Å; V153-L235 HydrophobicContact CG1-CB 3.93Å; V153-L235 HydrophobicContact CG1-CD1 4.16Å; V153-L236 HydrophobicContact CG1-CD2 4.12Å; V153-L236 HydrophobicContact CG1-CG 4.31Å; V153-I239 HydrophobicContact CG1-CD1 4.46Å; V153-W305 HydrophobicContact CG2-CD2 4.49Å; V153-W305 HydrophobicContact CG2-CH2 3.31Å; V153-W305 HydrophobicContact CG2-CZ2 3.1Å; V153-W305 HydrophobicContact CG2-CZ3 4.11Å
154	G	97.1	Very high	95	Very high	3 Å²	3	25.2 Å²	25.2	3%	0.031	13%	0.128	C	C	.	.	H	α-helix	trans	-61.3	-37.1	175.9	0	0	0	0	0	112.8	T150 A151 S152 F157 L158	T150-G154 PolarHBondContact O-N 3Å; A151-G154 PolarHBondContact O-N 2.98Å; S152-G154 VanDerWaalsContact C-N 3.34Å; S152-G154 PolarHBondContact O-N 2.91Å; G154-F157 WeakPolarHBondContact O-CB 3.18Å; G154-F157 PolarHBondContact O-N 2.89Å; G154-L158 WeakPolarHBondContact O-CG 3.38Å; G154-L158 PolarHBondContact O-N 2.84Å
155	S	96.8	Very high	94.9	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-69.7	-38.6	175.4	-60	0	0	0	0	112	S107 A151 S152 V153 F157 L158 T159 M189	S107-S155 PolarHBondContact OG-OG 2.86Å; A151-S155 WeakPolarHBondContact O-CB 3.48Å; A151-S155 PolarHBondContact O-N 3.08Å; A151-S155 PolarHBondContact O-OG 2.87Å; S152-S155 WeakPolarHBondContact O-CB 3.18Å; S152-S155 PolarHBondContact O-N 3.42Å; S152-S155 VanDerWaalsContact O-N 3.11Å; V153-S155 VanDerWaalsContact C-N 3.29Å; V153-S155 PolarHBondContact O-N 2.84Å; S155-F157 VanDerWaalsContact C-N 3.34Å; S155-L158 PolarHBondContact O-N 3.3Å; S155-T159 WeakPolarHBondContact O-CB 3.32Å; S155-T159 PolarHBondContact O-N 3.28Å; S155-T159 PolarHBondContact O-OG1 3.42Å; S155-M189 VanDerWaalsContact OG-CE 3.25Å; S155-M189 WeakPolarHBondContact OG-CE 3.48Å
156	L	95.3	Very high	94.8	Very high	38 Å²	38	26.2 Å²	26.2	20%	0.199	13%	0.13	C	C	.	.	H	α-helix	trans	-62.4	-41.7	170.9	-70.3	172.8	0	0	0	111.4	L108 S152 V153 T159 A160 I239 L301	L108-L156 HydrophobicContact CD1-CD2 4.39Å; L108-L156 HydrophobicContact CD1-CG 4.14Å; L108-L156 HydrophobicContact CD2-CD2 3.81Å; L108-L156 HydrophobicContact CD2-CG 4.44Å; S152-L156 PolarHBondContact O-N 2.8Å; V153-L156 WeakPolarHBondContact O-CB 3.47Å; V153-L156 PolarHBondContact O-N 2.95Å; L156-T159 WeakPolarHBondContact O-CB 3.12Å; L156-T159 PolarHBondContact O-N 3.04Å; L156-A160 WeakPolarHBondContact O-CB 3.46Å; L156-A160 PolarHBondContact O-N 2.94Å; L156-I239 HydrophobicContact CB-CD1 3.93Å; L156-L301 HydrophobicContact CD1-CD1 4.11Å
157	F	96.9	Very high	94.4	Very high	47 Å²	47	28.2 Å²	28.2	21%	0.206	14%	0.139	C	C	.	.	H	α-helix	trans	-62.6	-47.6	176.3	172.9	-101.7	0	0	0	112.3	V153 G154 S155 T159 A160 I161 L235 F238 I239	V153-F157 WeakPolarHBondContact O-CB 3.36Å; V153-F157 PolarHBondContact O-N 3.32Å; G154-F157 WeakPolarHBondContact O-CB 3.18Å; G154-F157 PolarHBondContact O-N 2.89Å; S155-F157 VanDerWaalsContact C-N 3.34Å; F157-T159 VanDerWaalsContact C-N 3.27Å; F157-T159 PolarHBondContact O-N 3.1Å; F157-A160 WeakPolarHBondContact O-CB 3.47Å; F157-A160 PolarHBondContact O-N 2.99Å; F157-A160 VanDerWaalsContact O-N 3.13Å; F157-I161 HydrophobicContact CD1-CD1 3.89Å; F157-I161 HydrophobicContact CE1-CD1 3.3Å; F157-I161 HydrophobicContact CE1-CG1 4.37Å; F157-I161 HydrophobicContact CE2-CD1 4.12Å; F157-I161 HydrophobicContact CZ-CD1 3.45Å; F157-I161 VanDerWaalsContact CZ-CD1 3.45Å; F157-I161 HydrophobicContact CZ-CG1 4.3Å; F157-I161 WeakPolarHBondContact O-CG1 3.26Å; F157-I161 PolarHBondContact O-N 3.32Å; F157-L235 HydrophobicContact CB-CD2 4.42Å; F157-L235 HydrophobicContact CD1-CD2 4.06Å; F157-L235 HydrophobicContact CD2-CD2 3.82Å; F157-L235 HydrophobicContact CE1-CD2 4.2Å; F157-L235 HydrophobicContact CE2-CD2 3.95Å; F157-L235 HydrophobicContact CG-CD2 3.86Å; F157-L235 HydrophobicContact CZ-CD2 4.14Å; F157-F238 HydrophobicContact CD2-CB 4.23Å; F157-F238 AromaticContact CD2-CD1 3.54Å; F157-F238 HydrophobicContact CD2-CD1 3.54Å; F157-F238 HydrophobicContact CD2-CE1 4.22Å; F157-F238 HydrophobicContact CD2-CG 4.13Å; F157-F238 HydrophobicContact CE2-CB 3.85Å; F157-F238 AromaticContact CE2-CD1 3.17Å; F157-F238 HydrophobicContact CE2-CD1 3.17Å; F157-F238 HydrophobicContact CE2-CD2 4.28Å; F157-F238 AromaticContact CE2-CE1 3.71Å; F157-F238 HydrophobicContact CE2-CE1 3.71Å; F157-F238 AromaticContact CE2-CG 3.5Å; F157-F238 HydrophobicContact CE2-CG 3.5Å; F157-F238 HydrophobicContact CE2-CZ 4.45Å; F157-F238 HydrophobicContact CZ-CD1 4.21Å; F157-F238 HydrophobicContact CZ-CE1 4.39Å; F157-I239 HydrophobicContact CB-CD1 4.03Å; F157-I239 HydrophobicContact CB-CG1 4.13Å; F157-I239 HydrophobicContact CD2-CG1 4.34Å
158	L	96.1	Very high	94	Very high	21 Å²	21	30.3 Å²	30.3	11%	0.11	15%	0.147	C	C	.	.	H	α-helix	trans	-61.6	-37.9	175	-71.1	176.3	0	0	0	111.8	F104 G154 S155 I161 D162 A185 F186 M189	F104-L158 HydrophobicContact CD1-CB 3.76Å; F104-L158 HydrophobicContact CD1-CD1 3.91Å; F104-L158 HydrophobicContact CD1-CG 4.44Å; F104-L158 HydrophobicContact CE1-CB 4Å; F104-L158 HydrophobicContact CE1-CD1 3.94Å; F104-L158 HydrophobicContact CE1-CG 4.42Å; F104-L158 HydrophobicContact CG-CB 4.06Å; F104-L158 HydrophobicContact CZ-CB 4.49Å; G154-L158 WeakPolarHBondContact O-CG 3.38Å; G154-L158 PolarHBondContact O-N 2.84Å; S155-L158 PolarHBondContact O-N 3.3Å; L158-I161 PolarHBondContact O-N 2.94Å; L158-D162 PolarHBondContact O-N 3.43Å; L158-A185 HydrophobicContact CD2-CB 4.27Å; L158-F186 HydrophobicContact CD1-CB 4.26Å; L158-M189 HydrophobicContact CD1-CB 3.98Å; L158-M189 HydrophobicContact CD1-CE 4.42Å; L158-M189 HydrophobicContact CD1-CG 4.19Å
159	T	95	Very high	93.6	Very high	19 Å²	19	36.9 Å²	36.9	12%	0.117	17%	0.17	C	C	.	.	H	α-helix	trans	-63.9	-42.4	173.9	-58.1	0	0	0	0	111.2	F104 S155 L156 F157 D162 R163	F104-T159 WeakPolarHBondContact CB-OG1 3.24Å; S155-T159 WeakPolarHBondContact O-CB 3.32Å; S155-T159 PolarHBondContact O-N 3.28Å; S155-T159 PolarHBondContact O-OG1 3.42Å; L156-T159 WeakPolarHBondContact O-CB 3.12Å; L156-T159 PolarHBondContact O-N 3.04Å; F157-T159 VanDerWaalsContact C-N 3.27Å; F157-T159 PolarHBondContact O-N 3.1Å; T159-D162 PolarHBondContact O-N 2.91Å; T159-R163 WeakPolarHBondContact O-CG 3.36Å; T159-R163 PolarHBondContact O-N 2.99Å
160	A	94.3	Very high	93.2	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-62.9	-42	175.9	0	0	0	0	0	111.8	L156 F157 R163 Y164 I239 A242 Y243	L156-A160 WeakPolarHBondContact O-CB 3.46Å; L156-A160 PolarHBondContact O-N 2.94Å; F157-A160 WeakPolarHBondContact O-CB 3.47Å; F157-A160 PolarHBondContact O-N 2.99Å; F157-A160 VanDerWaalsContact O-N 3.13Å; A160-R163 PolarHBondContact O-N 3.44Å; A160-Y164 VanDerWaalsContact O-CB 3.24Å; A160-Y164 WeakPolarHBondContact O-CB 3.41Å; A160-Y164 PolarHBondContact O-N 3.3Å; A160-I239 HydrophobicContact CB-CB 4.41Å; A160-I239 HydrophobicContact CB-CG1 4.06Å; A160-I239 HydrophobicContact CB-CG2 4.28Å; A160-A242 HydrophobicContact CB-CB 4.22Å; A160-Y243 HydrophobicContact CB-CE2 4.11Å
161	I	94.9	Very high	92.9	Very high	47 Å²	47	44.8 Å²	44.8	24%	0.241	22%	0.22	C	C	.	.	H	α-helix	trans	-61.1	-47.7	173.5	-70.5	175.6	0	0	0	111.2	F157 L158 R163 Y164 I165 F238	F157-I161 HydrophobicContact CD1-CD1 3.89Å; F157-I161 HydrophobicContact CE1-CD1 3.3Å; F157-I161 HydrophobicContact CE1-CG1 4.37Å; F157-I161 HydrophobicContact CE2-CD1 4.12Å; F157-I161 HydrophobicContact CZ-CD1 3.45Å; F157-I161 VanDerWaalsContact CZ-CD1 3.45Å; F157-I161 HydrophobicContact CZ-CG1 4.3Å; F157-I161 WeakPolarHBondContact O-CG1 3.26Å; F157-I161 PolarHBondContact O-N 3.32Å; L158-I161 PolarHBondContact O-N 2.94Å; I161-R163 VanDerWaalsContact C-N 3.32Å; I161-R163 PolarHBondContact O-N 3.34Å; I161-Y164 WeakPolarHBondContact O-CB 3.48Å; I161-Y164 PolarHBondContact O-N 2.98Å; I161-I165 HydrophobicContact CG2-CD1 3.62Å; I161-I165 HydrophobicContact CG2-CG1 4.24Å; I161-I165 VanDerWaalsContact O-CG1 3.3Å; I161-I165 WeakPolarHBondContact O-CG1 3.43Å; I161-I165 PolarHBondContact O-N 2.86Å; I161-F238 HydrophobicContact CD1-CE1 4.35Å; I161-F238 HydrophobicContact CG1-CE1 3.61Å; I161-F238 HydrophobicContact CG1-CZ 4.07Å
162	D	93.9	Very high	92.6	Very high	3 Å²	3	45.7 Å²	45.7	2%	0.016	23%	0.228	C	C	.	.	H	α-helix	trans	-55.4	-48.7	177.9	175.2	65.4	0	0	0	111.2	S101 F104 L158 T159 I165 S166 Y173	S101-D162 VanDerWaalsContact CB-OD2 3.26Å; S101-D162 WeakPolarHBondContact CB-OD2 3.4Å; S101-D162 VanDerWaalsContact OG-CG 3.29Å; S101-D162 PolarHBondContact OG-OD1 3.33Å; S101-D162 PolarHBondContact OG-OD2 2.84Å; F104-D162 HydrophobicContact CD2-CB 4.13Å; F104-D162 HydrophobicContact CE2-CB 3.98Å; L158-D162 PolarHBondContact O-N 3.43Å; T159-D162 PolarHBondContact O-N 2.91Å; D162-I165 PolarHBondContact O-N 3.42Å; D162-S166 WeakPolarHBondContact O-CB 3.38Å; D162-S166 PolarHBondContact O-N 3.34Å; D162-Y173 VanDerWaalsContact OD1-CE2 3.27Å; D162-Y173 WeakPolarHBondContact OD1-CE2 3.22Å; D162-Y173 PolarHBondContact OD1-OH 3.07Å
163	R	91.8	Very high	92.4	Very high	104 Å²	104	47.3 Å²	47.3	39%	0.392	23%	0.232	S	C	.	.	H	α-helix	trans	-64	-43.5	177.3	-64.6	-55.6	-178.8	-171.2	-1.8	112	T159 A160 I161 I165 S166 I167 I246	T159-R163 WeakPolarHBondContact O-CG 3.36Å; T159-R163 PolarHBondContact O-N 2.99Å; A160-R163 PolarHBondContact O-N 3.44Å; I161-R163 VanDerWaalsContact C-N 3.32Å; I161-R163 PolarHBondContact O-N 3.34Å; R163-I165 PolarHBondContact O-N 2.93Å; R163-S166 PolarHBondContact O-N 3Å; R163-S166 PolarHBondContact O-OG 3.47Å; R163-I167 PolarHBondContact O-N 3.19Å; R163-I246 HydrophobicContact CB-CD1 3.71Å
164	Y	91.4	Very high	92	Very high	51 Å²	51	56.2 Å²	56.2	20%	0.2	27%	0.271	C	S	.	.	H	α-helix	trans	-57.7	-49.4	177	176.6	-92.9	0	0	0	111.4	A160 I161 S166 I167 H168 A242 Y245	A160-Y164 VanDerWaalsContact O-CB 3.24Å; A160-Y164 WeakPolarHBondContact O-CB 3.41Å; A160-Y164 PolarHBondContact O-N 3.3Å; I161-Y164 WeakPolarHBondContact O-CB 3.48Å; I161-Y164 PolarHBondContact O-N 2.98Å; Y164-S166 VanDerWaalsContact C-N 3.34Å; Y164-S166 PolarHBondContact O-N 2.86Å; Y164-I167 PolarHBondContact O-N 3.36Å; Y164-H168 HydrophobicContact CD1-CB 4.44Å; Y164-H168 HydrophobicContact CE1-CB 4.14Å; Y164-H168 WeakPolarHBondContact O-CB 3.33Å; Y164-H168 PolarHBondContact O-N 2.8Å; Y164-A242 HydrophobicContact CD2-CB 4.44Å; Y164-Y245 AromaticContact CD2-CD1 3.68Å; Y164-Y245 HydrophobicContact CD2-CD1 3.68Å; Y164-Y245 HydrophobicContact CD2-CE1 4.21Å; Y164-Y245 HydrophobicContact CD2-CG 4.35Å; Y164-Y245 AromaticContact CE2-CD1 3.35Å; Y164-Y245 HydrophobicContact CE2-CD1 3.35Å; Y164-Y245 AromaticContact CE2-CE1 3.65Å; Y164-Y245 HydrophobicContact CE2-CE1 3.65Å; Y164-Y245 AromaticContact CE2-CG 3.85Å; Y164-Y245 HydrophobicContact CE2-CG 3.85Å
165	I	92.4	Very high	91.7	Very high	35 Å²	35	65.4 Å²	65.4	18%	0.179	30%	0.304	C	S	.	.	H	α-helix	trans	-63.6	-41.5	179.1	-62.6	168	0	0	0	110.6	I161 D162 R163 I167 H168 R169 Y173 I176 V177	I161-I165 HydrophobicContact CG2-CD1 3.62Å; I161-I165 HydrophobicContact CG2-CG1 4.24Å; I161-I165 VanDerWaalsContact O-CG1 3.3Å; I161-I165 WeakPolarHBondContact O-CG1 3.43Å; I161-I165 PolarHBondContact O-N 2.86Å; D162-I165 PolarHBondContact O-N 3.42Å; R163-I165 PolarHBondContact O-N 2.93Å; I165-I167 PolarHBondContact O-N 3.44Å; I165-H168 PolarHBondContact O-N 3.1Å; I165-R169 CarbonylContact O-C 3.59Å; I165-R169 PolarHBondContact O-N 2.84Å; I165-Y173 HydrophobicContact CB-CD2 4.46Å; I165-Y173 HydrophobicContact CG2-CD2 4.08Å; I165-I176 HydrophobicContact CD1-CG2 4.22Å; I165-I176 HydrophobicContact CG2-CB 4.31Å; I165-I176 HydrophobicContact CG2-CD1 4.04Å; I165-I176 HydrophobicContact CG2-CG2 4.06Å; I165-V177 HydrophobicContact CD1-CG2 4.23Å; I165-V177 HydrophobicContact CG2-CG2 4.24Å
166	S	88.9	Confident	91.4	Very high	28 Å²	28	68.4 Å²	68.4	20%	0.196	32%	0.32	C	S	.	.	H	α-helix	trans	-59.3	-34	-179	77.6	0	0	0	0	113.1	D162 R163 Y164 P170 Y173	D162-S166 WeakPolarHBondContact O-CB 3.38Å; D162-S166 PolarHBondContact O-N 3.34Å; R163-S166 PolarHBondContact O-N 3Å; R163-S166 PolarHBondContact O-OG 3.47Å; Y164-S166 VanDerWaalsContact C-N 3.34Å; Y164-S166 PolarHBondContact O-N 2.86Å; S166-P170 WeakPolarHBondContact O-CA 3.15Å; S166-Y173 VanDerWaalsContact CA-CD2 3.41Å
167	I	86.1	Confident	91.3	Very high	61 Å²	61	67.6 Å²	67.6	31%	0.313	32%	0.316	S	S	.	.	H	α-helix	trans	-95.4	-36	-177.5	-67.6	175.8	0	0	0	111.6	R163 Y164 I165 I246 K249	R163-I167 PolarHBondContact O-N 3.19Å; Y164-I167 PolarHBondContact O-N 3.36Å; I165-I167 PolarHBondContact O-N 3.44Å; I167-I246 HydrophobicContact CD1-CB 4.23Å; I167-I246 HydrophobicContact CD1-CG1 4.04Å; I167-I246 HydrophobicContact CD1-CG2 3.35Å; I167-K249 HydrophobicContact CG2-CB 4.14Å; I167-K249 HydrophobicContact CG2-CG 3.91Å
168	H	86.5	Confident	91.1	Very high	57 Å²	57	67.5 Å²	67.5	26%	0.264	32%	0.32	S	S	.	.	H	α-helix	trans	-72.3	-38.3	178.8	-174	67.8	0	0	0	112	Y164 I165 Y245	Y164-H168 HydrophobicContact CD1-CB 4.44Å; Y164-H168 HydrophobicContact CE1-CB 4.14Å; Y164-H168 WeakPolarHBondContact O-CB 3.33Å; Y164-H168 PolarHBondContact O-N 2.8Å; I165-H168 PolarHBondContact O-N 3.1Å; H168-Y245 HydrophobicContact CB-CE1 4.31Å; H168-Y245 AromaticContact ND1-CE1 3.9Å; H168-Y245 AromaticContact ND1-CZ 3.7Å; H168-Y245 PolarHBondContact ND1-OH 3.43Å
169	R	87.9	Confident	90.8	Very high	145 Å²	145	71.7 Å²	71.7	55%	0.547	33%	0.334	S	S	.	.	S	Bend	trans	-134.2	65.5	-176.9	-57.9	-65.9	177.5	160.7	3.3	111.9	I165 L171 A172 Y173 I176	I165-R169 CarbonylContact O-C 3.59Å; I165-R169 PolarHBondContact O-N 2.84Å; R169-L171 VanDerWaalsContact C-N 3.34Å; R169-L171 PolarHBondContact O-N 3.39Å; R169-A172 HydrophobicContact CB-CB 4.23Å; R169-A172 PolarHBondContact O-N 2.91Å; R169-A172 VanDerWaalsContact O-N 3.09Å; R169-Y173 PolarHBondContact O-N 3.44Å; R169-I176 HydrophobicContact CB-CD1 4.46Å
170	P	86	Confident	90.7	Very high	87 Å²	87	75.2 Å²	75.2	57%	0.565	36%	0.357	S	S	*	.	H	α-helix	trans	-59.2	-39.6	-172.7	22.7	-33.9	0	0	0	113.7	S166 A172	S166-P170 WeakPolarHBondContact O-CA 3.15Å; P170-A172 VanDerWaalsContact C-N 3.34Å; P170-A172 PolarHBondContact O-N 2.71Å
171	L	89.6	Confident	90.7	Very high	179 Å²	179	81.3 Å²	81.3	94%	0.937	38%	0.384	S	S	*	.	H	α-helix	trans	-71.1	-28.4	-180	-58.2	177.3	0	0	0	113	R169	R169-L171 VanDerWaalsContact C-N 3.34Å; R169-L171 PolarHBondContact O-N 3.39Å
172	A	90.9	Very high	90.5	Very high	20 Å²	20	79.3 Å²	79.3	17%	0.165	37%	0.374	C	S	.	.	H	α-helix	trans	-95.8	-12.2	-179.7	0	0	0	0	0	113	R169 P170 K174 R175 I176	R169-A172 HydrophobicContact CB-CB 4.23Å; R169-A172 PolarHBondContact O-N 2.91Å; R169-A172 VanDerWaalsContact O-N 3.09Å; P170-A172 VanDerWaalsContact C-N 3.34Å; P170-A172 PolarHBondContact O-N 2.71Å; A172-K174 PolarHBondContact O-N 3.16Å; A172-R175 WeakPolarHBondContact O-CA 3.3Å; A172-R175 WeakPolarHBondContact O-CB 3.22Å; A172-R175 PolarHBondContact O-N 2.92Å; A172-I176 HydrophobicContact CB-CD1 3.67Å; A172-I176 HydrophobicContact CB-CG1 4.24Å; A172-I176 WeakPolarHBondContact O-CG1 3.47Å; A172-I176 PolarHBondContact O-N 2.96Å
173	Y	91.3	Very high	90.5	Very high	47 Å²	47	81.7 Å²	81.7	18%	0.184	39%	0.389	C	S	.	.	H	α-helix	trans	-50.4	-51.3	-174.9	174.1	-103.3	0	0	0	112.7	S101 D162 I165 S166 R169 R175 I176 V177	S101-Y173 PolarHBondContact OG-OH 3.16Å; S101-Y173 VanDerWaalsContact OG-OH 3.1Å; D162-Y173 VanDerWaalsContact OD1-CE2 3.27Å; D162-Y173 WeakPolarHBondContact OD1-CE2 3.22Å; D162-Y173 PolarHBondContact OD1-OH 3.07Å; I165-Y173 HydrophobicContact CB-CD2 4.46Å; I165-Y173 HydrophobicContact CG2-CD2 4.08Å; S166-Y173 VanDerWaalsContact CA-CD2 3.41Å; R169-Y173 PolarHBondContact O-N 3.44Å; Y173-R175 PolarHBondContact O-N 2.92Å; Y173-R175 VanDerWaalsContact O-N 3.14Å; Y173-I176 PolarHBondContact O-N 3.02Å; Y173-I176 VanDerWaalsContact O-N 3.11Å; Y173-V177 HydrophobicContact CD2-CB 4.28Å; Y173-V177 HydrophobicContact CD2-CG2 3.87Å; Y173-V177 HydrophobicContact CE2-CB 3.84Å; Y173-V177 HydrophobicContact CE2-CG1 4.35Å; Y173-V177 HydrophobicContact CE2-CG2 3.59Å; Y173-V177 PolarHBondContact O-N 3.4Å
174	K	89	Confident	90.7	Very high	189 Å²	189	81.5 Å²	81.5	82%	0.822	40%	0.398	S	S	*	.	H	α-helix	trans	-60.9	-24.8	-180	-69.1	-173.1	177.5	-179.5	0	113.9	A172	A172-K174 PolarHBondContact O-N 3.16Å
175	R	91.4	Very high	90.8	Very high	195 Å²	195	80.7 Å²	80.7	74%	0.736	40%	0.402	S	S	*	.	H	α-helix	trans	-87.4	-35.2	177.3	-174	-178.2	67.8	-169.5	1.8	111.8	A172 Y173	A172-R175 WeakPolarHBondContact O-CA 3.3Å; A172-R175 WeakPolarHBondContact O-CB 3.22Å; A172-R175 PolarHBondContact O-N 2.92Å; Y173-R175 PolarHBondContact O-N 2.92Å; Y173-R175 VanDerWaalsContact O-N 3.14Å
176	I	90.6	Very high	90.8	Very high	64 Å²	64	81.3 Å²	81.3	33%	0.328	40%	0.404	S	S	.	.	H	α-helix	trans	-77.2	-53.9	-177.4	-64.6	166.5	0	0	0	110	I165 R169 A172 Y173 T178 K181	I165-I176 HydrophobicContact CD1-CG2 4.22Å; I165-I176 HydrophobicContact CG2-CB 4.31Å; I165-I176 HydrophobicContact CG2-CD1 4.04Å; I165-I176 HydrophobicContact CG2-CG2 4.06Å; R169-I176 HydrophobicContact CB-CD1 4.46Å; A172-I176 HydrophobicContact CB-CD1 3.67Å; A172-I176 HydrophobicContact CB-CG1 4.24Å; A172-I176 WeakPolarHBondContact O-CG1 3.47Å; A172-I176 PolarHBondContact O-N 2.96Å; Y173-I176 PolarHBondContact O-N 3.02Å; Y173-I176 VanDerWaalsContact O-N 3.11Å; I176-T178 PolarHBondContact O-N 3.32Å; I176-K181 WeakPolarHBondContact O-CD 3.4Å
177	V	92	Very high	91.1	Very high	20 Å²	20	82.7 Å²	82.7	12%	0.121	41%	0.413	C	S	.	.	S	Bend	trans	-95.3	101.8	-175.5	-173.8	0	0	0	0	109.1	P100 I165 Y173	P100-V177 HydrophobicContact CB-CG1 3.71Å; P100-V177 HydrophobicContact CG-CG1 4.26Å; I165-V177 HydrophobicContact CD1-CG2 4.23Å; I165-V177 HydrophobicContact CG2-CG2 4.24Å; Y173-V177 HydrophobicContact CD2-CB 4.28Å; Y173-V177 HydrophobicContact CD2-CG2 3.87Å; Y173-V177 HydrophobicContact CE2-CB 3.84Å; Y173-V177 HydrophobicContact CE2-CG1 4.35Å; Y173-V177 HydrophobicContact CE2-CG2 3.59Å; Y173-V177 PolarHBondContact O-N 3.4Å
178	T	92.6	Very high	91.7	Very high	45 Å²	45	84.7 Å²	84.7	28%	0.276	42%	0.424	S	S	.	.			trans	-119.2	158	178.4	60.1	0	0	0	0	110	I176 K181 A182	I176-T178 PolarHBondContact O-N 3.32Å; T178-K181 PolarHBondContact O-N 2.48Å; T178-K181 WeakPolarHBondContact OG1-CG 3.32Å; T178-A182 PolarHBondContact O-N 3.38Å
179	R	90.4	Very high	92.2	Very high	110 Å²	110	83.1 Å²	83.1	42%	0.415	42%	0.417	S	S	.	.	H	α-helix	trans	-56.8	-47.4	-178.1	-61	175.7	72.7	-156	-2.6	113	R97 C98 P100 K181 A182 V183	R97-R179 PolarHBondContact O-NE 3.4Å; R97-R179 PolarHBondContact O-NH2 3.14Å; C98-R179 VanDerWaalsContact O-CD 3.26Å; C98-R179 WeakPolarHBondContact O-CD 3.35Å; P100-R179 HydrophobicContact CG-CG 3.98Å; R179-K181 VanDerWaalsContact C-N 3.33Å; R179-K181 PolarHBondContact O-N 3.43Å; R179-A182 PolarHBondContact O-N 3.28Å; R179-V183 VanDerWaalsContact O-CG2 3.3Å; R179-V183 WeakPolarHBondContact O-CG2 3.23Å; R179-V183 PolarHBondContact O-N 3.26Å
180	P	92.5	Very high	92.6	Very high	92 Å²	92	78.3 Å²	78.3	60%	0.597	40%	0.398	S	S	*	.	H	α-helix	trans	-61.4	-41.7	-180	-22.3	34.5	0	0	0	112.2	V183 V184	P180-V183 PolarHBondContact O-N 2.9Å; P180-V184 WeakPolarHBondContact O-CG2 3.33Å; P180-V184 PolarHBondContact O-N 2.98Å
181	K	93.8	Very high	93.2	Very high	129 Å²	129	78 Å²	78	56%	0.561	40%	0.395	S	S	*	.	H	α-helix	trans	-65.5	-39.8	177.3	-69.1	-175.8	179	179.7	0	112.4	I176 T178 R179 V183 V184 A185	I176-K181 WeakPolarHBondContact O-CD 3.4Å; T178-K181 PolarHBondContact O-N 2.48Å; T178-K181 WeakPolarHBondContact OG1-CG 3.32Å; R179-K181 VanDerWaalsContact C-N 3.33Å; R179-K181 PolarHBondContact O-N 3.43Å; K181-V183 VanDerWaalsContact C-N 3.32Å; K181-V184 PolarHBondContact O-N 3.34Å; K181-A185 VanDerWaalsContact O-CB 3.29Å; K181-A185 WeakPolarHBondContact O-CB 3.45Å; K181-A185 PolarHBondContact O-N 2.9Å
182	A	92.3	Very high	93.5	Very high	4 Å²	4	73.6 Å²	73.6	3%	0.033	37%	0.372	C	S	.	.	H	α-helix	trans	-63.7	-40	174.9	0	0	0	0	0	111.4	P100 F104 T178 R179 A185 F186	P100-A182 HydrophobicContact CB-CB 3.95Å; F104-A182 HydrophobicContact CE1-CB 4.09Å; F104-A182 HydrophobicContact CE2-CB 4.41Å; F104-A182 HydrophobicContact CZ-CB 3.7Å; T178-A182 PolarHBondContact O-N 3.38Å; R179-A182 PolarHBondContact O-N 3.28Å; A182-A185 PolarHBondContact O-N 3.45Å; A182-F186 VanDerWaalsContact O-CD1 3.3Å; A182-F186 WeakPolarHBondContact O-CD1 3.45Å; A182-F186 PolarHBondContact O-N 3.2Å
183	V	92.5	Very high	93.8	Very high	54 Å²	54	72.7 Å²	72.7	33%	0.327	36%	0.364	S	S	.	.	H	α-helix	trans	-61.4	-51.3	175.5	174.8	0	0	0	0	111.3	R179 P180 K181 A185 F186 C187	R179-V183 VanDerWaalsContact O-CG2 3.3Å; R179-V183 WeakPolarHBondContact O-CG2 3.23Å; R179-V183 PolarHBondContact O-N 3.26Å; P180-V183 PolarHBondContact O-N 2.9Å; K181-V183 VanDerWaalsContact C-N 3.32Å; V183-A185 VanDerWaalsContact C-N 3.3Å; V183-A185 PolarHBondContact O-N 2.48Å; V183-F186 VanDerWaalsContact CA-CD1 3.45Å; V183-F186 VanDerWaalsContact CA-CE1 3.41Å; V183-F186 HydrophobicContact CB-CD1 4.43Å; V183-F186 HydrophobicContact CB-CE1 3.9Å; V183-F186 HydrophobicContact CG1-CE1 3.88Å; V183-F186 HydrophobicContact CG1-CZ 4.09Å; V183-F186 HydrophobicContact CG2-CE1 3.87Å; V183-F186 WeakPolarHBondContact O-CD1 3.48Å; V183-F186 PolarHBondContact O-N 2.84Å; V183-C187 WeakPolarHBondContact O-CB 3.23Å; V183-C187 PolarHBondContact O-N 3.07Å; V183-C187 PolarHBondContact O-SG 3.5Å
184	V	95.7	Very high	94.1	Very high	99 Å²	99	74.4 Å²	74.4	60%	0.6	38%	0.376	S	S	*	.	H	α-helix	trans	-57.7	-44.4	176.6	172.3	0	0	0	0	111.2	P180 K181 C187 L188	P180-V184 WeakPolarHBondContact O-CG2 3.33Å; P180-V184 PolarHBondContact O-N 2.98Å; K181-V184 PolarHBondContact O-N 3.34Å; V184-C187 PolarHBondContact O-N 3.22Å; V184-L188 VanDerWaalsContact O-CB 3.29Å; V184-L188 WeakPolarHBondContact O-CB 3.23Å; V184-L188 PolarHBondContact O-N 3.3Å
185	A	94.4	Very high	94.5	Very high	34 Å²	34	69.1 Å²	69.1	28%	0.281	36%	0.359	S	S	.	.	H	α-helix	trans	-63.3	-45.9	-179.4	0	0	0	0	0	112.7	L158 K181 A182 V183 M189	L158-A185 HydrophobicContact CD2-CB 4.27Å; K181-A185 VanDerWaalsContact O-CB 3.29Å; K181-A185 WeakPolarHBondContact O-CB 3.45Å; K181-A185 PolarHBondContact O-N 2.9Å; A182-A185 PolarHBondContact O-N 3.45Å; V183-A185 VanDerWaalsContact C-N 3.3Å; V183-A185 PolarHBondContact O-N 2.48Å; A185-M189 WeakPolarHBondContact O-CB 3.34Å; A185-M189 PolarHBondContact O-N 3.24Å
186	F	92.9	Very high	94.6	Very high	49 Å²	49	60.6 Å²	60.6	22%	0.215	33%	0.328	C	S	.	.	H	α-helix	trans	-69.4	-41.8	178	86.5	-111.3	0	0	0	111.1	H103 F104 L158 A182 V183 L188 M189 W190	H103-F186 HydrophobicContact CB-CD1 4.31Å; H103-F186 HydrophobicContact CB-CE1 4.45Å; F104-F186 HydrophobicContact CD1-CB 4.39Å; F104-F186 HydrophobicContact CE1-CB 4.49Å; L158-F186 HydrophobicContact CD1-CB 4.26Å; A182-F186 VanDerWaalsContact O-CD1 3.3Å; A182-F186 WeakPolarHBondContact O-CD1 3.45Å; A182-F186 PolarHBondContact O-N 3.2Å; V183-F186 VanDerWaalsContact CA-CD1 3.45Å; V183-F186 VanDerWaalsContact CA-CE1 3.41Å; V183-F186 HydrophobicContact CB-CD1 4.43Å; V183-F186 HydrophobicContact CB-CE1 3.9Å; V183-F186 HydrophobicContact CG1-CE1 3.88Å; V183-F186 HydrophobicContact CG1-CZ 4.09Å; V183-F186 HydrophobicContact CG2-CE1 3.87Å; V183-F186 WeakPolarHBondContact O-CD1 3.48Å; V183-F186 PolarHBondContact O-N 2.84Å; F186-L188 VanDerWaalsContact C-N 3.32Å; F186-L188 PolarHBondContact O-N 3.43Å; F186-M189 PolarHBondContact O-N 3.27Å; F186-W190 AromaticContact CD2-CD1 3.94Å; F186-W190 VanDerWaalsContact O-CD1 3.24Å; F186-W190 PolarHBondContact O-N 3.48Å
187	C	95.8	Very high	94.8	Very high	56 Å²	56	57.6 Å²	57.6	38%	0.378	31%	0.313	S	S	.	.	H	α-helix	trans	-59.6	-42.7	177.6	-71.4	0	0	0	0	112.1	V183 V184 W190 T191	V183-C187 WeakPolarHBondContact O-CB 3.23Å; V183-C187 PolarHBondContact O-N 3.07Å; V183-C187 PolarHBondContact O-SG 3.5Å; V184-C187 PolarHBondContact O-N 3.22Å; C187-W190 PolarHBondContact O-N 2.92Å; C187-T191 WeakPolarHBondContact O-CB 3.44Å; C187-T191 PolarHBondContact O-N 3.37Å; C187-T191 PolarHBondContact O-OG1 3.02Å
188	L	97.1	Very high	95	Very high	104 Å²	104	59 Å²	59	55%	0.545	32%	0.322	S	S	.	.	H	α-helix	trans	-62.8	-45.6	176.2	-179.8	62.7	0	0	0	111.1	V184 F186 W190 T191 I192	V184-L188 VanDerWaalsContact O-CB 3.29Å; V184-L188 WeakPolarHBondContact O-CB 3.23Å; V184-L188 PolarHBondContact O-N 3.3Å; F186-L188 VanDerWaalsContact C-N 3.32Å; F186-L188 PolarHBondContact O-N 3.43Å; L188-W190 PolarHBondContact O-N 2.83Å; L188-T191 PolarHBondContact O-N 2.93Å; L188-I192 HydrophobicContact CD1-CD1 4.08Å; L188-I192 HydrophobicContact CD1-CG1 4.39Å; L188-I192 HydrophobicContact CG-CD1 3.87Å; L188-I192 VanDerWaalsContact O-CG1 3.29Å; L188-I192 WeakPolarHBondContact O-CG1 3.28Å; L188-I192 PolarHBondContact O-N 3.42Å
189	M	97.1	Very high	95	Very high	23 Å²	23	59 Å²	59	11%	0.113	32%	0.319	C	S	.	.	H	α-helix	trans	-59.7	-46.5	177.7	-178.6	-75.7	-66.5	0	0	111.7	A151 S155 L158 A185 F186 T191 I192 A193	A151-M189 HydrophobicContact CB-SD 4.3Å; A151-M189 WeakPolarHBondContact O-CE 3.25Å; S155-M189 VanDerWaalsContact OG-CE 3.25Å; S155-M189 WeakPolarHBondContact OG-CE 3.48Å; L158-M189 HydrophobicContact CD1-CB 3.98Å; L158-M189 HydrophobicContact CD1-CE 4.42Å; L158-M189 HydrophobicContact CD1-CG 4.19Å; A185-M189 WeakPolarHBondContact O-CB 3.34Å; A185-M189 PolarHBondContact O-N 3.24Å; F186-M189 PolarHBondContact O-N 3.27Å; M189-T191 VanDerWaalsContact C-N 3.33Å; M189-T191 PolarHBondContact O-N 3.27Å; M189-I192 PolarHBondContact O-N 3.28Å; M189-A193 WeakPolarHBondContact O-CB 3.33Å; M189-A193 PolarHBondContact O-N 2.87Å
190	W	97.6	Very high	95.1	Very high	44 Å²	44	53.9 Å²	53.9	17%	0.167	30%	0.301	C	S	.	.	H	α-helix	trans	-59.7	-43.8	175.4	-87.8	87.3	0	0	0	112.2	S107 V110 A111 L114 A151 F186 C187 L188 I192 A193 I194	S107-W190 PolarHBondContact OG-NE1 3.25Å; V110-W190 HydrophobicContact CB-CZ2 4.28Å; V110-W190 HydrophobicContact CG1-CH2 3.94Å; V110-W190 HydrophobicContact CG1-CZ2 4Å; A111-W190 HydrophobicContact CB-CH2 3.97Å; A111-W190 HydrophobicContact CB-CZ2 3.94Å; L114-W190 HydrophobicContact CD1-CH2 3.95Å; L114-W190 HydrophobicContact CD1-CZ3 4.11Å; A151-W190 HydrophobicContact CB-CD2 4.16Å; A151-W190 HydrophobicContact CB-CE3 4.11Å; A151-W190 HydrophobicContact CB-CH2 4.12Å; A151-W190 HydrophobicContact CB-CZ2 4.18Å; A151-W190 HydrophobicContact CB-CZ3 4.1Å; F186-W190 AromaticContact CD2-CD1 3.94Å; F186-W190 VanDerWaalsContact O-CD1 3.24Å; F186-W190 PolarHBondContact O-N 3.48Å; C187-W190 PolarHBondContact O-N 2.92Å; L188-W190 PolarHBondContact O-N 2.83Å; W190-I192 VanDerWaalsContact C-N 3.33Å; W190-I192 PolarHBondContact O-N 3.37Å; W190-A193 PolarHBondContact O-N 3Å; W190-I194 HydrophobicContact CE3-CD1 4.44Å; W190-I194 VanDerWaalsContact O-CG1 3.29Å; W190-I194 WeakPolarHBondContact O-CG1 3.42Å; W190-I194 PolarHBondContact O-N 3.43Å
191	T	97.8	Very high	95	Very high	82 Å²	82	52 Å²	52	50%	0.503	29%	0.285	S	S	.	.	H	α-helix	trans	-60.7	-45.8	178.2	-54.2	0	0	0	0	110.6	C187 L188 M189 I194 V195	C187-T191 WeakPolarHBondContact O-CB 3.44Å; C187-T191 PolarHBondContact O-N 3.37Å; C187-T191 PolarHBondContact O-OG1 3.02Å; L188-T191 PolarHBondContact O-N 2.93Å; M189-T191 VanDerWaalsContact C-N 3.33Å; M189-T191 PolarHBondContact O-N 3.27Å; T191-I194 PolarHBondContact O-N 3.08Å; T191-V195 HydrophobicContact CG2-CG2 4.44Å; T191-V195 WeakPolarHBondContact O-CB 3.5Å; T191-V195 WeakPolarHBondContact O-CG2 3.15Å; T191-V195 PolarHBondContact O-N 3.4Å
192	I	96.9	Very high	94.9	Very high	86 Å²	86	52 Å²	52	44%	0.441	29%	0.29	S	S	.	.	H	α-helix	trans	-62.8	-45	177.2	-66.7	165.1	0	0	0	110.9	L188 M189 W190 I194 V195 I196	L188-I192 HydrophobicContact CD1-CD1 4.08Å; L188-I192 HydrophobicContact CD1-CG1 4.39Å; L188-I192 HydrophobicContact CG-CD1 3.87Å; L188-I192 VanDerWaalsContact O-CG1 3.29Å; L188-I192 WeakPolarHBondContact O-CG1 3.28Å; L188-I192 PolarHBondContact O-N 3.42Å; M189-I192 PolarHBondContact O-N 3.28Å; W190-I192 VanDerWaalsContact C-N 3.33Å; W190-I192 PolarHBondContact O-N 3.37Å; I192-I194 PolarHBondContact O-N 3Å; I192-V195 PolarHBondContact O-N 2.75Å; I192-I196 HydrophobicContact CG2-CD1 3.72Å; I192-I196 HydrophobicContact CG2-CG1 4.35Å; I192-I196 VanDerWaalsContact O-CG1 3.32Å; I192-I196 WeakPolarHBondContact O-CG1 3.37Å; I192-I196 PolarHBondContact O-N 2.86Å
193	A	97.3	Very high	94.7	Very high	1 Å²	1	52.3 Å²	52.3	1%	0.008	29%	0.294	C	S	.	.	H	α-helix	trans	-59.5	-45.8	178.8	0	0	0	0	0	112	T150 A151 M189 W190 A197	T150-A193 HydrophobicContact CG2-CB 3.73Å; A151-A193 HydrophobicContact CB-CB 4.08Å; M189-A193 WeakPolarHBondContact O-CB 3.33Å; M189-A193 PolarHBondContact O-N 2.87Å; W190-A193 PolarHBondContact O-N 3Å; A193-A197 VanDerWaalsContact O-CB 3.31Å; A193-A197 WeakPolarHBondContact O-CB 3.46Å; A193-A197 PolarHBondContact O-N 3.28Å
194	I	96.6	Very high	94.6	Very high	82 Å²	82	53.7 Å²	53.7	42%	0.421	29%	0.294	S	S	.	.	H	α-helix	trans	-64.2	-47.6	176.9	-67	165.5	0	0	0	110.3	W190 T191 I192 I196 A197 V198	W190-I194 HydrophobicContact CE3-CD1 4.44Å; W190-I194 VanDerWaalsContact O-CG1 3.29Å; W190-I194 WeakPolarHBondContact O-CG1 3.42Å; W190-I194 PolarHBondContact O-N 3.43Å; T191-I194 PolarHBondContact O-N 3.08Å; I192-I194 PolarHBondContact O-N 3Å; I194-I196 VanDerWaalsContact C-N 3.35Å; I194-I196 PolarHBondContact O-N 2.88Å; I194-A197 PolarHBondContact O-N 3.5Å; I194-V198 HydrophobicContact CG2-CG1 4.27Å; I194-V198 WeakPolarHBondContact O-CG1 3.33Å; I194-V198 WeakPolarHBondContact O-CG2 3.4Å; I194-V198 PolarHBondContact O-N 2.94Å
195	V	96.6	Very high	94.3	Very high	79 Å²	79	49.8 Å²	49.8	48%	0.479	27%	0.269	S	S	.	.	H	α-helix	trans	-56.7	-49.3	179.8	166.8	0	0	0	0	110.7	T191 I192 A197 V198 L199	T191-V195 HydrophobicContact CG2-CG2 4.44Å; T191-V195 WeakPolarHBondContact O-CB 3.5Å; T191-V195 WeakPolarHBondContact O-CG2 3.15Å; T191-V195 PolarHBondContact O-N 3.4Å; I192-V195 PolarHBondContact O-N 2.75Å; V195-A197 VanDerWaalsContact C-N 3.33Å; V195-A197 PolarHBondContact O-N 3.3Å; V195-V198 WeakPolarHBondContact O-CG2 3.45Å; V195-V198 PolarHBondContact O-N 3.38Å; V195-L199 WeakPolarHBondContact O-CG 3.43Å; V195-L199 PolarHBondContact O-N 3.24Å
196	I	95	Very high	93.9	Very high	16 Å²	16	48.4 Å²	48.4	8%	0.082	26%	0.258	C	S	.	.	H	α-helix	trans	-58.2	-47.7	177.9	-69.7	170.7	0	0	0	110.4	I192 I194 V198 L199 Y224 F227	I192-I196 HydrophobicContact CG2-CD1 3.72Å; I192-I196 HydrophobicContact CG2-CG1 4.35Å; I192-I196 VanDerWaalsContact O-CG1 3.32Å; I192-I196 WeakPolarHBondContact O-CG1 3.37Å; I192-I196 PolarHBondContact O-N 2.86Å; I194-I196 VanDerWaalsContact C-N 3.35Å; I194-I196 PolarHBondContact O-N 2.88Å; I196-V198 VanDerWaalsContact C-N 3.34Å; I196-V198 PolarHBondContact O-N 3.45Å; I196-L199 WeakPolarHBondContact O-CB 3.45Å; I196-L199 WeakPolarHBondContact O-CG 3.35Å; I196-L199 PolarHBondContact O-N 2.99Å; I196-Y224 WeakPolarHBondContact O-CE2 3.33Å; I196-Y224 PolarHBondContact O-OH 2.73Å; I196-F227 HydrophobicContact CD1-CE1 4.49Å; I196-F227 HydrophobicContact CG1-CE1 4.24Å; I196-F227 HydrophobicContact CG2-CE1 4.09Å
197	A	95.1	Very high	93.5	Very high	1 Å²	1	53.3 Å²	53.3	1%	0.008	28%	0.279	C	S	.	.	H	α-helix	trans	-68.6	-27.8	-174.6	0	0	0	0	0	114.4	G143 T146 A147 A193 I194 V195 P200	G143-A197 WeakPolarHBondContact O-CB 3.16Å; T146-A197 HydrophobicContact CG2-CB 4.07Å; A147-A197 HydrophobicContact CB-CB 3.58Å; A193-A197 VanDerWaalsContact O-CB 3.31Å; A193-A197 WeakPolarHBondContact O-CB 3.46Å; A193-A197 PolarHBondContact O-N 3.28Å; I194-A197 PolarHBondContact O-N 3.5Å; V195-A197 VanDerWaalsContact C-N 3.33Å; V195-A197 PolarHBondContact O-N 3.3Å; A197-P200 WeakPolarHBondContact O-CD 3.45Å
198	V	94.4	Very high	93	Very high	50 Å²	50	57.6 Å²	57.6	30%	0.303	29%	0.291	S	S	.	.	H	α-helix	trans	-88	-6.2	178.8	-58	0	0	0	0	113.7	I194 V195 I196 P200 L201 L202	I194-V198 HydrophobicContact CG2-CG1 4.27Å; I194-V198 WeakPolarHBondContact O-CG1 3.33Å; I194-V198 WeakPolarHBondContact O-CG2 3.4Å; I194-V198 PolarHBondContact O-N 2.94Å; V195-V198 WeakPolarHBondContact O-CG2 3.45Å; V195-V198 PolarHBondContact O-N 3.38Å; I196-V198 VanDerWaalsContact C-N 3.34Å; I196-V198 PolarHBondContact O-N 3.45Å; V198-P200 VanDerWaalsContact C-CD 3.49Å; V198-P200 VanDerWaalsContact C-N 3.34Å; V198-L201 HydrophobicContact CB-CD1 4.33Å; V198-L201 WeakPolarHBondContact O-CB 3.37Å; V198-L201 PolarHBondContact O-N 2.97Å; V198-L202 HydrophobicContact CG2-CD1 4.07Å; V198-L202 PolarHBondContact O-N 3.45Å; V198-L202 VanDerWaalsContact O-N 3.08Å
199	L	94.1	Very high	92.5	Very high	43 Å²	43	56.8 Å²	56.8	23%	0.225	29%	0.287	C	S	.	.	H	α-helix	trans	-53.9	-42.2	179.8	-66.8	173.6	0	0	0	113.5	V195 I196 L201 L202 G203 W204 Y224	V195-L199 WeakPolarHBondContact O-CG 3.43Å; V195-L199 PolarHBondContact O-N 3.24Å; I196-L199 WeakPolarHBondContact O-CB 3.45Å; I196-L199 WeakPolarHBondContact O-CG 3.35Å; I196-L199 PolarHBondContact O-N 2.99Å; L199-L201 VanDerWaalsContact C-N 3.3Å; L199-L201 PolarHBondContact O-N 2.89Å; L199-L202 PolarHBondContact O-N 2.96Å; L199-L202 VanDerWaalsContact O-N 3.17Å; L199-G203 PolarHBondContact O-N 2.95Å; L199-G203 VanDerWaalsContact O-N 3.1Å; L199-W204 HydrophobicContact CB-CB 4.31Å; L199-W204 HydrophobicContact CB-CE3 4.28Å; L199-W204 HydrophobicContact CD1-CE3 3.92Å; L199-W204 HydrophobicContact CD1-CZ3 4.03Å; L199-W204 PolarHBondContact O-N 3.5Å; L199-Y224 HydrophobicContact CB-CD2 4.38Å; L199-Y224 HydrophobicContact CB-CE2 4.09Å; L199-Y224 HydrophobicContact CD1-CE2 4.44Å
200	P	91.7	Very high	91.8	Very high	4 Å²	4	64.4 Å²	64.4	3%	0.026	32%	0.322	C	S	.	.	H	α-helix	trans	-63.1	-34.5	177	-23.9	36.5	0	0	0	113.3	L139 A197 V198 G203 W204 N205 I220 Y224	L139-P200 HydrophobicContact CD2-CB 4.17Å; A197-P200 WeakPolarHBondContact O-CD 3.45Å; V198-P200 VanDerWaalsContact C-CD 3.49Å; V198-P200 VanDerWaalsContact C-N 3.34Å; P200-G203 PolarHBondContact O-N 3.06Å; P200-W204 WeakPolarHBondContact CA-O 2.99Å; P200-N205 PolarHBondContact O-ND2 3.06Å; P200-I220 HydrophobicContact CB-CD1 3.93Å; P200-I220 HydrophobicContact CG-CD1 3.96Å; P200-Y224 HydrophobicContact CG-CD1 3.97Å; P200-Y224 HydrophobicContact CG-CD2 4Å; P200-Y224 HydrophobicContact CG-CE1 3.62Å; P200-Y224 HydrophobicContact CG-CE2 3.68Å; P200-Y224 HydrophobicContact CG-CG 4.13Å; P200-Y224 VanDerWaalsContact CG-CZ 3.46Å
201	L	90.6	Very high	91.3	Very high	52 Å²	52	64.4 Å²	64.4	27%	0.272	33%	0.329	S	S	.	.	H	α-helix	trans	-66.9	-39.5	173.9	-74	111.6	0	0	0	112.3	L139 F140 V198 L199 G203	L139-L201 HydrophobicContact CB-CD1 4.38Å; L139-L201 HydrophobicContact CB-CD2 4.36Å; L139-L201 HydrophobicContact CB-CG 3.84Å; L139-L201 WeakPolarHBondContact O-CD1 3.38Å; F140-L201 HydrophobicContact CB-CD2 3.87Å; F140-L201 HydrophobicContact CD2-CD2 4.24Å; V198-L201 HydrophobicContact CB-CD1 4.33Å; V198-L201 WeakPolarHBondContact O-CB 3.37Å; V198-L201 PolarHBondContact O-N 2.97Å; L199-L201 VanDerWaalsContact C-N 3.3Å; L199-L201 PolarHBondContact O-N 2.89Å; L201-G203 PolarHBondContact O-N 2.95Å
202	L	91.1	Very high	90.6	Very high	128 Å²	128	64.8 Å²	64.8	67%	0.67	33%	0.331	S	S	*	.	H	α-helix	trans	-72.5	-18.2	-179.4	-64.6	177.9	0	0	0	112.6	V198 L199	V198-L202 HydrophobicContact CG2-CD1 4.07Å; V198-L202 PolarHBondContact O-N 3.45Å; V198-L202 VanDerWaalsContact O-N 3.08Å; L199-L202 PolarHBondContact O-N 2.96Å; L199-L202 VanDerWaalsContact O-N 3.17Å
203	G	87.6	Confident	90.1	Very high	11 Å²	11	62.5 Å²	62.5	11%	0.113	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	142.7	-2.6	168.4	0	0	0	0	0	115.7	L199 P200 L201 N205 L209	L199-G203 PolarHBondContact O-N 2.95Å; L199-G203 VanDerWaalsContact O-N 3.1Å; P200-G203 PolarHBondContact O-N 3.06Å; L201-G203 PolarHBondContact O-N 2.95Å; G203-N205 PolarHBondContact O-N 3.13Å; G203-L209 WeakPolarHBondContact O-CD1 3.39Å
204	W	90.6	Very high	89.5	Confident	83 Å²	83	62.6 Å²	62.6	31%	0.314	32%	0.323	S	S	.	.			trans	-80.1	59.3	174.8	-161	-18.3	0	0	0	110.9	L199 P200 D221 T223 Y224	L199-W204 HydrophobicContact CB-CB 4.31Å; L199-W204 HydrophobicContact CB-CE3 4.28Å; L199-W204 HydrophobicContact CD1-CE3 3.92Å; L199-W204 HydrophobicContact CD1-CZ3 4.03Å; L199-W204 PolarHBondContact O-N 3.5Å; P200-W204 WeakPolarHBondContact CA-O 2.99Å; W204-D221 PolarHBondContact NE1-OD1 3.3Å; W204-T223 PolarHBondContact NE1-OG1 3.23Å; W204-Y224 HydrophobicContact CD2-CD2 4.42Å
205	N	89.5	Confident	88.6	Confident	17 Å²	17	61.6 Å²	61.6	9%	0.091	32%	0.318	C	S	.	.	B	Isolated β-bridge	trans	-125.7	151.5	177.2	63	68.2	0	0	0	109.4	L139 P200 G203 K207 K208 L209 L219	L139-N205 HydrophobicContact CD1-CB 4.34Å; P200-N205 PolarHBondContact O-ND2 3.06Å; G203-N205 PolarHBondContact O-N 3.13Å; N205-K207 PolarHBondContact O-N 3.18Å; N205-K207 VanDerWaalsContact O-N 3.16Å; N205-K207 PolarHBondContact OD1-N 3.37Å; N205-K208 PolarHBondContact O-N 3.08Å; N205-K208 VanDerWaalsContact O-N 3.16Å; N205-K208 WeakPolarHBondContact OD1-CB 3.28Å; N205-K208 PolarHBondContact OD1-N 3.49Å; N205-L209 PolarHBondContact O-N 2.9Å; N205-L219 WeakPolarHBondContact CA-O 3.09Å; N205-L219 VanDerWaalsContact CB-O 3.24Å; N205-L219 WeakPolarHBondContact CB-O 3.42Å
206	C	86.4	Confident	87.7	Confident	5 Å²	5	58.9 Å²	58.9	3%	0.034	30%	0.301	C	S	.	.	H	α-helix	trans	-63.4	-27.8	-171.7	61.6	0	0	0	0	112.8	Q210 S211 C213 L219 D221	C206-Q210 WeakPolarHBondContact O-CA 3.48Å; C206-Q210 PolarHBondContact O-N 3.39Å; C206-S211 WeakPolarHBondContact CA-OG 3.37Å; C206-S211 PolarHBondContact O-N 2.77Å; C206-C213 HydrophobicContact CB-CB 3.85Å; C206-C213 WeakPolarHBondContact CB-SG 3.37Å; C206-C213 WeakPolarHBondContact SG-CB 3.36Å; C206-C213 CovalentContact SG-SG 2.03Å; C206-C213 PolarHBondContact SG-SG 3.43Å; C206-L219 PolarHBondContact N-O 3.12Å; C206-L219 VanDerWaalsContact N-O 3.17Å; C206-L219 VanDerWaalsContact SG-C 3.58Å; C206-D221 HydrophobicContact CB-CB 4.27Å
207	K	84.4	Confident	87.2	Confident	153 Å²	153	60 Å²	60	67%	0.665	31%	0.305	S	S	*	.	H	α-helix	trans	-66.5	-42.4	177.2	-175.5	175.2	-178.4	173.5	0	112.7	N205	N205-K207 PolarHBondContact O-N 3.18Å; N205-K207 VanDerWaalsContact O-N 3.16Å; N205-K207 PolarHBondContact OD1-N 3.37Å
208	K	86.1	Confident	86.5	Confident	145 Å²	145	60.6 Å²	60.6	63%	0.63	31%	0.309	S	S	*	.	H	α-helix	trans	-82.2	-31	-178.3	-165.5	174.5	-176.9	179.4	0	112.2	N205	N205-K208 PolarHBondContact O-N 3.08Å; N205-K208 VanDerWaalsContact O-N 3.16Å; N205-K208 WeakPolarHBondContact OD1-CB 3.28Å; N205-K208 PolarHBondContact OD1-N 3.49Å
209	L	85.4	Confident	86	Confident	87 Å²	87	59.4 Å²	59.4	46%	0.455	30%	0.301	S	S	.	.	H	α-helix	trans	-86.3	-10.9	177.4	-93.4	65	0	0	0	113.8	G203 N205 S211	G203-L209 WeakPolarHBondContact O-CD1 3.39Å; N205-L209 PolarHBondContact O-N 2.9Å; L209-S211 PolarHBondContact O-N 3.36Å
210	Q	83.6	Confident	85.7	Confident	184 Å²	184	57.8 Å²	57.8	86%	0.86	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	42.9	-172.9	-59.9	-178.2	-40.7	0	0	112.2	C206	C206-Q210 WeakPolarHBondContact O-CA 3.48Å; C206-Q210 PolarHBondContact O-N 3.39Å
211	S	85.5	Confident	85.7	Confident	43 Å²	43	57.7 Å²	57.7	30%	0.301	29%	0.292	S	S	.	.			trans	-111.4	177.7	-176.6	55.8	0	0	0	0	111.7	C206 L209 C213 D221	C206-S211 WeakPolarHBondContact CA-OG 3.37Å; C206-S211 PolarHBondContact O-N 2.77Å; L209-S211 PolarHBondContact O-N 3.36Å; S211-C213 PolarHBondContact O-N 3.09Å; S211-D221 WeakPolarHBondContact CB-OD2 3.21Å; S211-D221 PolarHBondContact OG-OD2 2.9Å
212	V	83.8	Confident	85.6	Confident	91 Å²	91	57.5 Å²	57.5	55%	0.552	29%	0.289	S	S	*	.	P	Polyproline II helix	trans	-70.9	127.2	178.3	-170.1	0	0	0	0	109.7	E222	V212-E222 HydrophobicContact CB-CG 4.47Å; V212-E222 HydrophobicContact CG1-CG 4.35Å; V212-E222 WeakPolarHBondContact CG1-OE1 3.29Å; V212-E222 PolarHBondContact O-N 3.39Å
213	C	85.9	Confident	85.7	Confident	38 Å²	38	54.7 Å²	54.7	26%	0.257	28%	0.278	S	S	.	.	B	Isolated β-bridge	trans	-87	147.8	176.5	-56	0	0	0	0	110.8	C206 S211 I220	C206-C213 HydrophobicContact CB-CB 3.85Å; C206-C213 WeakPolarHBondContact CB-SG 3.37Å; C206-C213 WeakPolarHBondContact SG-CB 3.36Å; C206-C213 CovalentContact SG-SG 2.03Å; C206-C213 PolarHBondContact SG-SG 3.43Å; S211-C213 PolarHBondContact O-N 3.09Å; C213-I220 CarbonylContact C-O 3.55Å; C213-I220 WeakPolarHBondContact CA-O 3.33Å
214	S	84.6	Confident	86	Confident	3 Å²	3	54.6 Å²	54.6	2%	0.021	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-60.3	142.3	170.2	168.9	0	0	0	0	111.7	I216 F217 I220 D315	S214-I216 VanDerWaalsContact C-N 3.32Å; S214-I216 PolarHBondContact OG-N 2.88Å; S214-F217 PolarHBondContact OG-N 2.77Å; S214-F217 VanDerWaalsContact OG-N 3.09Å; S214-I220 PolarHBondContact N-O 2.94Å; S214-D315 WeakPolarHBondContact CB-OD2 3.36Å; S214-D315 PolarHBondContact OG-OD2 2.84Å
215	D	77.6	Confident	86.1	Confident	61 Å²	61	51 Å²	51	33%	0.326	26%	0.26	S	S	.	.	S	Bend	trans	-78.2	-20.6	178.1	-115.9	-27.5	0	0	0	111.8	F57 D315 M320 K325	F57-D215 WeakPolarHBondContact CE1-O 3.32Å; D215-D315 WeakPolarHBondContact CA-OD1 3.49Å; D215-D315 WeakPolarHBondContact CB-OD1 3.29Å; D215-D315 PolarHBondContact N-OD1 3.16Å; D215-M320 HydrophobicContact CB-CB 3.95Å; D215-M320 HydrophobicContact CB-CG 4.03Å; D215-M320 PolarHBondContact OD2-N 2.88Å; D215-K325 VanDerWaalsContact O-CE 3.26Å; D215-K325 WeakPolarHBondContact O-CE 3.38Å; D215-K325 PolarHBondContact O-NZ 3.44Å; D215-K325 IonicContact OD1-NZ 2.65Å; D215-K325 PolarHBondContact OD1-NZ 3.03Å
216	I	79.7	Confident	86.3	Confident	21 Å²	21	54 Å²	54	11%	0.108	28%	0.275	C	S	.	.	S	Bend	trans	-94.5	-43.3	178.4	-70.3	174.7	0	0	0	111.9	S214 I311 D315 M320 F328	S214-I216 VanDerWaalsContact C-N 3.32Å; S214-I216 PolarHBondContact OG-N 2.88Å; I216-I311 HydrophobicContact CD1-CG2 3.82Å; I216-D315 HydrophobicContact CD1-CB 3.67Å; I216-D315 HydrophobicContact CG1-CB 4.19Å; I216-D315 WeakPolarHBondContact CG1-OD1 3.43Å; I216-D315 PolarHBondContact N-OD1 3.02Å; I216-M320 HydrophobicContact CD1-CE 3.88Å; I216-M320 HydrophobicContact CD1-SD 4.23Å; I216-M320 HydrophobicContact CG1-CE 3.83Å; I216-M320 HydrophobicContact CG1-CG 4.41Å; I216-M320 HydrophobicContact CG1-SD 4.48Å; I216-F328 HydrophobicContact CD1-CD2 4.18Å; I216-F328 HydrophobicContact CD1-CE2 4.49Å; I216-F328 HydrophobicContact CD1-CG 4.25Å; I216-F328 HydrophobicContact CG2-CD1 3.44Å; I216-F328 VanDerWaalsContact CG2-CD1 3.44Å; I216-F328 HydrophobicContact CG2-CD2 4.48Å; I216-F328 HydrophobicContact CG2-CE1 3.23Å; I216-F328 HydrophobicContact CG2-CE2 4.31Å; I216-F328 HydrophobicContact CG2-CG 4.09Å; I216-F328 HydrophobicContact CG2-CZ 3.72Å
217	F	82.8	Confident	86.7	Confident	40 Å²	40	57.7 Å²	57.7	18%	0.175	29%	0.291	C	S	.	.	S	Bend	trans	-113.6	112.9	-173.1	-66.4	-70.5	0	0	0	111.8	L142 S214 L219 I220 L225 M312 F328	L142-F217 HydrophobicContact CD1-CD1 4.19Å; L142-F217 HydrophobicContact CD1-CE1 4.22Å; L142-F217 HydrophobicContact CD2-CD1 4.37Å; S214-F217 PolarHBondContact OG-N 2.77Å; S214-F217 VanDerWaalsContact OG-N 3.09Å; F217-L219 PolarHBondContact O-N 2.84Å; F217-I220 HydrophobicContact CB-CB 3.74Å; F217-I220 HydrophobicContact CB-CG1 3.62Å; F217-I220 HydrophobicContact CB-CG2 4.45Å; F217-I220 PolarHBondContact O-N 3.03Å; F217-L225 HydrophobicContact CD2-CD1 4.27Å; F217-L225 HydrophobicContact CE2-CD1 4.29Å; F217-M312 HydrophobicContact CE2-CE 4.05Å; F217-M312 HydrophobicContact CZ-CE 3.94Å; F217-F328 HydrophobicContact CE1-CE1 4.17Å; F217-F328 HydrophobicContact CE1-CZ 4.25Å; F217-F328 HydrophobicContact CE2-CE1 4.48Å; F217-F328 HydrophobicContact CE2-CZ 4.03Å; F217-F328 AromaticContact CZ-CE1 3.87Å; F217-F328 HydrophobicContact CZ-CE1 3.87Å; F217-F328 AromaticContact CZ-CZ 3.52Å; F217-F328 HydrophobicContact CZ-CZ 3.52Å
218	P	80.8	Confident	87.3	Confident	14 Å²	14	51.4 Å²	51.4	9%	0.091	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	140.5	175.9	-19.5	26.4	0	0	0	111.6	F57 F138 I220	F57-P218 HydrophobicContact CB-CG 4.34Å; F57-P218 HydrophobicContact CD1-CG 3.96Å; F57-P218 HydrophobicContact CD2-CB 4.27Å; F57-P218 HydrophobicContact CD2-CG 3.72Å; F57-P218 HydrophobicContact CE1-CG 4.14Å; F57-P218 HydrophobicContact CE2-CB 4.02Å; F57-P218 HydrophobicContact CE2-CG 3.91Å; F57-P218 HydrophobicContact CG-CG 3.74Å; F57-P218 HydrophobicContact CZ-CB 4.24Å; F57-P218 HydrophobicContact CZ-CG 4.12Å; F138-P218 HydrophobicContact CE1-CB 3.85Å; F138-P218 HydrophobicContact CE1-CG 4.04Å; F138-P218 WeakPolarHBondContact CE1-O 3.24Å; F138-P218 HydrophobicContact CZ-CB 4.28Å; F138-P218 HydrophobicContact CZ-CG 3.94Å; P218-I220 PolarHBondContact O-N 2.8Å
219	L	83.3	Confident	87.8	Confident	25 Å²	25	45 Å²	45	13%	0.131	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.4	-6.5	176.6	-71.9	65	0	0	0	115.6	P135 L139 N205 C206 F217	P135-L219 HydrophobicContact CB-CD2 3.59Å; P135-L219 HydrophobicContact CG-CD2 4.32Å; L139-L219 HydrophobicContact CD1-CB 4.47Å; L139-L219 HydrophobicContact CD1-CD2 4.1Å; L139-L219 HydrophobicContact CD2-CB 3.97Å; L139-L219 HydrophobicContact CG-CB 4.41Å; L139-L219 HydrophobicContact CG-CD2 4.2Å; N205-L219 WeakPolarHBondContact CA-O 3.09Å; N205-L219 VanDerWaalsContact CB-O 3.24Å; N205-L219 WeakPolarHBondContact CB-O 3.42Å; C206-L219 PolarHBondContact N-O 3.12Å; C206-L219 VanDerWaalsContact N-O 3.17Å; C206-L219 VanDerWaalsContact SG-C 3.58Å; F217-L219 PolarHBondContact O-N 2.84Å
220	I	88.8	Confident	88.3	Confident	8 Å²	8	42.5 Å²	42.5	4%	0.041	23%	0.231	C	C	.	.	B	Isolated β-bridge	trans	-81.2	131.7	177	-63.3	-55.7	0	0	0	109.7	L139 L142 P200 C213 S214 F217 P218 Y224 L225	L139-I220 HydrophobicContact CD2-CD1 3.87Å; L142-I220 HydrophobicContact CD2-CD1 3.78Å; L142-I220 HydrophobicContact CD2-CG1 3.67Å; P200-I220 HydrophobicContact CB-CD1 3.93Å; P200-I220 HydrophobicContact CG-CD1 3.96Å; C213-I220 CarbonylContact C-O 3.55Å; C213-I220 WeakPolarHBondContact CA-O 3.33Å; S214-I220 PolarHBondContact N-O 2.94Å; F217-I220 HydrophobicContact CB-CB 3.74Å; F217-I220 HydrophobicContact CB-CG1 3.62Å; F217-I220 HydrophobicContact CB-CG2 4.45Å; F217-I220 PolarHBondContact O-N 3.03Å; P218-I220 PolarHBondContact O-N 2.8Å; I220-Y224 HydrophobicContact CD1-CE1 4.43Å; I220-Y224 HydrophobicContact CG2-CD1 3.75Å; I220-Y224 HydrophobicContact CG2-CE1 4.38Å; I220-L225 HydrophobicContact CG2-CB 4.22Å
221	D	90.9	Very high	88.9	Confident	3 Å²	3	35.9 Å²	35.9	2%	0.016	20%	0.203	C	C	.	.	B	Isolated β-bridge	trans	-79.5	140	174.6	170.8	-95.6	0	0	0	111.2	W204 C206 S211 T223 Y224 L225	W204-D221 PolarHBondContact NE1-OD1 3.3Å; C206-D221 HydrophobicContact CB-CB 4.27Å; S211-D221 WeakPolarHBondContact CB-OD2 3.21Å; S211-D221 PolarHBondContact OG-OD2 2.9Å; D221-T223 VanDerWaalsContact C-N 3.27Å; D221-T223 PolarHBondContact O-N 3.29Å; D221-T223 VanDerWaalsContact OD1-CA 3.3Å; D221-T223 WeakPolarHBondContact OD1-CA 3.19Å; D221-T223 WeakPolarHBondContact OD1-CB 3.44Å; D221-T223 PolarHBondContact OD1-N 3.17Å; D221-T223 PolarHBondContact OD1-OG1 2.86Å; D221-Y224 PolarHBondContact O-N 2.99Å; D221-Y224 PolarHBondContact OD1-N 2.03Å; D221-L225 PolarHBondContact O-N 3.33Å
222	E	89.9	Confident	89.4	Confident	48 Å²	48	34 Å²	34	22%	0.224	19%	0.189	C	C	.	.	H	α-helix	trans	-61	-33	-179.3	-71.4	-179.5	173	0	0	113.1	V212 L225 M226	V212-E222 HydrophobicContact CB-CG 4.47Å; V212-E222 HydrophobicContact CG1-CG 4.35Å; V212-E222 WeakPolarHBondContact CG1-OE1 3.29Å; V212-E222 PolarHBondContact O-N 3.39Å; E222-L225 PolarHBondContact O-N 2.98Å; E222-M226 WeakPolarHBondContact O-CB 3.37Å; E222-M226 WeakPolarHBondContact O-CG 3.3Å; E222-M226 PolarHBondContact O-N 3.47Å
223	T	91.8	Very high	90	Very high	69 Å²	69	31.2 Å²	31.2	42%	0.423	17%	0.174	S	C	.	.	H	α-helix	trans	-72	-37	178.7	76.6	0	0	0	0	111.8	W204 D221 M226 F227	W204-T223 PolarHBondContact NE1-OG1 3.23Å; D221-T223 VanDerWaalsContact C-N 3.27Å; D221-T223 PolarHBondContact O-N 3.29Å; D221-T223 VanDerWaalsContact OD1-CA 3.3Å; D221-T223 WeakPolarHBondContact OD1-CA 3.19Å; D221-T223 WeakPolarHBondContact OD1-CB 3.44Å; D221-T223 PolarHBondContact OD1-N 3.17Å; D221-T223 PolarHBondContact OD1-OG1 2.86Å; T223-M226 HydrophobicContact CG2-CE 4.39Å; T223-F227 WeakPolarHBondContact O-CB 3.37Å; T223-F227 PolarHBondContact O-N 3.1Å
224	Y	93.8	Very high	90.5	Very high	9 Å²	9	34.1 Å²	34.1	4%	0.035	19%	0.19	C	C	.	.	H	α-helix	trans	-63.4	-44.2	170.1	171	-92.9	0	0	0	111	I196 L199 P200 W204 I220 D221 F227 W228	I196-Y224 WeakPolarHBondContact O-CE2 3.33Å; I196-Y224 PolarHBondContact O-OH 2.73Å; L199-Y224 HydrophobicContact CB-CD2 4.38Å; L199-Y224 HydrophobicContact CB-CE2 4.09Å; L199-Y224 HydrophobicContact CD1-CE2 4.44Å; P200-Y224 HydrophobicContact CG-CD1 3.97Å; P200-Y224 HydrophobicContact CG-CD2 4Å; P200-Y224 HydrophobicContact CG-CE1 3.62Å; P200-Y224 HydrophobicContact CG-CE2 3.68Å; P200-Y224 HydrophobicContact CG-CG 4.13Å; P200-Y224 VanDerWaalsContact CG-CZ 3.46Å; W204-Y224 HydrophobicContact CD2-CD2 4.42Å; I220-Y224 HydrophobicContact CD1-CE1 4.43Å; I220-Y224 HydrophobicContact CG2-CD1 3.75Å; I220-Y224 HydrophobicContact CG2-CE1 4.38Å; D221-Y224 PolarHBondContact O-N 2.99Å; D221-Y224 PolarHBondContact OD1-N 2.03Å; Y224-F227 WeakPolarHBondContact O-CB 3.48Å; Y224-F227 PolarHBondContact O-N 3.02Å; Y224-W228 PolarHBondContact O-N 2.97Å
225	L	93.4	Very high	91.1	Very high	6 Å²	6	35.7 Å²	35.7	3%	0.031	20%	0.198	C	C	.	.	H	α-helix	trans	-60.3	-47.5	177.8	-178.7	59.6	0	0	0	111	F217 I220 D221 E222 F227 W228 I229 D315 V316	F217-L225 HydrophobicContact CD2-CD1 4.27Å; F217-L225 HydrophobicContact CE2-CD1 4.29Å; I220-L225 HydrophobicContact CG2-CB 4.22Å; D221-L225 PolarHBondContact O-N 3.33Å; E222-L225 PolarHBondContact O-N 2.98Å; L225-F227 PolarHBondContact O-N 3.38Å; L225-W228 PolarHBondContact O-N 2.92Å; L225-I229 HydrophobicContact CD1-CD1 4.09Å; L225-I229 HydrophobicContact CD1-CG1 4.28Å; L225-I229 HydrophobicContact CG-CD1 3.85Å; L225-I229 HydrophobicContact CG-CG1 4.49Å; L225-I229 WeakPolarHBondContact O-CB 3.22Å; L225-I229 WeakPolarHBondContact O-CG1 3.28Å; L225-I229 PolarHBondContact O-N 2.94Å; L225-D315 WeakPolarHBondContact CD2-OD2 3.23Å; L225-V316 HydrophobicContact CD2-CG2 3.98Å; L225-V316 HydrophobicContact CG-CG2 4.24Å
226	M	93.9	Very high	92	Very high	81 Å²	81	33.6 Å²	33.6	40%	0.399	19%	0.187	S	C	.	.	H	α-helix	trans	-57.6	-44.8	173.6	-81.1	-164.8	-79.5	0	0	112.9	E222 T223 W228 I229 G230 V316	E222-M226 WeakPolarHBondContact O-CB 3.37Å; E222-M226 WeakPolarHBondContact O-CG 3.3Å; E222-M226 PolarHBondContact O-N 3.47Å; T223-M226 HydrophobicContact CG2-CE 4.39Å; M226-W228 PolarHBondContact O-N 3.48Å; M226-I229 PolarHBondContact O-N 3.45Å; M226-G230 PolarHBondContact O-N 3.3Å; M226-V316 HydrophobicContact CE-CG1 4.14Å; M226-V316 HydrophobicContact CG-CB 4.23Å; M226-V316 HydrophobicContact CG-CG1 3.4Å; M226-V316 VanDerWaalsContact CG-CG1 3.4Å; M226-V316 HydrophobicContact CG-CG2 3.84Å; M226-V316 HydrophobicContact SD-CG1 3.51Å; M226-V316 VanDerWaalsContact SD-CG1 3.51Å
227	F	95.7	Very high	92.8	Very high	82 Å²	82	38.5 Å²	38.5	36%	0.36	21%	0.212	S	C	.	.	H	α-helix	trans	-59	-48.1	177.2	169.1	-103.5	0	0	0	111.2	I196 T223 Y224 L225 G230 V231	I196-F227 HydrophobicContact CD1-CE1 4.49Å; I196-F227 HydrophobicContact CG1-CE1 4.24Å; I196-F227 HydrophobicContact CG2-CE1 4.09Å; T223-F227 WeakPolarHBondContact O-CB 3.37Å; T223-F227 PolarHBondContact O-N 3.1Å; Y224-F227 WeakPolarHBondContact O-CB 3.48Å; Y224-F227 PolarHBondContact O-N 3.02Å; L225-F227 PolarHBondContact O-N 3.38Å; F227-G230 PolarHBondContact O-N 3.42Å; F227-V231 HydrophobicContact CD2-CG2 4.24Å; F227-V231 HydrophobicContact CE1-CG2 4.32Å; F227-V231 HydrophobicContact CE2-CG2 3.81Å; F227-V231 HydrophobicContact CZ-CG2 3.86Å; F227-V231 WeakPolarHBondContact O-CG2 3.42Å; F227-V231 PolarHBondContact O-N 3.36Å
228	W	96.1	Very high	93.4	Very high	22 Å²	22	40 Å²	40	8%	0.083	22%	0.219	C	C	.	.	H	α-helix	trans	-64.9	-43.3	179.8	-175.2	90.1	0	0	0	112.6	T146 T150 Y224 L225 M226 G230 V231 T232 W305 L309 M312	T146-W228 VanDerWaalsContact CG2-NE1 3.3Å; T150-W228 PolarHBondContact OG1-NE1 3.31Å; Y224-W228 PolarHBondContact O-N 2.97Å; L225-W228 PolarHBondContact O-N 2.92Å; M226-W228 PolarHBondContact O-N 3.48Å; W228-G230 VanDerWaalsContact C-N 3.34Å; W228-G230 PolarHBondContact O-N 3Å; W228-V231 PolarHBondContact O-N 3.46Å; W228-T232 WeakPolarHBondContact O-CB 3.31Å; W228-T232 PolarHBondContact O-N 2.89Å; W228-T232 PolarHBondContact O-OG1 3.35Å; W228-W305 HydrophobicContact CH2-CZ3 4.06Å; W228-L309 HydrophobicContact CZ3-CD2 4.31Å; W228-M312 HydrophobicContact CE3-SD 4.4Å; W228-M312 HydrophobicContact CZ3-CE 4.3Å; W228-M312 HydrophobicContact CZ3-SD 3.69Å
229	I	95.6	Very high	94.1	Very high	11 Å²	11	39.4 Å²	39.4	6%	0.056	22%	0.215	C	C	.	.	H	α-helix	trans	-59	-46.6	174.3	-69.3	165.5	0	0	0	110.2	L225 M226 T232 S233 L309 M312 V313 V316	L225-I229 HydrophobicContact CD1-CD1 4.09Å; L225-I229 HydrophobicContact CD1-CG1 4.28Å; L225-I229 HydrophobicContact CG-CD1 3.85Å; L225-I229 HydrophobicContact CG-CG1 4.49Å; L225-I229 WeakPolarHBondContact O-CB 3.22Å; L225-I229 WeakPolarHBondContact O-CG1 3.28Å; L225-I229 PolarHBondContact O-N 2.94Å; M226-I229 PolarHBondContact O-N 3.45Å; I229-T232 PolarHBondContact O-N 3.46Å; I229-S233 VanDerWaalsContact O-CB 3.23Å; I229-S233 WeakPolarHBondContact O-CB 3.37Å; I229-S233 PolarHBondContact O-N 2.98Å; I229-S233 PolarHBondContact O-OG 3.46Å; I229-L309 HydrophobicContact CG2-CD2 4.44Å; I229-M312 HydrophobicContact CD1-CB 3.68Å; I229-M312 HydrophobicContact CG1-CB 4.11Å; I229-V313 HydrophobicContact CD1-CG2 4.33Å; I229-V313 HydrophobicContact CG2-CG2 3.7Å; I229-V316 HydrophobicContact CD1-CG2 4.4Å
230	G	96.5	Very high	94.7	Very high	34 Å²	34	40.3 Å²	40.3	35%	0.351	22%	0.222	S	C	.	.	H	α-helix	trans	-61	-49.9	-179.7	0	0	0	0	0	112.2	M226 F227 W228 T232 S233 V234	M226-G230 PolarHBondContact O-N 3.3Å; F227-G230 PolarHBondContact O-N 3.42Å; W228-G230 VanDerWaalsContact C-N 3.34Å; W228-G230 PolarHBondContact O-N 3Å; G230-T232 PolarHBondContact O-N 3.4Å; G230-S233 PolarHBondContact O-N 3.43Å; G230-V234 VanDerWaalsContact O-CG2 3.3Å; G230-V234 WeakPolarHBondContact O-CG2 3.23Å; G230-V234 PolarHBondContact O-N 3.03Å
231	V	96.3	Very high	95	Very high	45 Å²	45	46 Å²	46	27%	0.273	24%	0.243	S	C	.	.	H	α-helix	trans	-58.3	-49.1	176.8	170.9	0	0	0	0	110.7	F227 W228 S233 V234 L235	F227-V231 HydrophobicContact CD2-CG2 4.24Å; F227-V231 HydrophobicContact CE1-CG2 4.32Å; F227-V231 HydrophobicContact CE2-CG2 3.81Å; F227-V231 HydrophobicContact CZ-CG2 3.86Å; F227-V231 WeakPolarHBondContact O-CG2 3.42Å; F227-V231 PolarHBondContact O-N 3.36Å; W228-V231 PolarHBondContact O-N 3.46Å; V231-S233 PolarHBondContact O-N 3.32Å; V231-V234 PolarHBondContact O-N 3.37Å; V231-L235 HydrophobicContact CG1-CD1 4.31Å; V231-L235 WeakPolarHBondContact O-CG 3.07Å; V231-L235 PolarHBondContact O-N 3.2Å; V231-L235 VanDerWaalsContact O-N 3.13Å
232	T	96.3	Very high	95.1	Very high	2 Å²	2	45.9 Å²	45.9	1%	0.012	24%	0.243	C	C	.	.	H	α-helix	trans	-62.8	-43.9	-179.3	-57.8	0	0	0	0	111.7	V153 W228 I229 G230 V234 L235 L236 W305 L309	V153-T232 HydrophobicContact CG2-CG2 4.43Å; W228-T232 WeakPolarHBondContact O-CB 3.31Å; W228-T232 PolarHBondContact O-N 2.89Å; W228-T232 PolarHBondContact O-OG1 3.35Å; I229-T232 PolarHBondContact O-N 3.46Å; G230-T232 PolarHBondContact O-N 3.4Å; T232-V234 PolarHBondContact O-N 3.45Å; T232-L235 PolarHBondContact O-N 3.28Å; T232-L236 HydrophobicContact CG2-CD1 3.98Å; T232-L236 HydrophobicContact CG2-CG 4.42Å; T232-L236 WeakPolarHBondContact O-CG 3.25Å; T232-L236 PolarHBondContact O-N 3.4Å; T232-W305 HydrophobicContact CG2-CE3 4.01Å; T232-W305 HydrophobicContact CG2-CH2 4.41Å; T232-W305 HydrophobicContact CG2-CZ3 3.71Å; T232-L309 HydrophobicContact CG2-CD2 4.33Å
233	S	96	Very high	95.2	Very high	34 Å²	34	44.1 Å²	44.1	24%	0.238	23%	0.234	C	C	.	.	H	α-helix	trans	-62.9	-42.5	178.8	-60.2	0	0	0	0	112	I229 G230 V231 L235 L236 L237	I229-S233 VanDerWaalsContact O-CB 3.23Å; I229-S233 WeakPolarHBondContact O-CB 3.37Å; I229-S233 PolarHBondContact O-N 2.98Å; I229-S233 PolarHBondContact O-OG 3.46Å; G230-S233 PolarHBondContact O-N 3.43Å; V231-S233 PolarHBondContact O-N 3.32Å; S233-L235 VanDerWaalsContact C-N 3.34Å; S233-L235 PolarHBondContact O-N 3.33Å; S233-L236 PolarHBondContact O-N 2.94Å; S233-L237 WeakPolarHBondContact O-CB 3.4Å; S233-L237 VanDerWaalsContact O-CG 3.24Å; S233-L237 WeakPolarHBondContact O-CG 3.47Å; S233-L237 PolarHBondContact O-N 3.49Å
234	V	97.1	Very high	95.2	Very high	99 Å²	99	45.9 Å²	45.9	60%	0.6	24%	0.239	S	C	*	.	H	α-helix	trans	-61.1	-43.6	176.1	169.2	0	0	0	0	111.2	G230 V231 T232 F238	G230-V234 VanDerWaalsContact O-CG2 3.3Å; G230-V234 WeakPolarHBondContact O-CG2 3.23Å; G230-V234 PolarHBondContact O-N 3.03Å; V231-V234 PolarHBondContact O-N 3.37Å; T232-V234 PolarHBondContact O-N 3.45Å; V234-F238 PolarHBondContact O-N 2.89Å; V234-F238 VanDerWaalsContact O-N 3.08Å
235	L	96.6	Very high	95.1	Very high	36 Å²	36	47.3 Å²	47.3	19%	0.188	24%	0.244	C	C	.	.	H	α-helix	trans	-63.2	-46.1	177	-66.9	175.4	0	0	0	111.7	V153 F157 V231 T232 S233 F238 I239	V153-L235 HydrophobicContact CG1-CB 3.93Å; V153-L235 HydrophobicContact CG1-CD1 4.16Å; F157-L235 HydrophobicContact CB-CD2 4.42Å; F157-L235 HydrophobicContact CD1-CD2 4.06Å; F157-L235 HydrophobicContact CD2-CD2 3.82Å; F157-L235 HydrophobicContact CE1-CD2 4.2Å; F157-L235 HydrophobicContact CE2-CD2 3.95Å; F157-L235 HydrophobicContact CG-CD2 3.86Å; F157-L235 HydrophobicContact CZ-CD2 4.14Å; V231-L235 HydrophobicContact CG1-CD1 4.31Å; V231-L235 WeakPolarHBondContact O-CG 3.07Å; V231-L235 PolarHBondContact O-N 3.2Å; V231-L235 VanDerWaalsContact O-N 3.13Å; T232-L235 PolarHBondContact O-N 3.28Å; S233-L235 VanDerWaalsContact C-N 3.34Å; S233-L235 PolarHBondContact O-N 3.33Å; L235-F238 PolarHBondContact O-N 2.99Å; L235-I239 VanDerWaalsContact O-CG1 3.3Å; L235-I239 WeakPolarHBondContact O-CG1 2.97Å; L235-I239 PolarHBondContact O-N 3.41Å
236	L	96.5	Very high	94.9	Very high	16 Å²	16	47.1 Å²	47.1	8%	0.084	24%	0.243	C	C	.	.	H	α-helix	trans	-64.8	-42.9	179.1	-69.9	173	0	0	0	112.3	V153 T232 S233 F238 I239 V240 L301 W305 L309	V153-L236 HydrophobicContact CG1-CD2 4.12Å; V153-L236 HydrophobicContact CG1-CG 4.31Å; T232-L236 HydrophobicContact CG2-CD1 3.98Å; T232-L236 HydrophobicContact CG2-CG 4.42Å; T232-L236 WeakPolarHBondContact O-CG 3.25Å; T232-L236 PolarHBondContact O-N 3.4Å; S233-L236 PolarHBondContact O-N 2.94Å; L236-F238 VanDerWaalsContact C-N 3.29Å; L236-F238 PolarHBondContact O-N 3.03Å; L236-I239 HydrophobicContact CD2-CD1 4.29Å; L236-I239 WeakPolarHBondContact O-CB 3.14Å; L236-I239 PolarHBondContact O-N 3.48Å; L236-I239 VanDerWaalsContact O-N 3.14Å; L236-V240 WeakPolarHBondContact O-CG2 3.29Å; L236-V240 PolarHBondContact O-N 3.16Å; L236-L301 HydrophobicContact CD2-CD1 3.63Å; L236-L301 HydrophobicContact CD2-CD2 4.05Å; L236-L301 HydrophobicContact CD2-CG 3.95Å; L236-W305 HydrophobicContact CD1-CB 3.78Å; L236-W305 HydrophobicContact CD1-CD2 3.97Å; L236-W305 HydrophobicContact CD1-CE3 4.06Å; L236-W305 HydrophobicContact CD1-CG 3.85Å; L236-W305 HydrophobicContact CD2-CD2 4.48Å; L236-W305 HydrophobicContact CD2-CG 4.22Å; L236-L309 HydrophobicContact CD1-CD1 3.54Å
237	L	96.3	Very high	94.7	Very high	124 Å²	124	44.8 Å²	44.8	65%	0.649	23%	0.232	S	C	*	.	H	α-helix	trans	-60.3	-40.7	175.5	-74.3	172.9	0	0	0	111.5	S233 V240 Y241	S233-L237 WeakPolarHBondContact O-CB 3.4Å; S233-L237 VanDerWaalsContact O-CG 3.24Å; S233-L237 WeakPolarHBondContact O-CG 3.47Å; S233-L237 PolarHBondContact O-N 3.49Å; L237-V240 PolarHBondContact O-N 2.88Å; L237-Y241 WeakPolarHBondContact O-CB 3.33Å; L237-Y241 PolarHBondContact O-N 2.94Å
238	F	95.8	Very high	94.3	Very high	71 Å²	71	49.2 Å²	49.2	31%	0.311	25%	0.247	S	C	.	.	H	α-helix	trans	-64.3	-42.7	174.1	-176.7	-83.8	0	0	0	112	F157 I161 V234 L235 L236 V240 Y241 A242	F157-F238 HydrophobicContact CD2-CB 4.23Å; F157-F238 AromaticContact CD2-CD1 3.54Å; F157-F238 HydrophobicContact CD2-CD1 3.54Å; F157-F238 HydrophobicContact CD2-CE1 4.22Å; F157-F238 HydrophobicContact CD2-CG 4.13Å; F157-F238 HydrophobicContact CE2-CB 3.85Å; F157-F238 AromaticContact CE2-CD1 3.17Å; F157-F238 HydrophobicContact CE2-CD1 3.17Å; F157-F238 HydrophobicContact CE2-CD2 4.28Å; F157-F238 AromaticContact CE2-CE1 3.71Å; F157-F238 HydrophobicContact CE2-CE1 3.71Å; F157-F238 AromaticContact CE2-CG 3.5Å; F157-F238 HydrophobicContact CE2-CG 3.5Å; F157-F238 HydrophobicContact CE2-CZ 4.45Å; F157-F238 HydrophobicContact CZ-CD1 4.21Å; F157-F238 HydrophobicContact CZ-CE1 4.39Å; I161-F238 HydrophobicContact CD1-CE1 4.35Å; I161-F238 HydrophobicContact CG1-CE1 3.61Å; I161-F238 HydrophobicContact CG1-CZ 4.07Å; V234-F238 PolarHBondContact O-N 2.89Å; V234-F238 VanDerWaalsContact O-N 3.08Å; L235-F238 PolarHBondContact O-N 2.99Å; L236-F238 VanDerWaalsContact C-N 3.29Å; L236-F238 PolarHBondContact O-N 3.03Å; F238-V240 VanDerWaalsContact C-N 3.33Å; F238-V240 PolarHBondContact O-N 2.92Å; F238-Y241 PolarHBondContact O-N 3Å; F238-A242 HydrophobicContact CD1-CB 4.44Å; F238-A242 HydrophobicContact CE1-CB 4.18Å; F238-A242 WeakPolarHBondContact O-CB 3.43Å; F238-A242 PolarHBondContact O-N 2.86Å
239	I	96	Very high	93.9	Very high	3 Å²	3	52 Å²	52	2%	0.015	26%	0.26	C	S	.	.	H	α-helix	trans	-57.7	-48.7	176.2	-70	162.3	0	0	0	110.1	V153 L156 F157 A160 L235 L236 A242 Y243 L301	V153-I239 HydrophobicContact CG1-CD1 4.46Å; L156-I239 HydrophobicContact CB-CD1 3.93Å; F157-I239 HydrophobicContact CB-CD1 4.03Å; F157-I239 HydrophobicContact CB-CG1 4.13Å; F157-I239 HydrophobicContact CD2-CG1 4.34Å; A160-I239 HydrophobicContact CB-CB 4.41Å; A160-I239 HydrophobicContact CB-CG1 4.06Å; A160-I239 HydrophobicContact CB-CG2 4.28Å; L235-I239 VanDerWaalsContact O-CG1 3.3Å; L235-I239 WeakPolarHBondContact O-CG1 2.97Å; L235-I239 PolarHBondContact O-N 3.41Å; L236-I239 HydrophobicContact CD2-CD1 4.29Å; L236-I239 WeakPolarHBondContact O-CB 3.14Å; L236-I239 PolarHBondContact O-N 3.48Å; L236-I239 VanDerWaalsContact O-N 3.14Å; I239-A242 PolarHBondContact O-N 2.85Å; I239-Y243 HydrophobicContact CG2-CD2 3.59Å; I239-Y243 HydrophobicContact CG2-CE2 3.58Å; I239-Y243 VanDerWaalsContact O-CD2 3.25Å; I239-Y243 WeakPolarHBondContact O-CD2 3.47Å; I239-Y243 PolarHBondContact O-N 3.03Å; I239-L301 HydrophobicContact CB-CD2 4.25Å; I239-L301 HydrophobicContact CG2-CD2 3.63Å
240	V	95.6	Very high	93.3	Very high	43 Å²	43	52.9 Å²	52.9	26%	0.261	27%	0.269	S	S	.	.	H	α-helix	trans	-58.9	-50.1	177.2	173.5	0	0	0	0	110.5	L236 L237 F238 A242 Y243 M244 L298 L301	L236-V240 WeakPolarHBondContact O-CG2 3.29Å; L236-V240 PolarHBondContact O-N 3.16Å; L237-V240 PolarHBondContact O-N 2.88Å; F238-V240 VanDerWaalsContact C-N 3.33Å; F238-V240 PolarHBondContact O-N 2.92Å; V240-A242 PolarHBondContact O-N 2.84Å; V240-Y243 PolarHBondContact O-N 3.09Å; V240-M244 HydrophobicContact CG1-CG 4.17Å; V240-M244 WeakPolarHBondContact O-CB 3.47Å; V240-M244 WeakPolarHBondContact O-CG 3.38Å; V240-M244 PolarHBondContact O-N 3.35Å; V240-L298 HydrophobicContact CB-CD2 4.31Å; V240-L298 HydrophobicContact CG1-CD2 4.37Å; V240-L298 HydrophobicContact CG2-CD2 4.09Å; V240-L301 HydrophobicContact CG2-CD2 4.19Å
241	Y	95	Very high	92.7	Very high	128 Å²	128	57.4 Å²	57.4	50%	0.502	28%	0.28	S	S	.	.	H	α-helix	trans	-55.5	-48	176.8	167.7	-97.2	0	0	0	112.3	L237 F238 Y243 M244 Y245	L237-Y241 WeakPolarHBondContact O-CB 3.33Å; L237-Y241 PolarHBondContact O-N 2.94Å; F238-Y241 PolarHBondContact O-N 3Å; Y241-Y243 PolarHBondContact O-N 3.2Å; Y241-M244 PolarHBondContact O-N 2.97Å; Y241-Y245 WeakPolarHBondContact O-CB 3.42Å; Y241-Y245 PolarHBondContact O-N 3.27Å
242	A	93.6	Very high	92.1	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-61.6	-45.5	-178.5	0	0	0	0	0	111.5	A160 Y164 F238 I239 V240 Y245 I246	A160-A242 HydrophobicContact CB-CB 4.22Å; Y164-A242 HydrophobicContact CD2-CB 4.44Å; F238-A242 HydrophobicContact CD1-CB 4.44Å; F238-A242 HydrophobicContact CE1-CB 4.18Å; F238-A242 WeakPolarHBondContact O-CB 3.43Å; F238-A242 PolarHBondContact O-N 2.86Å; I239-A242 PolarHBondContact O-N 2.85Å; V240-A242 PolarHBondContact O-N 2.84Å; A242-Y245 PolarHBondContact O-N 3.46Å; A242-I246 WeakPolarHBondContact O-CB 3.47Å; A242-I246 WeakPolarHBondContact O-CD1 3.47Å; A242-I246 WeakPolarHBondContact O-CG1 3.29Å; A242-I246 PolarHBondContact O-N 3.27Å
243	Y	92.4	Very high	91.3	Very high	11 Å²	11	60.8 Å²	60.8	4%	0.043	30%	0.296	C	S	.	.	H	α-helix	trans	-69.7	-38.1	177.9	-78.4	-60.5	0	0	0	113.1	A160 I239 V240 Y241 Y245 I246 L247 L294 I297 L298	A160-Y243 HydrophobicContact CB-CE2 4.11Å; I239-Y243 HydrophobicContact CG2-CD2 3.59Å; I239-Y243 HydrophobicContact CG2-CE2 3.58Å; I239-Y243 VanDerWaalsContact O-CD2 3.25Å; I239-Y243 WeakPolarHBondContact O-CD2 3.47Å; I239-Y243 PolarHBondContact O-N 3.03Å; V240-Y243 PolarHBondContact O-N 3.09Å; Y241-Y243 PolarHBondContact O-N 3.2Å; Y243-Y245 VanDerWaalsContact C-N 3.34Å; Y243-I246 HydrophobicContact CD1-CD1 4.05Å; Y243-I246 HydrophobicContact CE1-CD1 4.47Å; Y243-I246 WeakPolarHBondContact O-CB 3.34Å; Y243-I246 PolarHBondContact O-N 2.97Å; Y243-L247 WeakPolarHBondContact O-CG 3.12Å; Y243-L247 PolarHBondContact O-N 3.28Å; Y243-L294 HydrophobicContact CD1-CB 4.43Å; Y243-L294 HydrophobicContact CD1-CD2 3.53Å; Y243-L294 HydrophobicContact CD1-CG 4.4Å; Y243-L294 HydrophobicContact CE1-CD2 3.38Å; Y243-I297 HydrophobicContact CE2-CG2 4.16Å; Y243-L298 HydrophobicContact CD2-CD2 4.17Å; Y243-L298 HydrophobicContact CG-CD2 4.35Å; Y243-L298 HydrophobicContact CG-CG 4.48Å
244	M	91.6	Very high	90.6	Very high	106 Å²	106	60.1 Å²	60.1	52%	0.522	29%	0.292	S	S	.	.	H	α-helix	trans	-62.7	-42	172.9	-70.2	-61.3	-74.1	0	0	111.5	V240 Y241 L247 W248 L298	V240-M244 HydrophobicContact CG1-CG 4.17Å; V240-M244 WeakPolarHBondContact O-CB 3.47Å; V240-M244 WeakPolarHBondContact O-CG 3.38Å; V240-M244 PolarHBondContact O-N 3.35Å; Y241-M244 PolarHBondContact O-N 2.97Å; M244-L247 PolarHBondContact O-N 2.56Å; M244-L247 HydrophobicContact SD-CD1 4.4Å; M244-W248 WeakPolarHBondContact O-CB 3Å; M244-W248 PolarHBondContact O-N 3.27Å; M244-L298 HydrophobicContact CG-CD1 4.4Å; M244-L298 HydrophobicContact SD-CD1 3.93Å
245	Y	91.4	Very high	89.8	Confident	39 Å²	39	58 Å²	58	15%	0.153	28%	0.279	C	S	.	.	H	α-helix	trans	-61.3	-43.8	173.4	179.2	-91.6	0	0	0	111.9	Y164 H168 Y241 A242 Y243 W248 K249	Y164-Y245 AromaticContact CD2-CD1 3.68Å; Y164-Y245 HydrophobicContact CD2-CD1 3.68Å; Y164-Y245 HydrophobicContact CD2-CE1 4.21Å; Y164-Y245 HydrophobicContact CD2-CG 4.35Å; Y164-Y245 AromaticContact CE2-CD1 3.35Å; Y164-Y245 HydrophobicContact CE2-CD1 3.35Å; Y164-Y245 AromaticContact CE2-CE1 3.65Å; Y164-Y245 HydrophobicContact CE2-CE1 3.65Å; Y164-Y245 AromaticContact CE2-CG 3.85Å; Y164-Y245 HydrophobicContact CE2-CG 3.85Å; H168-Y245 HydrophobicContact CB-CE1 4.31Å; H168-Y245 AromaticContact ND1-CE1 3.9Å; H168-Y245 AromaticContact ND1-CZ 3.7Å; H168-Y245 PolarHBondContact ND1-OH 3.43Å; Y241-Y245 WeakPolarHBondContact O-CB 3.42Å; Y241-Y245 PolarHBondContact O-N 3.27Å; A242-Y245 PolarHBondContact O-N 3.46Å; Y243-Y245 VanDerWaalsContact C-N 3.34Å; Y245-W248 HydrophobicContact CD2-CE3 4.38Å; Y245-W248 PolarHBondContact O-N 3.49Å; Y245-K249 HydrophobicContact CE1-CB 4.45Å; Y245-K249 WeakPolarHBondContact O-CB 3.31Å; Y245-K249 PolarHBondContact O-N 3.24Å
246	I	89.6	Confident	89	Confident	2 Å²	2	63.2 Å²	63.2	1%	0.01	30%	0.296	C	S	.	.	H	α-helix	trans	-58.6	-48.9	176.3	-73.8	163.4	0	0	0	110.7	R163 I167 A242 Y243 W248 K249 A250 L294	R163-I246 HydrophobicContact CB-CD1 3.71Å; I167-I246 HydrophobicContact CD1-CB 4.23Å; I167-I246 HydrophobicContact CD1-CG1 4.04Å; I167-I246 HydrophobicContact CD1-CG2 3.35Å; A242-I246 WeakPolarHBondContact O-CB 3.47Å; A242-I246 WeakPolarHBondContact O-CD1 3.47Å; A242-I246 WeakPolarHBondContact O-CG1 3.29Å; A242-I246 PolarHBondContact O-N 3.27Å; Y243-I246 HydrophobicContact CD1-CD1 4.05Å; Y243-I246 HydrophobicContact CE1-CD1 4.47Å; Y243-I246 WeakPolarHBondContact O-CB 3.34Å; Y243-I246 PolarHBondContact O-N 2.97Å; I246-W248 PolarHBondContact O-N 3.11Å; I246-K249 PolarHBondContact O-N 3Å; I246-A250 WeakPolarHBondContact O-CB 3.41Å; I246-A250 PolarHBondContact O-N 3.36Å; I246-L294 HydrophobicContact CG2-CD1 3.5Å
247	L	88.2	Confident	88	Confident	32 Å²	32	66.1 Å²	66.1	17%	0.168	31%	0.31	C	S	.	.	H	α-helix	trans	-60.1	-46.1	178.1	-74	172.1	0	0	0	111.3	Y243 M244 K249 A250 H251 A291 L294 V295 L298	Y243-L247 WeakPolarHBondContact O-CG 3.12Å; Y243-L247 PolarHBondContact O-N 3.28Å; M244-L247 PolarHBondContact O-N 2.56Å; M244-L247 HydrophobicContact SD-CD1 4.4Å; L247-K249 PolarHBondContact O-N 2.68Å; L247-A250 PolarHBondContact O-N 2.88Å; L247-H251 VanDerWaalsContact O-CB 3.32Å; L247-H251 WeakPolarHBondContact O-CB 3.49Å; L247-H251 PolarHBondContact O-N 2.99Å; L247-A291 HydrophobicContact CD2-CB 3.76Å; L247-L294 HydrophobicContact CD2-CB 4.09Å; L247-L294 HydrophobicContact CD2-CD1 4.07Å; L247-L294 HydrophobicContact CG-CB 4.42Å; L247-L294 HydrophobicContact CG-CD1 4.47Å; L247-V295 HydrophobicContact CD1-CG2 3.9Å; L247-V295 HydrophobicContact CD2-CG2 4.37Å; L247-L298 HydrophobicContact CD1-CD1 4.05Å
248	W	88.8	Confident	87	Confident	176 Å²	176	65.2 Å²	65.2	67%	0.667	31%	0.305	S	S	*	.	H	α-helix	trans	-62.1	-42.8	177.7	178.2	31.3	0	0	0	112.2	M244 Y245 I246 H251 S252	M244-W248 WeakPolarHBondContact O-CB 3Å; M244-W248 PolarHBondContact O-N 3.27Å; Y245-W248 HydrophobicContact CD2-CE3 4.38Å; Y245-W248 PolarHBondContact O-N 3.49Å; I246-W248 PolarHBondContact O-N 3.11Å; W248-H251 PolarHBondContact O-N 2.86Å; W248-S252 PolarHBondContact NE1-OG 3.34Å; W248-S252 VanDerWaalsContact O-CB 3.3Å; W248-S252 WeakPolarHBondContact O-CB 3.48Å; W248-S252 PolarHBondContact O-N 2.66Å; W248-S252 PolarHBondContact O-OG 2.67Å
249	K	86.4	Confident	85.9	Confident	81 Å²	81	67.8 Å²	67.8	35%	0.352	32%	0.318	S	S	.	.	H	α-helix	trans	-66.7	-43.4	179	-170.2	67.3	174.2	-168.2	0	111.8	I167 Y245 I246 L247 S252 H253	I167-K249 HydrophobicContact CG2-CB 4.14Å; I167-K249 HydrophobicContact CG2-CG 3.91Å; Y245-K249 HydrophobicContact CE1-CB 4.45Å; Y245-K249 WeakPolarHBondContact O-CB 3.31Å; Y245-K249 PolarHBondContact O-N 3.24Å; I246-K249 PolarHBondContact O-N 3Å; L247-K249 PolarHBondContact O-N 2.68Å; K249-S252 PolarHBondContact O-N 2.91Å; K249-H253 WeakPolarHBondContact O-CB 3.18Å; K249-H253 PolarHBondContact O-N 3.33Å
250	A	82.5	Confident	84.6	Confident	29 Å²	29	76.5 Å²	76.5	24%	0.24	35%	0.351	C	S	.	.	H	α-helix	trans	-61.4	-47.8	176	0	0	0	0	0	110.9	I246 L247 S252 H253 A254	I246-A250 WeakPolarHBondContact O-CB 3.41Å; I246-A250 PolarHBondContact O-N 3.36Å; L247-A250 PolarHBondContact O-N 2.88Å; A250-S252 PolarHBondContact O-N 3.32Å; A250-H253 PolarHBondContact O-N 3.38Å; A250-A254 WeakPolarHBondContact O-CB 3.33Å; A250-A254 PolarHBondContact O-N 3.07Å
251	H	84	Confident	83	Confident	128 Å²	128	76.1 Å²	76.1	59%	0.593	36%	0.356	S	S	*	.	H	α-helix	trans	-60.1	-47.1	176	-176.4	-95.2	0	0	0	111.9	L247 W248 H253 A254 V255	L247-H251 VanDerWaalsContact O-CB 3.32Å; L247-H251 WeakPolarHBondContact O-CB 3.49Å; L247-H251 PolarHBondContact O-N 2.99Å; W248-H251 PolarHBondContact O-N 2.86Å; H251-H253 VanDerWaalsContact C-N 3.27Å; H251-H253 PolarHBondContact O-N 2.85Å; H251-A254 PolarHBondContact O-N 3.41Å; H251-V255 WeakPolarHBondContact O-CG2 3.28Å; H251-V255 PolarHBondContact O-N 3.47Å
252	S	84	Confident	81	Confident	26 Å²	26	74.6 Å²	74.6	18%	0.182	36%	0.36	C	S	.	.	H	α-helix	trans	-60.4	-38	178.1	-61	0	0	0	0	112.2	W248 K249 A250 R256	W248-S252 PolarHBondContact NE1-OG 3.34Å; W248-S252 VanDerWaalsContact O-CB 3.3Å; W248-S252 WeakPolarHBondContact O-CB 3.48Å; W248-S252 PolarHBondContact O-N 2.66Å; W248-S252 PolarHBondContact O-OG 2.67Å; K249-S252 PolarHBondContact O-N 2.91Å; A250-S252 PolarHBondContact O-N 3.32Å; S252-R256 VanDerWaalsContact O-CG 3.22Å; S252-R256 WeakPolarHBondContact O-CG 3.25Å; S252-R256 PolarHBondContact O-N 2.92Å; S252-R256 VanDerWaalsContact O-N 3.14Å
253	H	80.5	Confident	78.9	Confident	93 Å²	93	82.8 Å²	82.8	43%	0.431	40%	0.398	S	S	.	.	H	α-helix	trans	-68.1	-45.1	175.5	-175.9	-94	0	0	0	111.6	K249 A250 H251 V255 R256 M257	K249-H253 WeakPolarHBondContact O-CB 3.18Å; K249-H253 PolarHBondContact O-N 3.33Å; A250-H253 PolarHBondContact O-N 3.38Å; H251-H253 VanDerWaalsContact C-N 3.27Å; H251-H253 PolarHBondContact O-N 2.85Å; H253-V255 PolarHBondContact O-N 2.85Å; H253-R256 PolarHBondContact O-N 3.34Å; H253-M257 VanDerWaalsContact CE1-CG 3.47Å; H253-M257 WeakPolarHBondContact CE1-CG 3.03Å; H253-M257 WeakPolarHBondContact O-CB 3.3Å; H253-M257 WeakPolarHBondContact O-CG 3.44Å; H253-M257 PolarHBondContact O-N 3.47Å
254	A	79.9	Confident	76.7	Confident	20 Å²	20	91 Å²	91	17%	0.165	43%	0.434	C	S	.	.	H	α-helix	trans	-59.5	-44.9	177	0	0	0	0	0	111.9	A250 H251 M257 I258	A250-A254 WeakPolarHBondContact O-CB 3.33Å; A250-A254 PolarHBondContact O-N 3.07Å; H251-A254 PolarHBondContact O-N 3.41Å; A254-M257 WeakPolarHBondContact O-CB 3.13Å; A254-M257 PolarHBondContact O-N 3.44Å; A254-I258 WeakPolarHBondContact O-CG1 3.31Å; A254-I258 PolarHBondContact O-N 3.41Å
255	V	81	Confident	74.5	Confident	54 Å²	54	90.3 Å²	90.3	33%	0.327	44%	0.44	S	S	.	.	H	α-helix	trans	-61.6	-46.3	176.2	172.9	0	0	0	0	111.3	H251 H253 M257 I258 Q259	H251-V255 WeakPolarHBondContact O-CG2 3.28Å; H251-V255 PolarHBondContact O-N 3.47Å; H253-V255 PolarHBondContact O-N 2.85Å; V255-M257 VanDerWaalsContact C-N 3.29Å; V255-M257 PolarHBondContact O-N 3Å; V255-I258 PolarHBondContact O-N 3.02Å; V255-Q259 WeakPolarHBondContact O-CG 3.27Å; V255-Q259 PolarHBondContact O-N 3.38Å
256	R	80.9	Confident	72.4	Confident	145 Å²	145	94.9 Å²	94.9	55%	0.547	47%	0.466	S	S	.	.	H	α-helix	trans	-62.7	-36.8	176.8	-72.4	171.9	-170	-175.8	0.9	112.4	S252 H253 Q259 R260	S252-R256 VanDerWaalsContact O-CG 3.22Å; S252-R256 WeakPolarHBondContact O-CG 3.25Å; S252-R256 PolarHBondContact O-N 2.92Å; S252-R256 VanDerWaalsContact O-N 3.14Å; H253-R256 PolarHBondContact O-N 3.34Å; R256-Q259 PolarHBondContact O-N 3.23Å; R256-R260 WeakPolarHBondContact O-CB 3.42Å; R256-R260 WeakPolarHBondContact O-CG 3.26Å; R256-R260 PolarHBondContact O-N 3.07Å
257	M	74.4	Confident	70.6	Confident	77 Å²	77	100.9 Å²	100.9	38%	0.379	50%	0.496	S	S	.	.	H	α-helix	trans	-66.4	-41.7	176.3	-73.6	-99.9	-62.9	0	0	111.5	H253 A254 V255 R260 G261 Q283	H253-M257 VanDerWaalsContact CE1-CG 3.47Å; H253-M257 WeakPolarHBondContact CE1-CG 3.03Å; H253-M257 WeakPolarHBondContact O-CB 3.3Å; H253-M257 WeakPolarHBondContact O-CG 3.44Å; H253-M257 PolarHBondContact O-N 3.47Å; A254-M257 WeakPolarHBondContact O-CB 3.13Å; A254-M257 PolarHBondContact O-N 3.44Å; V255-M257 VanDerWaalsContact C-N 3.29Å; V255-M257 PolarHBondContact O-N 3Å; M257-R260 PolarHBondContact O-N 2.85Å; M257-G261 WeakPolarHBondContact O-CA 3.22Å; M257-G261 PolarHBondContact O-N 2.86Å; M257-Q283 HydrophobicContact CE-CB 3.99Å; M257-Q283 HydrophobicContact CE-CG 3.68Å
258	I	74.6	Confident	68.8	Low	106 Å²	106	105.6 Å²	105.6	54%	0.544	52%	0.52	S	S	.	.	H	α-helix	trans	-62.6	-47.8	174.5	-67.6	165.4	0	0	0	109.8	A254 V255 R260 G261 T262	A254-I258 WeakPolarHBondContact O-CG1 3.31Å; A254-I258 PolarHBondContact O-N 3.41Å; V255-I258 PolarHBondContact O-N 3.02Å; I258-R260 VanDerWaalsContact C-N 3.33Å; I258-R260 PolarHBondContact O-N 3.48Å; I258-G261 PolarHBondContact O-N 2.95Å; I258-T262 PolarHBondContact O-N 2.78Å; I258-T262 PolarHBondContact O-OG1 3.18Å
259	Q	74.3	Confident	66.9	Low	124 Å²	124	105 Å²	105	58%	0.579	52%	0.524	S	S	*	.	H	α-helix	trans	-59.1	-41.2	178.1	-71.5	174.1	-18.2	0	0	112.9	V255 R256 Q263	V255-Q259 WeakPolarHBondContact O-CG 3.27Å; V255-Q259 PolarHBondContact O-N 3.38Å; R256-Q259 PolarHBondContact O-N 3.23Å; Q259-Q263 PolarHBondContact O-N 3.05Å
260	R	68.9	Low	64.9	Low	186 Å²	186	107.2 Å²	107.2	70%	0.702	55%	0.545	S	S	*	.	H	α-helix	trans	-75.2	-32.8	176.2	-72.1	178.9	176	-172.6	-2.7	113.1	R256 M257 I258 Q263 K264	R256-R260 WeakPolarHBondContact O-CB 3.42Å; R256-R260 WeakPolarHBondContact O-CG 3.26Å; R256-R260 PolarHBondContact O-N 3.07Å; M257-R260 PolarHBondContact O-N 2.85Å; I258-R260 VanDerWaalsContact C-N 3.33Å; I258-R260 PolarHBondContact O-N 3.48Å; R260-Q263 PolarHBondContact O-N 3.35Å; R260-K264 PolarHBondContact O-N 3.22Å; R260-K264 VanDerWaalsContact O-N 3.11Å
261	G	60.1	Low	63.2	Low	36 Å²	36	110.8 Å²	110.8	37%	0.371	57%	0.568	S	S	.	*	H	α-helix	trans	-66.3	-42	175.5	0	0	0	0	0	111.6	M257 I258 Q263 K264 S265	M257-G261 WeakPolarHBondContact O-CA 3.22Å; M257-G261 PolarHBondContact O-N 2.86Å; I258-G261 PolarHBondContact O-N 2.95Å; G261-Q263 VanDerWaalsContact C-N 3.26Å; G261-Q263 PolarHBondContact O-N 2.76Å; G261-K264 PolarHBondContact O-N 3.49Å; G261-K264 VanDerWaalsContact O-N 3.16Å; G261-S265 WeakPolarHBondContact O-CB 3.45Å; G261-S265 PolarHBondContact O-N 3.18Å; G261-S265 PolarHBondContact O-OG 2.83Å
262	T	54.1	Low	61.6	Low	96 Å²	96	114 Å²	114	59%	0.589	58%	0.584	S	S	*	*	H	α-helix	trans	-64.1	-29.7	172.9	-52	0	0	0	0	112.3	I258	I258-T262 PolarHBondContact O-N 2.78Å; I258-T262 PolarHBondContact O-OG1 3.18Å
263	Q	49.5	Very low	59.9	Low	171 Å²	171	120.3 Å²	120.3	80%	0.799	62%	0.615	S	S	*	*	H	α-helix	trans	-77.6	-24.8	172.9	-92.3	-162.6	-4.4	0	0	114.5	Q259 R260 G261	Q259-Q263 PolarHBondContact O-N 3.05Å; R260-Q263 PolarHBondContact O-N 3.35Å; G261-Q263 VanDerWaalsContact C-N 3.26Å; G261-Q263 PolarHBondContact O-N 2.76Å
264	K	46.7	Very low	58.6	Low	185 Å²	185	119.9 Å²	119.9	80%	0.804	64%	0.636	S	S	*	*	H	α-helix	trans	-104.9	-3.5	-177.9	-82.1	-170.9	174.8	-172.7	0	114.9	R260 G261	R260-K264 PolarHBondContact O-N 3.22Å; R260-K264 VanDerWaalsContact O-N 3.11Å; G261-K264 PolarHBondContact O-N 3.49Å; G261-K264 VanDerWaalsContact O-N 3.16Å
265	S	44.9	Very low	56.7	Low	90 Å²	90	127.9 Å²	127.9	63%	0.629	67%	0.667	S	S	*	*			trans	-93.8	20.1	179.1	69.9	0	0	0	0	114.8	G261 I267	G261-S265 WeakPolarHBondContact O-CB 3.45Å; G261-S265 PolarHBondContact O-N 3.18Å; G261-S265 PolarHBondContact O-OG 2.83Å; S265-I267 VanDerWaalsContact C-N 3.31Å; S265-I267 PolarHBondContact O-N 3.1Å
266	I	47.9	Very low	55.1	Low	136 Å²	136	132 Å²	132	70%	0.697	69%	0.692	S	S	*	*			trans	-92.8	72.8	160.5	-51.8	176.9	0	0	0	107.5	I268	I266-I268 HydrophobicContact CG2-CD1 4.48Å; I266-I268 HydrophobicContact CG2-CG1 4.42Å
267	I	51.3	Low	53.4	Low	127 Å²	127	133 Å²	133	65%	0.651	70%	0.703	S	S	*	*			trans	-122	93.3	148.5	-58.5	-179.5	0	0	0	104.6	S265 H269	S265-I267 VanDerWaalsContact C-N 3.31Å; S265-I267 PolarHBondContact O-N 3.1Å; I267-H269 PolarHBondContact O-N 3.37Å; I267-H269 VanDerWaalsContact O-N 3.15Å
268	I	50.4	Low	52.2	Low	131 Å²	131	135.3 Å²	135.3	67%	0.672	72%	0.721	S	S	*	*			trans	-71.8	99	171	-60	169.9	0	0	0	105.4	I266 T270	I266-I268 HydrophobicContact CG2-CD1 4.48Å; I266-I268 HydrophobicContact CG2-CG1 4.42Å; I268-T270 VanDerWaalsContact C-N 3.35Å; I268-T270 HydrophobicContact CG2-CG2 4.38Å; I268-T270 PolarHBondContact O-N 3.08Å
269	H	48.1	Very low	50.9	Low	163 Å²	163	135.8 Å²	135.8	76%	0.755	73%	0.729	S	S	*	*			trans	-80	94.8	156.1	-78	-76.6	0	0	0	106.8	I267 S271	I267-H269 PolarHBondContact O-N 3.37Å; I267-H269 VanDerWaalsContact O-N 3.15Å; H269-S271 PolarHBondContact O-N 3.15Å
270	T	44.4	Very low	49.9	Very low	128 Å²	128	137.7 Å²	137.7	79%	0.785	73%	0.731	S	S	*	*			trans	-65.9	107	162.7	0.9	0	0	0	0	107.1	I268	I268-T270 VanDerWaalsContact C-N 3.35Å; I268-T270 HydrophobicContact CG2-CG2 4.38Å; I268-T270 PolarHBondContact O-N 3.08Å
271	S	47.1	Very low	49.2	Very low	105 Å²	105	132.5 Å²	132.5	73%	0.734	72%	0.721	S	S	*	*			trans	-132.8	129.7	157	-67.7	0	0	0	0	106.7	H269 D273	H269-S271 PolarHBondContact O-N 3.15Å; S271-D273 VanDerWaalsContact C-N 3.29Å; S271-D273 PolarHBondContact O-N 3.39Å
272	E	50.7	Low	48.9	Very low	196 Å²	196	137 Å²	137	92%	0.916	74%	0.737	S	S	*	*	S	Bend	trans	-59.7	83.9	-178.5	-67.9	171.7	129.2	0	0	110.3
273	D	47.3	Very low	48.9	Very low	157 Å²	157	136.2 Å²	136.2	84%	0.84	73%	0.727	S	S	*	*	S	Bend	trans	-178.3	79.6	147.3	-104	-25.7	0	0	0	111	S271 K275	S271-D273 VanDerWaalsContact C-N 3.29Å; S271-D273 PolarHBondContact O-N 3.39Å; D273-K275 VanDerWaalsContact C-N 3.3Å; D273-K275 PolarHBondContact O-N 2.91Å
274	G	53.7	Low	49	Very low	84 Å²	84	129.2 Å²	129.2	87%	0.866	70%	0.698	S	S	*	*			trans	54.9	5.5	131.4	0	0	0	0	0	122.9
275	K	39.7	Very low	49.5	Very low	189 Å²	189	127.2 Å²	127.2	82%	0.822	69%	0.685	S	S	*	*			trans	-128.6	93.8	176.6	-71.4	-173.8	-177.5	175.2	0	112.5	D273 Q277	D273-K275 VanDerWaalsContact C-N 3.3Å; D273-K275 PolarHBondContact O-N 2.91Å; K275-Q277 PolarHBondContact O-N 3.2Å
276	V	48	Very low	50.1	Low	140 Å²	140	127.2 Å²	127.2	85%	0.848	68%	0.677	S	S	*	*			trans	-70.5	91.8	166.1	-177.7	0	0	0	0	108.6	V278	V276-V278 HydrophobicContact CG1-CG2 4.23Å; V276-V278 PolarHBondContact O-N 3.42Å
277	Q	44.9	Very low	50.9	Low	167 Å²	167	122.1 Å²	122.1	78%	0.78	65%	0.65	S	S	*	*			trans	-79.1	102.3	167.5	-90.7	-166.5	-6.5	0	0	110	K275 T279	K275-Q277 PolarHBondContact O-N 3.2Å; Q277-T279 PolarHBondContact O-N 2.81Å
278	V	50.3	Low	51.6	Low	125 Å²	125	120.4 Å²	120.4	76%	0.758	64%	0.642	S	S	*	*			trans	-71.4	92.5	166.5	-178.1	0	0	0	0	108.3	V276 R280	V276-V278 HydrophobicContact CG1-CG2 4.23Å; V276-V278 PolarHBondContact O-N 3.42Å; V278-R280 VanDerWaalsContact C-N 3.33Å; V278-R280 PolarHBondContact O-N 3.34Å
279	T	47.3	Very low	52.7	Low	116 Å²	116	123 Å²	123	71%	0.712	64%	0.643	S	S	*	*			trans	-72.4	91.7	171.7	-52.8	0	0	0	0	108.2	Q277	Q277-T279 PolarHBondContact O-N 2.81Å
280	R	51.7	Low	53.9	Low	163 Å²	163	119.9 Å²	119.9	62%	0.615	63%	0.632	S	S	*	*			trans	-61.1	119.5	174.5	-154	174.5	176.2	137.9	-1.2	107.1	V278 D282	V278-R280 VanDerWaalsContact C-N 3.33Å; V278-R280 PolarHBondContact O-N 3.34Å; R280-D282 PolarHBondContact O-N 3.17Å
281	P	54.3	Low	55.3	Low	77 Å²	77	115.3 Å²	115.3	50%	0.5	61%	0.607	S	S	.	*			trans	-60.6	128.7	-170.5	22.4	-31.9	0	0	0	109.6	Q283 A284	P281-Q283 PolarHBondContact O-N 3.34Å; P281-A284 PolarHBondContact O-N 3.43Å
282	D	55.5	Low	57	Low	132 Å²	132	117.4 Å²	117.4	71%	0.706	60%	0.603	S	S	*	*	H	α-helix	trans	-50.6	-26.2	179.9	-73.2	-41.7	0	0	0	112.8	R280 A284 R285 M286	R280-D282 PolarHBondContact O-N 3.17Å; D282-A284 PolarHBondContact O-N 3.08Å; D282-R285 PolarHBondContact O-N 3.43Å; D282-M286 PolarHBondContact O-N 2.96Å; D282-M286 VanDerWaalsContact O-N 3.09Å
283	Q	53.4	Low	58.8	Low	79 Å²	79	112 Å²	112	37%	0.369	58%	0.583	S	S	.	*	H	α-helix	trans	-57.9	-41.6	174.6	-155.5	70.4	26.3	0	0	113.7	M257 P281 R285 M286 D287	M257-Q283 HydrophobicContact CE-CB 3.99Å; M257-Q283 HydrophobicContact CE-CG 3.68Å; P281-Q283 PolarHBondContact O-N 3.34Å; Q283-R285 VanDerWaalsContact C-N 3.31Å; Q283-R285 PolarHBondContact O-N 2.93Å; Q283-M286 PolarHBondContact O-N 3.4Å; Q283-D287 VanDerWaalsContact O-CG 3.3Å; Q283-D287 PolarHBondContact O-N 3.06Å
284	A	51.2	Low	60.6	Low	24 Å²	24	105.8 Å²	105.8	20%	0.198	55%	0.549	C	S	.	.	H	α-helix	trans	-70.2	-28.2	179.5	0	0	0	0	0	112.4	P281 D282 I288	P281-A284 PolarHBondContact O-N 3.43Å; D282-A284 PolarHBondContact O-N 3.08Å; A284-I288 WeakPolarHBondContact O-CD1 3.28Å; A284-I288 WeakPolarHBondContact O-CG1 3.46Å; A284-I288 PolarHBondContact O-N 3.25Å
285	R	57	Low	62.2	Low	143 Å²	143	105.1 Å²	105.1	54%	0.54	53%	0.529	S	S	.	.	H	α-helix	trans	-74.3	-36.2	173.9	-67.2	-178.1	-178.2	-118	3.9	111.5	D282 Q283 R289	D282-R285 PolarHBondContact O-N 3.43Å; Q283-R285 VanDerWaalsContact C-N 3.31Å; Q283-R285 PolarHBondContact O-N 2.93Å; R285-R289 WeakPolarHBondContact O-CG 3.21Å; R285-R289 PolarHBondContact O-N 2.85Å; R285-R289 VanDerWaalsContact O-N 3.14Å
286	M	58.1	Low	64.7	Low	90 Å²	90	101.3 Å²	101.3	44%	0.443	52%	0.517	S	S	.	.	H	α-helix	trans	-67	-41.5	175.8	-171	167.8	59	0	0	111.6	D282 Q283 I288 R289 L290	D282-M286 PolarHBondContact O-N 2.96Å; D282-M286 VanDerWaalsContact O-N 3.09Å; Q283-M286 PolarHBondContact O-N 3.4Å; M286-I288 VanDerWaalsContact C-N 3.34Å; M286-I288 PolarHBondContact O-N 2.97Å; M286-R289 PolarHBondContact O-N 3.46Å; M286-L290 HydrophobicContact CG-CD1 4.14Å; M286-L290 VanDerWaalsContact O-CG 3.32Å; M286-L290 WeakPolarHBondContact O-CG 3.44Å; M286-L290 PolarHBondContact O-N 2.7Å
287	D	64	Low	66.7	Low	28 Å²	28	97.6 Å²	97.6	15%	0.15	49%	0.491	C	S	.	.	H	α-helix	trans	-62	-39	176.9	-67.2	-19.1	0	0	0	112.2	Q283 A291	Q283-D287 VanDerWaalsContact O-CG 3.3Å; Q283-D287 PolarHBondContact O-N 3.06Å; D287-A291 WeakPolarHBondContact O-CB 2.96Å; D287-A291 PolarHBondContact O-N 2.65Å
288	I	65.9	Low	69	Low	92 Å²	92	90.2 Å²	90.2	47%	0.472	46%	0.457	S	S	.	.	H	α-helix	trans	-68.9	-41.3	176	-67.5	168.5	0	0	0	111.9	A284 M286 A291 K292	A284-I288 WeakPolarHBondContact O-CD1 3.28Å; A284-I288 WeakPolarHBondContact O-CG1 3.46Å; A284-I288 PolarHBondContact O-N 3.25Å; M286-I288 VanDerWaalsContact C-N 3.34Å; M286-I288 PolarHBondContact O-N 2.97Å; I288-A291 PolarHBondContact O-N 3.3Å; I288-K292 WeakPolarHBondContact O-CG 3.41Å; I288-K292 PolarHBondContact O-N 2.89Å
289	R	73.6	Confident	71	Confident	184 Å²	184	87.5 Å²	87.5	69%	0.694	44%	0.441	S	S	*	.	H	α-helix	trans	-64.2	-44.2	178.3	-75	177.5	-179	178.2	0.4	111.3	R285 M286 K292 T293	R285-R289 WeakPolarHBondContact O-CG 3.21Å; R285-R289 PolarHBondContact O-N 2.85Å; R285-R289 VanDerWaalsContact O-N 3.14Å; M286-R289 PolarHBondContact O-N 3.46Å; R289-K292 PolarHBondContact O-N 3.38Å; R289-T293 PolarHBondContact O-N 2.75Å; R289-T293 PolarHBondContact O-OG1 3.03Å
290	L	72.9	Confident	73.3	Confident	99 Å²	99	85.5 Å²	85.5	52%	0.518	43%	0.428	S	S	.	.	H	α-helix	trans	-62.1	-45.9	175.7	-68.8	171.4	0	0	0	111.1	M286 K292 T293 L294	M286-L290 HydrophobicContact CG-CD1 4.14Å; M286-L290 VanDerWaalsContact O-CG 3.32Å; M286-L290 WeakPolarHBondContact O-CG 3.44Å; M286-L290 PolarHBondContact O-N 2.7Å; L290-K292 PolarHBondContact O-N 3.49Å; L290-T293 PolarHBondContact O-N 3.2Å; L290-L294 VanDerWaalsContact O-CG 3.25Å; L290-L294 WeakPolarHBondContact O-CG 3.22Å; L290-L294 PolarHBondContact O-N 2.92Å; L290-L294 VanDerWaalsContact O-N 3.08Å
291	A	75.4	Confident	75.3	Confident	31 Å²	31	78.5 Å²	78.5	26%	0.256	40%	0.403	S	S	.	.	H	α-helix	trans	-59.5	-42.9	177.8	0	0	0	0	0	112.8	L247 D287 I288 T293 L294 V295	L247-A291 HydrophobicContact CD2-CB 3.76Å; D287-A291 WeakPolarHBondContact O-CB 2.96Å; D287-A291 PolarHBondContact O-N 2.65Å; I288-A291 PolarHBondContact O-N 3.3Å; A291-T293 PolarHBondContact O-N 2.95Å; A291-L294 PolarHBondContact O-N 2.8Å; A291-V295 WeakPolarHBondContact O-CG2 3.35Å; A291-V295 PolarHBondContact O-N 3.29Å
292	K	82.7	Confident	77.1	Confident	150 Å²	150	79.7 Å²	79.7	65%	0.652	40%	0.404	S	S	*	.	H	α-helix	trans	-58.3	-45.8	177	-76.7	-177.3	177.5	-169.2	0	112.4	I288 R289 L290 L296	I288-K292 WeakPolarHBondContact O-CG 3.41Å; I288-K292 PolarHBondContact O-N 2.89Å; R289-K292 PolarHBondContact O-N 3.38Å; L290-K292 PolarHBondContact O-N 3.49Å; K292-L296 WeakPolarHBondContact O-CB 3.34Å; K292-L296 PolarHBondContact O-N 3.03Å
293	T	86.9	Confident	78.9	Confident	81 Å²	81	78.9 Å²	78.9	50%	0.497	40%	0.398	S	S	.	.	H	α-helix	trans	-64.6	-41.1	178.4	-55.7	0	0	0	0	111.7	R289 L290 A291 L296 I297	R289-T293 PolarHBondContact O-N 2.75Å; R289-T293 PolarHBondContact O-OG1 3.03Å; L290-T293 PolarHBondContact O-N 3.2Å; A291-T293 PolarHBondContact O-N 2.95Å; T293-L296 PolarHBondContact O-N 3.37Å; T293-I297 HydrophobicContact CG2-CD1 4.07Å; T293-I297 VanDerWaalsContact O-CG1 3.26Å; T293-I297 WeakPolarHBondContact O-CG1 3.25Å; T293-I297 PolarHBondContact O-N 3.19Å
294	L	85.9	Confident	80.8	Confident	27 Å²	27	78.3 Å²	78.3	14%	0.141	40%	0.403	C	S	.	.	H	α-helix	trans	-70	-38.8	-179.5	-60.1	170.4	0	0	0	112.5	Y243 I246 L247 L290 A291 L296 I297 L298	Y243-L294 HydrophobicContact CD1-CB 4.43Å; Y243-L294 HydrophobicContact CD1-CD2 3.53Å; Y243-L294 HydrophobicContact CD1-CG 4.4Å; Y243-L294 HydrophobicContact CE1-CD2 3.38Å; I246-L294 HydrophobicContact CG2-CD1 3.5Å; L247-L294 HydrophobicContact CD2-CB 4.09Å; L247-L294 HydrophobicContact CD2-CD1 4.07Å; L247-L294 HydrophobicContact CG-CB 4.42Å; L247-L294 HydrophobicContact CG-CD1 4.47Å; L290-L294 VanDerWaalsContact O-CG 3.25Å; L290-L294 WeakPolarHBondContact O-CG 3.22Å; L290-L294 PolarHBondContact O-N 2.92Å; L290-L294 VanDerWaalsContact O-N 3.08Å; A291-L294 PolarHBondContact O-N 2.8Å; L294-L296 VanDerWaalsContact C-N 3.35Å; L294-I297 PolarHBondContact O-N 2.06Å; L294-L298 WeakPolarHBondContact O-CG 3.27Å; L294-L298 PolarHBondContact O-N 3.29Å
295	V	88.4	Confident	82.9	Confident	71 Å²	71	78.6 Å²	78.6	43%	0.43	40%	0.399	S	S	.	.	H	α-helix	trans	-63.6	-43.2	173.9	171.4	0	0	0	0	110.4	L247 A291 I297 L298 V299	L247-V295 HydrophobicContact CD1-CG2 3.9Å; L247-V295 HydrophobicContact CD2-CG2 4.37Å; A291-V295 WeakPolarHBondContact O-CG2 3.35Å; A291-V295 PolarHBondContact O-N 3.29Å; V295-I297 VanDerWaalsContact C-N 3.34Å; V295-I297 PolarHBondContact O-N 2.96Å; V295-L298 PolarHBondContact O-N 3.44Å; V295-V299 HydrophobicContact CG1-CG2 4.3Å; V295-V299 WeakPolarHBondContact O-CG2 3.25Å; V295-V299 PolarHBondContact O-N 3.25Å
296	L	91.6	Very high	84.6	Confident	109 Å²	109	73.4 Å²	73.4	57%	0.571	39%	0.39	S	S	*	.	H	α-helix	trans	-58.6	-46.5	175.5	-179.4	65.4	0	0	0	111.4	K292 T293 L294 L298 V299 V300	K292-L296 WeakPolarHBondContact O-CB 3.34Å; K292-L296 PolarHBondContact O-N 3.03Å; T293-L296 PolarHBondContact O-N 3.37Å; L294-L296 VanDerWaalsContact C-N 3.35Å; L296-L298 VanDerWaalsContact C-N 3.34Å; L296-L298 PolarHBondContact O-N 2.92Å; L296-V299 PolarHBondContact O-N 3.43Å; L296-V300 HydrophobicContact CD1-CG2 4.32Å; L296-V300 WeakPolarHBondContact O-CG2 3.43Å; L296-V300 PolarHBondContact O-N 2.96Å
297	I	90.8	Very high	86.2	Confident	61 Å²	61	72.2 Å²	72.2	31%	0.313	39%	0.388	S	S	.	.	H	α-helix	trans	-58.1	-46	176.9	-69.3	164.2	0	0	0	111	Y243 T293 L294 V295 V300 L301	Y243-I297 HydrophobicContact CE2-CG2 4.16Å; T293-I297 HydrophobicContact CG2-CD1 4.07Å; T293-I297 VanDerWaalsContact O-CG1 3.26Å; T293-I297 WeakPolarHBondContact O-CG1 3.25Å; T293-I297 PolarHBondContact O-N 3.19Å; L294-I297 PolarHBondContact O-N 2.06Å; V295-I297 VanDerWaalsContact C-N 3.34Å; V295-I297 PolarHBondContact O-N 2.96Å; I297-V300 PolarHBondContact O-N 3.14Å; I297-L301 WeakPolarHBondContact O-CB 3.39Å; I297-L301 PolarHBondContact O-N 3.2Å
298	L	91.5	Very high	87.6	Confident	13 Å²	13	72.1 Å²	72.1	7%	0.068	39%	0.388	C	S	.	.	H	α-helix	trans	-62.3	-43.9	178.7	-78.6	174.9	0	0	0	112.8	V240 Y243 M244 L247 L294 V295 L296 L301 I302	V240-L298 HydrophobicContact CB-CD2 4.31Å; V240-L298 HydrophobicContact CG1-CD2 4.37Å; V240-L298 HydrophobicContact CG2-CD2 4.09Å; Y243-L298 HydrophobicContact CD2-CD2 4.17Å; Y243-L298 HydrophobicContact CG-CD2 4.35Å; Y243-L298 HydrophobicContact CG-CG 4.48Å; M244-L298 HydrophobicContact CG-CD1 4.4Å; M244-L298 HydrophobicContact SD-CD1 3.93Å; L247-L298 HydrophobicContact CD1-CD1 4.05Å; L294-L298 WeakPolarHBondContact O-CG 3.27Å; L294-L298 PolarHBondContact O-N 3.29Å; V295-L298 PolarHBondContact O-N 3.44Å; L296-L298 VanDerWaalsContact C-N 3.34Å; L296-L298 PolarHBondContact O-N 2.92Å; L298-L301 PolarHBondContact O-N 2.89Å; L298-I302 WeakPolarHBondContact O-CG1 3.24Å; L298-I302 PolarHBondContact O-N 3.04Å; L298-I302 VanDerWaalsContact O-N 3.1Å
299	V	94	Very high	88.9	Confident	68 Å²	68	68.7 Å²	68.7	41%	0.412	37%	0.37	S	S	.	.	H	α-helix	trans	-63.6	-47.1	179.3	169.7	0	0	0	0	110.6	V295 L296 L301 I302 I303	V295-V299 HydrophobicContact CG1-CG2 4.3Å; V295-V299 WeakPolarHBondContact O-CG2 3.25Å; V295-V299 PolarHBondContact O-N 3.25Å; L296-V299 PolarHBondContact O-N 3.43Å; V299-L301 VanDerWaalsContact C-N 3.31Å; V299-L301 PolarHBondContact O-N 2.9Å; V299-I302 PolarHBondContact O-N 3.21Å; V299-I303 HydrophobicContact CG1-CD1 3.57Å; V299-I303 HydrophobicContact CG1-CG1 4.37Å; V299-I303 WeakPolarHBondContact O-CG1 3.43Å; V299-I303 PolarHBondContact O-N 3Å
300	V	94.4	Very high	89.8	Confident	74 Å²	74	62.9 Å²	62.9	45%	0.448	36%	0.361	S	S	.	.	H	α-helix	trans	-60.2	-43.3	177	172.9	0	0	0	0	110.6	L296 I297 I302 I303 C304	L296-V300 HydrophobicContact CD1-CG2 4.32Å; L296-V300 WeakPolarHBondContact O-CG2 3.43Å; L296-V300 PolarHBondContact O-N 2.96Å; I297-V300 PolarHBondContact O-N 3.14Å; V300-I302 VanDerWaalsContact C-N 3.34Å; V300-I302 PolarHBondContact O-N 2.98Å; V300-I303 PolarHBondContact O-N 3.46Å; V300-C304 WeakPolarHBondContact O-CB 3.38Å; V300-C304 PolarHBondContact O-N 3.43Å; V300-C304 PolarHBondContact O-SG 3.39Å
301	L	92.8	Very high	90.7	Very high	15 Å²	15	59.3 Å²	59.3	8%	0.079	34%	0.343	C	S	.	.	H	α-helix	trans	-57.9	-45.7	178.6	-168.6	72.3	0	0	0	112.2	L156 L236 I239 V240 I297 L298 V299 W305	L156-L301 HydrophobicContact CD1-CD1 4.11Å; L236-L301 HydrophobicContact CD2-CD1 3.63Å; L236-L301 HydrophobicContact CD2-CD2 4.05Å; L236-L301 HydrophobicContact CD2-CG 3.95Å; I239-L301 HydrophobicContact CB-CD2 4.25Å; I239-L301 HydrophobicContact CG2-CD2 3.63Å; V240-L301 HydrophobicContact CG2-CD2 4.19Å; I297-L301 WeakPolarHBondContact O-CB 3.39Å; I297-L301 PolarHBondContact O-N 3.2Å; L298-L301 PolarHBondContact O-N 2.89Å; V299-L301 VanDerWaalsContact C-N 3.31Å; V299-L301 PolarHBondContact O-N 2.9Å; L301-W305 WeakPolarHBondContact O-CB 3.48Å; L301-W305 PolarHBondContact O-N 3.46Å
302	I	93	Very high	91.5	Very high	103 Å²	103	58.6 Å²	58.6	53%	0.528	33%	0.334	S	S	.	.	H	α-helix	trans	-69.5	-42.3	-179.4	-66.5	168.4	0	0	0	111.2	L298 V299 V300 G306	L298-I302 WeakPolarHBondContact O-CG1 3.24Å; L298-I302 PolarHBondContact O-N 3.04Å; L298-I302 VanDerWaalsContact O-N 3.1Å; V299-I302 PolarHBondContact O-N 3.21Å; V300-I302 VanDerWaalsContact C-N 3.34Å; V300-I302 PolarHBondContact O-N 2.98Å; I302-G306 VanDerWaalsContact O-CA 3.29Å; I302-G306 WeakPolarHBondContact O-CA 3.27Å; I302-G306 PolarHBondContact O-N 2.9Å
303	I	94.4	Very high	92	Very high	114 Å²	114	54 Å²	54	59%	0.585	32%	0.319	S	S	*	.	H	α-helix	trans	-66.7	-40.8	-179.4	-69.2	172.7	0	0	0	111.1	V299 V300 P307	V299-I303 HydrophobicContact CG1-CD1 3.57Å; V299-I303 HydrophobicContact CG1-CG1 4.37Å; V299-I303 WeakPolarHBondContact O-CG1 3.43Å; V299-I303 PolarHBondContact O-N 3Å; V300-I303 PolarHBondContact O-N 3.46Å; I303-P307 WeakPolarHBondContact O-CD 3.15Å; I303-P307 WeakPolarHBondContact O-CG 3.19Å
304	C	92.8	Very high	92.2	Very high	68 Å²	68	55.1 Å²	55.1	46%	0.459	32%	0.315	S	S	.	.	H	α-helix	trans	-75.6	-45.7	-179	-65.2	0	0	0	0	112.4	V300 L308	V300-C304 WeakPolarHBondContact O-CB 3.38Å; V300-C304 PolarHBondContact O-N 3.43Å; V300-C304 PolarHBondContact O-SG 3.39Å; C304-L308 WeakPolarHBondContact O-CD1 3.21Å
305	W	94.4	Very high	92.4	Very high	30 Å²	30	54 Å²	54	11%	0.114	31%	0.309	C	S	.	.	H	α-helix	trans	-91.2	-28.3	-173.3	-73.9	88.8	0	0	0	114.3	F149 V153 W228 T232 L236 L301 L308 L309	F149-W305 HydrophobicContact CB-CH2 4.35Å; F149-W305 AromaticContact CD1-CH2 3.76Å; F149-W305 HydrophobicContact CD1-CH2 3.76Å; F149-W305 AromaticContact CD1-CZ2 3.99Å; F149-W305 HydrophobicContact CD1-CZ2 3.99Å; V153-W305 HydrophobicContact CG2-CD2 4.49Å; V153-W305 HydrophobicContact CG2-CH2 3.31Å; V153-W305 HydrophobicContact CG2-CZ2 3.1Å; V153-W305 HydrophobicContact CG2-CZ3 4.11Å; W228-W305 HydrophobicContact CH2-CZ3 4.06Å; T232-W305 HydrophobicContact CG2-CE3 4.01Å; T232-W305 HydrophobicContact CG2-CH2 4.41Å; T232-W305 HydrophobicContact CG2-CZ3 3.71Å; L236-W305 HydrophobicContact CD1-CB 3.78Å; L236-W305 HydrophobicContact CD1-CD2 3.97Å; L236-W305 HydrophobicContact CD1-CE3 4.06Å; L236-W305 HydrophobicContact CD1-CG 3.85Å; L236-W305 HydrophobicContact CD2-CD2 4.48Å; L236-W305 HydrophobicContact CD2-CG 4.22Å; L301-W305 WeakPolarHBondContact O-CB 3.48Å; L301-W305 PolarHBondContact O-N 3.46Å; W305-L308 PolarHBondContact O-N 3.13Å; W305-L309 HydrophobicContact CB-CD1 4.47Å; W305-L309 HydrophobicContact CE3-CD1 4.48Å; W305-L309 HydrophobicContact CE3-CG 4.41Å; W305-L309 WeakPolarHBondContact O-CB 3.32Å; W305-L309 WeakPolarHBondContact O-CG 3.37Å; W305-L309 PolarHBondContact O-N 2.88Å
306	G	92.8	Very high	92.3	Very high	34 Å²	34	51.5 Å²	51.5	35%	0.351	29%	0.294	S	S	.	.	H	α-helix	trans	-58.7	-56.1	-174.7	0	0	0	0	0	113.3	I302 L308 L309 A310	I302-G306 VanDerWaalsContact O-CA 3.29Å; I302-G306 WeakPolarHBondContact O-CA 3.27Å; I302-G306 PolarHBondContact O-N 2.9Å; G306-L308 PolarHBondContact O-N 3.05Å; G306-L309 PolarHBondContact O-N 3.39Å; G306-A310 VanDerWaalsContact O-CB 3.3Å; G306-A310 WeakPolarHBondContact O-CB 3.4Å; G306-A310 PolarHBondContact O-N 2.91Å
307	P	92.9	Very high	92.1	Very high	64 Å²	64	54.2 Å²	54.2	42%	0.416	30%	0.301	S	S	.	.	H	α-helix	trans	-60.2	-43.9	179	-23.8	34.7	0	0	0	112.7	I303 A310 I311	I303-P307 WeakPolarHBondContact O-CD 3.15Å; I303-P307 WeakPolarHBondContact O-CG 3.19Å; P307-A310 PolarHBondContact O-N 3.42Å; P307-I311 VanDerWaalsContact O-CG1 3.29Å; P307-I311 WeakPolarHBondContact O-CG1 3.45Å; P307-I311 PolarHBondContact O-N 3.48Å
308	L	91.8	Very high	91.8	Very high	27 Å²	27	52.6 Å²	52.6	14%	0.141	30%	0.299	C	S	.	.	H	α-helix	trans	-58	-53.5	178.9	-76.6	173.1	0	0	0	111.8	C304 W305 G306 A310 I311 M312 F328 C331	C304-L308 WeakPolarHBondContact O-CD1 3.21Å; W305-L308 PolarHBondContact O-N 3.13Å; G306-L308 PolarHBondContact O-N 3.05Å; L308-A310 VanDerWaalsContact C-N 3.34Å; L308-A310 PolarHBondContact O-N 2.88Å; L308-I311 PolarHBondContact O-N 3.39Å; L308-M312 VanDerWaalsContact O-CG 3.28Å; L308-M312 WeakPolarHBondContact O-CG 3.41Å; L308-M312 PolarHBondContact O-N 3.36Å; L308-F328 HydrophobicContact CD2-CE2 4.03Å; L308-C331 HydrophobicContact CD2-CB 3.38Å; L308-C331 HydrophobicContact CG-CB 4.13Å
309	L	94	Very high	91.3	Very high	20 Å²	20	60.5 Å²	60.5	11%	0.105	33%	0.333	C	S	.	.	H	α-helix	trans	-66.1	-36.8	-179.7	-67.9	175.5	0	0	0	112	W228 I229 T232 L236 W305 G306 M312 V313	W228-L309 HydrophobicContact CZ3-CD2 4.31Å; I229-L309 HydrophobicContact CG2-CD2 4.44Å; T232-L309 HydrophobicContact CG2-CD2 4.33Å; L236-L309 HydrophobicContact CD1-CD1 3.54Å; W305-L309 HydrophobicContact CB-CD1 4.47Å; W305-L309 HydrophobicContact CE3-CD1 4.48Å; W305-L309 HydrophobicContact CE3-CG 4.41Å; W305-L309 WeakPolarHBondContact O-CB 3.32Å; W305-L309 WeakPolarHBondContact O-CG 3.37Å; W305-L309 PolarHBondContact O-N 2.88Å; G306-L309 PolarHBondContact O-N 3.39Å; L309-M312 PolarHBondContact O-N 3.4Å; L309-V313 WeakPolarHBondContact O-CB 3.28Å; L309-V313 WeakPolarHBondContact O-CG2 3.34Å; L309-V313 PolarHBondContact O-N 3.3Å
310	A	92.8	Very high	90.6	Very high	61 Å²	61	58 Å²	58	50%	0.504	32%	0.317	S	S	.	.	H	α-helix	trans	-62.8	-43.6	177.3	0	0	0	0	0	111.9	G306 P307 L308 V313 Y314	G306-A310 VanDerWaalsContact O-CB 3.3Å; G306-A310 WeakPolarHBondContact O-CB 3.4Å; G306-A310 PolarHBondContact O-N 2.91Å; P307-A310 PolarHBondContact O-N 3.42Å; L308-A310 VanDerWaalsContact C-N 3.34Å; L308-A310 PolarHBondContact O-N 2.88Å; A310-V313 PolarHBondContact O-N 3.44Å; A310-Y314 WeakPolarHBondContact O-CB 3.14Å; A310-Y314 PolarHBondContact O-N 3.4Å
311	I	91.8	Very high	90.1	Very high	24 Å²	24	59.3 Å²	59.3	12%	0.123	32%	0.322	C	S	.	.	H	α-helix	trans	-67.4	-43.9	177.4	-64.6	166.6	0	0	0	110.7	I216 P307 L308 V313 Y314 D315 M320 I324 V327 F328	I216-I311 HydrophobicContact CD1-CG2 3.82Å; P307-I311 VanDerWaalsContact O-CG1 3.29Å; P307-I311 WeakPolarHBondContact O-CG1 3.45Å; P307-I311 PolarHBondContact O-N 3.48Å; L308-I311 PolarHBondContact O-N 3.39Å; I311-V313 VanDerWaalsContact C-N 3.3Å; I311-V313 PolarHBondContact O-N 3.45Å; I311-Y314 WeakPolarHBondContact O-CB 3.41Å; I311-Y314 PolarHBondContact O-N 3.29Å; I311-Y314 VanDerWaalsContact O-N 3.11Å; I311-D315 PolarHBondContact O-N 3.5Å; I311-M320 HydrophobicContact CG2-CE 4.38Å; I311-I324 HydrophobicContact CG2-CG2 3.94Å; I311-V327 HydrophobicContact CD1-CG1 4.21Å; I311-F328 HydrophobicContact CB-CD2 4.23Å; I311-F328 HydrophobicContact CG2-CB 4.17Å; I311-F328 HydrophobicContact CG2-CD2 3.72Å; I311-F328 HydrophobicContact CG2-CG 4.31Å
312	M	91.9	Very high	89.4	Confident	16 Å²	16	64.3 Å²	64.3	8%	0.079	34%	0.343	C	S	.	.	H	α-helix	trans	-63.9	-34.5	177.4	-68.3	178.2	-176.3	0	0	112.8	F217 W228 I229 L308 L309 D315 F328	F217-M312 HydrophobicContact CE2-CE 4.05Å; F217-M312 HydrophobicContact CZ-CE 3.94Å; W228-M312 HydrophobicContact CE3-SD 4.4Å; W228-M312 HydrophobicContact CZ3-CE 4.3Å; W228-M312 HydrophobicContact CZ3-SD 3.69Å; I229-M312 HydrophobicContact CD1-CB 3.68Å; I229-M312 HydrophobicContact CG1-CB 4.11Å; L308-M312 VanDerWaalsContact O-CG 3.28Å; L308-M312 WeakPolarHBondContact O-CG 3.41Å; L308-M312 PolarHBondContact O-N 3.36Å; L309-M312 PolarHBondContact O-N 3.4Å; M312-D315 WeakPolarHBondContact O-CB 3.42Å; M312-F328 HydrophobicContact CE-CE2 3.76Å; M312-F328 HydrophobicContact CE-CZ 3.74Å; M312-F328 HydrophobicContact CG-CE2 3.98Å
313	V	93.2	Very high	88.9	Confident	55 Å²	55	65.5 Å²	65.5	33%	0.333	35%	0.349	S	S	.	.	H	α-helix	trans	-67.1	-41.7	171.9	166.6	0	0	0	0	110.5	I229 L309 A310 I311 D315 V316 F317	I229-V313 HydrophobicContact CD1-CG2 4.33Å; I229-V313 HydrophobicContact CG2-CG2 3.7Å; L309-V313 WeakPolarHBondContact O-CB 3.28Å; L309-V313 WeakPolarHBondContact O-CG2 3.34Å; L309-V313 PolarHBondContact O-N 3.3Å; A310-V313 PolarHBondContact O-N 3.44Å; I311-V313 VanDerWaalsContact C-N 3.3Å; I311-V313 PolarHBondContact O-N 3.45Å; V313-D315 VanDerWaalsContact C-N 3.29Å; V313-D315 PolarHBondContact O-N 3.36Å; V313-V316 PolarHBondContact O-N 3.02Å; V313-F317 HydrophobicContact CG1-CD2 3.72Å; V313-F317 HydrophobicContact CG1-CE2 3.83Å; V313-F317 WeakPolarHBondContact O-CD2 3.47Å; V313-F317 PolarHBondContact O-N 2.91Å
314	Y	91.9	Very high	88.3	Confident	104 Å²	104	62.1 Å²	62.1	41%	0.408	33%	0.332	S	S	.	.	H	α-helix	trans	-61.9	-36.8	177.7	-175.8	-97.2	0	0	0	112.4	A310 I311 V316 F317 G318 M320 I324	A310-Y314 WeakPolarHBondContact O-CB 3.14Å; A310-Y314 PolarHBondContact O-N 3.4Å; I311-Y314 WeakPolarHBondContact O-CB 3.41Å; I311-Y314 PolarHBondContact O-N 3.29Å; I311-Y314 VanDerWaalsContact O-N 3.11Å; Y314-V316 VanDerWaalsContact C-N 3.28Å; Y314-V316 PolarHBondContact O-N 2.99Å; Y314-F317 PolarHBondContact O-N 3.45Å; Y314-G318 WeakPolarHBondContact O-CA 3.46Å; Y314-G318 PolarHBondContact O-N 3.38Å; Y314-M320 HydrophobicContact CD1-SD 3.65Å; Y314-M320 HydrophobicContact CE1-SD 4.12Å; Y314-I324 HydrophobicContact CD1-CD1 4.11Å; Y314-I324 HydrophobicContact CE1-CD1 3.55Å
315	D	88.6	Confident	87.8	Confident	3 Å²	3	60.8 Å²	60.8	2%	0.016	32%	0.318	C	S	.	.	H	α-helix	trans	-56.7	-38.7	174	-174	64.8	0	0	0	113.1	S214 D215 I216 L225 I311 M312 V313 M320	S214-D315 WeakPolarHBondContact CB-OD2 3.36Å; S214-D315 PolarHBondContact OG-OD2 2.84Å; D215-D315 WeakPolarHBondContact CA-OD1 3.49Å; D215-D315 WeakPolarHBondContact CB-OD1 3.29Å; D215-D315 PolarHBondContact N-OD1 3.16Å; I216-D315 HydrophobicContact CD1-CB 3.67Å; I216-D315 HydrophobicContact CG1-CB 4.19Å; I216-D315 WeakPolarHBondContact CG1-OD1 3.43Å; I216-D315 PolarHBondContact N-OD1 3.02Å; L225-D315 WeakPolarHBondContact CD2-OD2 3.23Å; I311-D315 PolarHBondContact O-N 3.5Å; M312-D315 WeakPolarHBondContact O-CB 3.42Å; V313-D315 VanDerWaalsContact C-N 3.29Å; V313-D315 PolarHBondContact O-N 3.36Å; D315-M320 HydrophobicContact CB-CG 4.21Å; D315-M320 WeakPolarHBondContact OD1-CG 3.33Å
316	V	87.6	Confident	87.1	Confident	19 Å²	19	60.2 Å²	60.2	12%	0.115	32%	0.318	C	S	.	.	H	α-helix	trans	-74	-35.2	-179.6	171	0	0	0	0	112.3	L225 M226 I229 V313 Y314	L225-V316 HydrophobicContact CD2-CG2 3.98Å; L225-V316 HydrophobicContact CG-CG2 4.24Å; M226-V316 HydrophobicContact CE-CG1 4.14Å; M226-V316 HydrophobicContact CG-CB 4.23Å; M226-V316 HydrophobicContact CG-CG1 3.4Å; M226-V316 VanDerWaalsContact CG-CG1 3.4Å; M226-V316 HydrophobicContact CG-CG2 3.84Å; M226-V316 HydrophobicContact SD-CG1 3.51Å; M226-V316 VanDerWaalsContact SD-CG1 3.51Å; I229-V316 HydrophobicContact CD1-CG2 4.4Å; V313-V316 PolarHBondContact O-N 3.02Å; Y314-V316 VanDerWaalsContact C-N 3.28Å; Y314-V316 PolarHBondContact O-N 2.99Å
317	F	87.5	Confident	86.6	Confident	166 Å²	166	62 Å²	62	73%	0.728	32%	0.322	S	S	*	.	H	α-helix	trans	-102.3	-13.8	-171.2	-68	-66.6	0	0	0	114.3	V313 Y314	V313-F317 HydrophobicContact CG1-CD2 3.72Å; V313-F317 HydrophobicContact CG1-CE2 3.83Å; V313-F317 WeakPolarHBondContact O-CD2 3.47Å; V313-F317 PolarHBondContact O-N 2.91Å; Y314-F317 PolarHBondContact O-N 3.45Å
318	G	83.9	Confident	86.2	Confident	26 Å²	26	60.3 Å²	60.3	27%	0.268	31%	0.308	S	S	.	.	S	Bend	trans	-142.6	167.4	-172.6	0	0	0	0	0	112.4	Y314	Y314-G318 WeakPolarHBondContact O-CA 3.46Å; Y314-G318 PolarHBondContact O-N 3.38Å
319	K	79.9	Confident	85.6	Confident	179 Å²	179	60.8 Å²	60.8	78%	0.778	32%	0.316	S	S	*	.	P	Polyproline II helix	trans	-84	130.7	174.3	-70.3	-169.8	175.7	-172.8	0	110.6
320	M	79.7	Confident	84.8	Confident	15 Å²	15	64.4 Å²	64.4	7%	0.074	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-83.1	120	-176.9	-80.4	-73.7	-59.8	0	0	112.2	D215 I216 I311 Y314 D315 I324 K325	D215-M320 HydrophobicContact CB-CB 3.95Å; D215-M320 HydrophobicContact CB-CG 4.03Å; D215-M320 PolarHBondContact OD2-N 2.88Å; I216-M320 HydrophobicContact CD1-CE 3.88Å; I216-M320 HydrophobicContact CD1-SD 4.23Å; I216-M320 HydrophobicContact CG1-CE 3.83Å; I216-M320 HydrophobicContact CG1-CG 4.41Å; I216-M320 HydrophobicContact CG1-SD 4.48Å; I311-M320 HydrophobicContact CG2-CE 4.38Å; Y314-M320 HydrophobicContact CD1-SD 3.65Å; Y314-M320 HydrophobicContact CE1-SD 4.12Å; D315-M320 HydrophobicContact CB-CG 4.21Å; D315-M320 WeakPolarHBondContact OD1-CG 3.33Å; M320-I324 HydrophobicContact CE-CB 3.54Å; M320-I324 HydrophobicContact CE-CG2 3.37Å; M320-I324 HydrophobicContact SD-CB 4.04Å; M320-I324 HydrophobicContact SD-CG2 3.65Å; M320-K325 HydrophobicContact CB-CD 4.33Å; M320-K325 HydrophobicContact CB-CG 4.04Å; M320-K325 HydrophobicContact CE-CB 4.3Å; M320-K325 HydrophobicContact CE-CG 3.54Å
321	N	83.9	Confident	84.1	Confident	103 Å²	103	65.9 Å²	65.9	55%	0.551	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-77.1	153.6	172	-66.8	-24.8	0	0	0	111.6	L323 I324 K325	N321-L323 PolarHBondContact O-N 2.95Å; N321-L323 VanDerWaalsContact O-N 3.14Å; N321-I324 HydrophobicContact CB-CD1 4.48Å; N321-I324 HydrophobicContact CB-CG1 4.45Å; N321-I324 PolarHBondContact O-N 3.45Å; N321-K325 PolarHBondContact O-N 3.4Å; N321-K325 VanDerWaalsContact O-N 3.17Å
322	K	78.9	Confident	83.7	Confident	119 Å²	119	68 Å²	68	52%	0.517	35%	0.348	S	S	.	.	H	α-helix	trans	-49.9	-42.4	178.8	-161.9	177.9	-176.6	176.4	0	112.4	I59 I324 K325 T326	I59-K322 HydrophobicContact CG2-CD 4.1Å; I59-K322 HydrophobicContact CG2-CG 3.34Å; K322-I324 PolarHBondContact O-N 2.91Å; K322-K325 PolarHBondContact O-N 3.39Å; K322-T326 PolarHBondContact O-N 3.3Å; K322-T326 PolarHBondContact O-OG1 2.88Å
323	L	82.3	Confident	83.3	Confident	128 Å²	128	70.7 Å²	70.7	67%	0.67	36%	0.362	S	S	*	.	H	α-helix	trans	-58.4	-44.5	177.4	179.3	65.3	0	0	0	113.1	N321 T326 V327	N321-L323 PolarHBondContact O-N 2.95Å; N321-L323 VanDerWaalsContact O-N 3.14Å; L323-T326 WeakPolarHBondContact O-CB 3.19Å; L323-T326 PolarHBondContact O-N 3.05Å; L323-V327 WeakPolarHBondContact O-CG2 3.33Å; L323-V327 PolarHBondContact O-N 3.39Å
324	I	82.5	Confident	82.7	Confident	43 Å²	43	71.6 Å²	71.6	22%	0.221	36%	0.364	C	S	.	.	H	α-helix	trans	-71.5	-38.2	-176.8	-51.2	175.5	0	0	0	109.5	I311 Y314 M320 N321 K322 T326 V327 F328	I311-I324 HydrophobicContact CG2-CG2 3.94Å; Y314-I324 HydrophobicContact CD1-CD1 4.11Å; Y314-I324 HydrophobicContact CE1-CD1 3.55Å; M320-I324 HydrophobicContact CE-CB 3.54Å; M320-I324 HydrophobicContact CE-CG2 3.37Å; M320-I324 HydrophobicContact SD-CB 4.04Å; M320-I324 HydrophobicContact SD-CG2 3.65Å; N321-I324 HydrophobicContact CB-CD1 4.48Å; N321-I324 HydrophobicContact CB-CG1 4.45Å; N321-I324 PolarHBondContact O-N 3.45Å; K322-I324 PolarHBondContact O-N 2.91Å; I324-T326 VanDerWaalsContact C-N 3.31Å; I324-T326 PolarHBondContact O-N 3.29Å; I324-V327 PolarHBondContact O-N 2.86Å; I324-F328 WeakPolarHBondContact O-CB 3.47Å; I324-F328 PolarHBondContact O-N 2.78Å
325	K	80.6	Confident	82.2	Confident	40 Å²	40	69.7 Å²	69.7	17%	0.174	36%	0.361	C	S	.	.	H	α-helix	trans	-60.6	-40.7	172.6	-62.3	-171.5	-179.2	-160.8	0	111.2	I59 D215 M320 N321 K322 F328 A329	I59-K325 HydrophobicContact CD1-CB 3.77Å; I59-K325 HydrophobicContact CD1-CD 3.38Å; I59-K325 HydrophobicContact CD1-CG 4.16Å; D215-K325 VanDerWaalsContact O-CE 3.26Å; D215-K325 WeakPolarHBondContact O-CE 3.38Å; D215-K325 PolarHBondContact O-NZ 3.44Å; D215-K325 IonicContact OD1-NZ 2.65Å; D215-K325 PolarHBondContact OD1-NZ 3.03Å; M320-K325 HydrophobicContact CB-CD 4.33Å; M320-K325 HydrophobicContact CB-CG 4.04Å; M320-K325 HydrophobicContact CE-CB 4.3Å; M320-K325 HydrophobicContact CE-CG 3.54Å; N321-K325 PolarHBondContact O-N 3.4Å; N321-K325 VanDerWaalsContact O-N 3.17Å; K322-K325 PolarHBondContact O-N 3.39Å; K325-F328 PolarHBondContact O-N 3.14Å; K325-A329 PolarHBondContact O-N 3.03Å
326	T	80.3	Confident	81.8	Confident	19 Å²	19	73.9 Å²	73.9	12%	0.117	38%	0.383	C	S	.	.	H	α-helix	trans	-64.1	-47	173.5	-53.9	0	0	0	0	112	K322 L323 I324 F328 A329 F330	K322-T326 PolarHBondContact O-N 3.3Å; K322-T326 PolarHBondContact O-OG1 2.88Å; L323-T326 WeakPolarHBondContact O-CB 3.19Å; L323-T326 PolarHBondContact O-N 3.05Å; I324-T326 VanDerWaalsContact C-N 3.31Å; I324-T326 PolarHBondContact O-N 3.29Å; T326-F328 VanDerWaalsContact C-N 3.29Å; T326-F328 PolarHBondContact O-N 3.37Å; T326-A329 WeakPolarHBondContact O-CB 3.27Å; T326-A329 PolarHBondContact O-N 3.43Å; T326-A329 VanDerWaalsContact O-N 3.15Å; T326-F330 HydrophobicContact CG2-CD2 4.39Å; T326-F330 HydrophobicContact CG2-CE2 4.05Å; T326-F330 VanDerWaalsContact O-CD2 3.32Å; T326-F330 WeakPolarHBondContact O-CD2 3.31Å
327	V	83.6	Confident	81.4	Confident	70 Å²	70	77.5 Å²	77.5	42%	0.424	40%	0.4	S	S	.	.	H	α-helix	trans	-59.6	-41.9	178.4	169.8	0	0	0	0	111.2	I311 L323 I324 A329 F330 C331	I311-V327 HydrophobicContact CD1-CG1 4.21Å; L323-V327 WeakPolarHBondContact O-CG2 3.33Å; L323-V327 PolarHBondContact O-N 3.39Å; I324-V327 PolarHBondContact O-N 2.86Å; V327-A329 VanDerWaalsContact C-N 3.28Å; V327-A329 PolarHBondContact O-N 3.48Å; V327-F330 PolarHBondContact O-N 3.26Å; V327-F330 VanDerWaalsContact O-N 3.1Å; V327-C331 PolarHBondContact O-N 2.92Å; V327-C331 PolarHBondContact O-SG 2.86Å
328	F	83	Confident	81	Confident	29 Å²	29	71.2 Å²	71.2	13%	0.127	38%	0.377	C	S	.	.	H	α-helix	trans	-59	-39.1	176.8	-176.4	-95.8	0	0	0	112.4	I216 F217 L308 I311 M312 I324 K325 T326 F330 C331	I216-F328 HydrophobicContact CD1-CD2 4.18Å; I216-F328 HydrophobicContact CD1-CE2 4.49Å; I216-F328 HydrophobicContact CD1-CG 4.25Å; I216-F328 HydrophobicContact CG2-CD1 3.44Å; I216-F328 VanDerWaalsContact CG2-CD1 3.44Å; I216-F328 HydrophobicContact CG2-CD2 4.48Å; I216-F328 HydrophobicContact CG2-CE1 3.23Å; I216-F328 HydrophobicContact CG2-CE2 4.31Å; I216-F328 HydrophobicContact CG2-CG 4.09Å; I216-F328 HydrophobicContact CG2-CZ 3.72Å; F217-F328 HydrophobicContact CE1-CE1 4.17Å; F217-F328 HydrophobicContact CE1-CZ 4.25Å; F217-F328 HydrophobicContact CE2-CE1 4.48Å; F217-F328 HydrophobicContact CE2-CZ 4.03Å; F217-F328 AromaticContact CZ-CE1 3.87Å; F217-F328 HydrophobicContact CZ-CE1 3.87Å; F217-F328 AromaticContact CZ-CZ 3.52Å; F217-F328 HydrophobicContact CZ-CZ 3.52Å; L308-F328 HydrophobicContact CD2-CE2 4.03Å; I311-F328 HydrophobicContact CB-CD2 4.23Å; I311-F328 HydrophobicContact CG2-CB 4.17Å; I311-F328 HydrophobicContact CG2-CD2 3.72Å; I311-F328 HydrophobicContact CG2-CG 4.31Å; M312-F328 HydrophobicContact CE-CE2 3.76Å; M312-F328 HydrophobicContact CE-CZ 3.74Å; M312-F328 HydrophobicContact CG-CE2 3.98Å; I324-F328 WeakPolarHBondContact O-CB 3.47Å; I324-F328 PolarHBondContact O-N 2.78Å; K325-F328 PolarHBondContact O-N 3.14Å; T326-F328 VanDerWaalsContact C-N 3.29Å; T326-F328 PolarHBondContact O-N 3.37Å; F328-F330 PolarHBondContact O-N 2.84Å; F328-C331 PolarHBondContact O-N 3.05Å; F328-C331 VanDerWaalsContact O-N 3.08Å
329	A	78.9	Confident	80.7	Confident	38 Å²	38	74.7 Å²	74.7	31%	0.314	39%	0.385	S	S	.	.	H	α-helix	trans	-63.1	-22.1	178.1	0	0	0	0	0	113.8	L60 I68 K325 T326 V327	L60-A329 HydrophobicContact CD1-CB 4.01Å; L60-A329 HydrophobicContact CD2-CB 4.17Å; L60-A329 HydrophobicContact CG-CB 4.48Å; I68-A329 HydrophobicContact CD1-CB 4.18Å; K325-A329 PolarHBondContact O-N 3.03Å; T326-A329 WeakPolarHBondContact O-CB 3.27Å; T326-A329 PolarHBondContact O-N 3.43Å; T326-A329 VanDerWaalsContact O-N 3.15Å; V327-A329 VanDerWaalsContact C-N 3.28Å; V327-A329 PolarHBondContact O-N 3.48Å
330	F	78.6	Confident	80.8	Confident	96 Å²	96	66 Å²	66	42%	0.421	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-7.9	176.4	-77	-86.8	0	0	0	114	L60 Q64 I68 T326 V327 F328	L60-F330 HydrophobicContact CD2-CE2 4.22Å; Q64-F330 HydrophobicContact CB-CE2 4.4Å; Q64-F330 HydrophobicContact CB-CZ 4.02Å; Q64-F330 HydrophobicContact CG-CZ 4.3Å; I68-F330 HydrophobicContact CD1-CD1 3.82Å; I68-F330 HydrophobicContact CD1-CD2 3.88Å; I68-F330 HydrophobicContact CD1-CE1 3.73Å; I68-F330 HydrophobicContact CD1-CE2 3.77Å; I68-F330 HydrophobicContact CD1-CG 3.9Å; I68-F330 HydrophobicContact CD1-CZ 3.69Å; I68-F330 HydrophobicContact CG1-CD1 3.54Å; I68-F330 HydrophobicContact CG1-CD2 4.45Å; I68-F330 HydrophobicContact CG1-CE1 3.23Å; I68-F330 HydrophobicContact CG1-CE2 4.19Å; I68-F330 HydrophobicContact CG1-CG 4.15Å; I68-F330 HydrophobicContact CG1-CZ 3.58Å; T326-F330 HydrophobicContact CG2-CD2 4.39Å; T326-F330 HydrophobicContact CG2-CE2 4.05Å; T326-F330 VanDerWaalsContact O-CD2 3.32Å; T326-F330 WeakPolarHBondContact O-CD2 3.31Å; V327-F330 PolarHBondContact O-N 3.26Å; V327-F330 VanDerWaalsContact O-N 3.1Å; F328-F330 PolarHBondContact O-N 2.84Å
331	C	77.4	Confident	80.9	Confident	92 Å²	92	70.6 Å²	70.6	62%	0.622	38%	0.378	S	S	*	.			trans	-86.7	0	-178.9	-65.3	0	0	0	0	111.4	L308 V327 F328	L308-C331 HydrophobicContact CD2-CB 3.38Å; L308-C331 HydrophobicContact CG-CB 4.13Å; V327-C331 PolarHBondContact O-N 2.92Å; V327-C331 PolarHBondContact O-SG 2.86Å; F328-C331 PolarHBondContact O-N 3.05Å; F328-C331 VanDerWaalsContact O-N 3.08Å

Retrieved 331 of 331 residues in 486.7 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).