Q99NU3_MOUSE Loading...

Cannabinoid receptor 1

AlphaFold DB , UniProt , Accession Q99NU3, Species MOUSE (Mus musculus, Mouse), Gene Cnr1, Length 331 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	F	31.8	Very low	29.4	Very low	270 Å²	270	165.7 Å²	165.7	100%	1.184	84%	0.837	S	S	*	*				0	109.5	0	-74.4	-88.5	0	0	0	107.5
2	R	32.3	Very low	29.2	Very low	253 Å²	253	161.1 Å²	161.1	96%	0.955	84%	0.843	S	S	*	*			cis	-133.3	148.4	17.2	-94.4	165.4	176.7	176.6	0.8	106.1
3	G	28.6	Very low	29	Very low	68 Å²	68	154.6 Å²	154.6	70%	0.701	84%	0.839	S	S	*	*			cis	127.2	93	22.2	0	0	0	0	0	108.9
4	S	30.5	Very low	29	Very low	117 Å²	117	154.1 Å²	154.1	82%	0.818	84%	0.836	S	S	*	*			trans	30.1	164.6	136.9	-43.3	0	0	0	0	120.9
5	P	41.9	Very low	28.9	Very low	116 Å²	116	154.1 Å²	154.1	75%	0.753	84%	0.835	S	S	*	*			cis	-148.1	156.7	27.2	27.5	0.2	0	0	0	120.2
6	F	26.5	Very low	29	Very low	184 Å²	184	151.4 Å²	151.4	81%	0.807	83%	0.831	S	S	*	*				52.5	124.9	125.6	-125.9	-104.1	0	0	0	120.5
7	Q	27.4	Very low	29.6	Very low	176 Å²	176	149.1 Å²	149.1	82%	0.822	83%	0.825	S	S	*	*				-170	124.6	95	-156.7	161.7	3.8	0	0	112.8
8	E	26	Very low	29.4	Very low	136 Å²	136	149.7 Å²	149.7	64%	0.636	83%	0.826	S	S	*	*			trans	-79.3	140	171.7	-173.7	175.5	-161.3	0	0	110.2
9	K	26.4	Very low	29.8	Very low	202 Å²	202	148.8 Å²	148.8	88%	0.878	83%	0.825	S	S	*	*			trans	-142.6	100.5	155.4	-112.6	-176.5	-177.6	-178.5	0	109.8
10	M	24.5	Very low	29.8	Very low	160 Å²	160	147.2 Å²	147.2	79%	0.788	82%	0.821	S	S	*	*			trans	-65.7	134.4	155.7	-81.1	174	173.4	0	0	109.7
11	T	27.8	Very low	30.2	Very low	141 Å²	141	144.9 Å²	144.9	87%	0.865	82%	0.821	S	S	*	*			trans	-136	124.6	141.9	32.2	0	0	0	0	108.2
12	A	27	Very low	30.6	Very low	110 Å²	110	135.1 Å²	135.1	91%	0.909	80%	0.797	S	S	*	*			trans	-64.4	148.1	-179.7	0	0	0	0	0	112.5
13	G	26.3	Very low	30.6	Very low	77 Å²	77	130.1 Å²	130.1	79%	0.794	79%	0.789	S	S	*	*			trans	-160.7	80.7	170.6	0	0	0	0	0	107.6
14	D	29.6	Very low	31.2	Very low	148 Å²	148	133 Å²	133	79%	0.791	79%	0.793	S	S	*	*			trans	-54.6	144.4	172.3	-141.8	-8.5	0	0	0	110.8
15	N	27.5	Very low	31.8	Very low	154 Å²	154	133.1 Å²	133.1	82%	0.824	79%	0.789	S	S	*	*			trans	150.2	87.7	151.4	-76	-14	0	0	0	112
16	S	29.7	Very low	32.1	Very low	110 Å²	110	132 Å²	132	77%	0.769	78%	0.777	S	S	*	*				-83.3	156	127.9	-55.8	0	0	0	0	106.7
17	P	38.9	Very low	33.2	Very low	113 Å²	113	129.9 Å²	129.9	73%	0.734	77%	0.772	S	S	*	*			cis	-136.7	175.7	17.3	39.1	-20.6	0	0	0	113.1
18	L	27.1	Very low	34.1	Very low	159 Å²	159	125.7 Å²	125.7	83%	0.832	76%	0.759	S	S	*	*			trans	168.4	111.7	135	-92	147.1	0	0	0	110	P20	L18-P20 WeakPolarHBondContact O-CD 3.44Å
19	V	36.3	Very low	35	Very low	133 Å²	133	125.3 Å²	125.3	81%	0.806	76%	0.757	S	S	*	*			trans	-68.1	119.2	157.1	171.5	0	0	0	0	106.8	A21	V19-A21 PolarHBondContact O-N 3.27Å
20	P	30.4	Very low	36	Very low	117 Å²	117	123.5 Å²	123.5	76%	0.76	75%	0.75	S	S	*	*			trans	-80.5	114	163.4	2.4	16.9	0	0	0	107.3	L18	L18-P20 WeakPolarHBondContact O-CD 3.44Å
21	A	38.3	Very low	36.7	Very low	99 Å²	99	123.7 Å²	123.7	82%	0.818	74%	0.743	S	S	*	*			trans	-67.3	131.5	158	0	0	0	0	0	108.4	V19	V19-A21 PolarHBondContact O-N 3.27Å
22	G	39.2	Very low	37.4	Very low	65 Å²	65	121.5 Å²	121.5	67%	0.67	73%	0.725	S	S	*	*			trans	96.2	91.5	168.7	0	0	0	0	0	114.3
23	D	32	Very low	38	Very low	148 Å²	148	123.8 Å²	123.8	79%	0.791	72%	0.715	S	S	*	*				-156.9	103.6	126.9	-105.2	-20.2	0	0	0	108.3	T25	D23-T25 PolarHBondContact O-N 3.49Å; D23-T25 PolarHBondContact O-OG1 2.96Å
24	T	41.5	Very low	38.9	Very low	129 Å²	129	122.5 Å²	122.5	79%	0.791	69%	0.694	S	S	*	*			trans	-61.5	78.7	159.8	37.2	0	0	0	0	107.8	N26	T24-N26 PolarHBondContact O-N 2.88Å
25	T	44.7	Very low	39.5	Very low	119 Å²	119	119.8 Å²	119.8	73%	0.73	68%	0.679	S	S	*	*			trans	-62.4	109.2	163.2	18.2	0	0	0	0	105.9	D23 I27	D23-T25 PolarHBondContact O-N 3.49Å; D23-T25 PolarHBondContact O-OG1 2.96Å; T25-I27 PolarHBondContact O-N 3.14Å
26	N	46.4	Very low	40.2	Very low	92 Å²	92	115.1 Å²	115.1	49%	0.492	66%	0.658	S	S	.	*			trans	-51.9	113.8	-165.2	-80.7	-47.3	0	0	0	110.6	T24 T28 E29 F30	T24-N26 PolarHBondContact O-N 2.88Å; N26-T28 PolarHBondContact O-N 3.12Å; N26-T28 VanDerWaalsContact O-N 3.1Å; N26-E29 HydrophobicContact CB-CB 3.79Å; N26-E29 WeakPolarHBondContact O-CA 3.43Å; N26-E29 VanDerWaalsContact O-CB 3.3Å; N26-E29 WeakPolarHBondContact O-CB 3.49Å; N26-E29 PolarHBondContact O-N 2.92Å; N26-F30 PolarHBondContact O-N 3.25Å
27	I	50.7	Low	40.4	Very low	140 Å²	140	113.1 Å²	113.1	72%	0.718	64%	0.644	S	S	*	*	H	α-helix	trans	-51.9	-32.1	166.7	-64.4	170.8	0	0	0	109.5	T25 E29 F30 Y31	T25-I27 PolarHBondContact O-N 3.14Å; I27-E29 VanDerWaalsContact C-N 3.3Å; I27-E29 PolarHBondContact O-N 3.46Å; I27-F30 PolarHBondContact O-N 3.49Å; I27-Y31 WeakPolarHBondContact O-CB 3.34Å; I27-Y31 PolarHBondContact O-N 3.16Å
28	T	46.4	Very low	40.4	Very low	88 Å²	88	115.3 Å²	115.3	54%	0.54	64%	0.642	S	S	.	*	H	α-helix	trans	-59.7	-33.7	171.5	-25.7	0	0	0	0	113.5	N26 N32	N26-T28 PolarHBondContact O-N 3.12Å; N26-T28 VanDerWaalsContact O-N 3.1Å; T28-N32 WeakPolarHBondContact O-CB 3.49Å; T28-N32 PolarHBondContact O-N 3.45Å; T28-N32 PolarHBondContact O-ND2 2.94Å; T28-N32 PolarHBondContact O-OD1 3.29Å
29	E	45.2	Very low	41.1	Very low	127 Å²	127	114 Å²	114	59%	0.593	63%	0.63	S	S	*	*	H	α-helix	trans	-80.6	-34.6	179.5	-161.8	169.6	-157.8	0	0	111.1	N26 I27 N32 K33	N26-E29 HydrophobicContact CB-CB 3.79Å; N26-E29 WeakPolarHBondContact O-CA 3.43Å; N26-E29 VanDerWaalsContact O-CB 3.3Å; N26-E29 WeakPolarHBondContact O-CB 3.49Å; N26-E29 PolarHBondContact O-N 2.92Å; I27-E29 VanDerWaalsContact C-N 3.3Å; I27-E29 PolarHBondContact O-N 3.46Å; E29-N32 PolarHBondContact O-N 3.27Å; E29-K33 WeakPolarHBondContact O-CB 3.33Å; E29-K33 PolarHBondContact O-N 3.08Å
30	F	45.8	Very low	41.2	Very low	165 Å²	165	114.7 Å²	114.7	72%	0.724	63%	0.625	S	S	*	*	H	α-helix	trans	-66.5	-38.5	167.6	-162.7	-91.3	0	0	0	111.7	N26 I27 S34	N26-F30 PolarHBondContact O-N 3.25Å; I27-F30 PolarHBondContact O-N 3.49Å; F30-S34 WeakPolarHBondContact O-CB 3.29Å; F30-S34 PolarHBondContact O-N 2.95Å; F30-S34 PolarHBondContact O-OG 3.4Å
31	Y	40.7	Very low	41.5	Very low	164 Å²	164	114.7 Å²	114.7	64%	0.643	62%	0.618	S	S	*	*	H	α-helix	trans	-66.1	-42.6	172.6	-124.9	-89.4	0	0	0	111.8	I27 S34 L35	I27-Y31 WeakPolarHBondContact O-CB 3.34Å; I27-Y31 PolarHBondContact O-N 3.16Å; Y31-S34 WeakPolarHBondContact CA-OG 3.32Å; Y31-S34 PolarHBondContact O-N 2.95Å; Y31-S34 PolarHBondContact O-OG 3.47Å; Y31-L35 WeakPolarHBondContact O-CB 3.37Å; Y31-L35 PolarHBondContact O-N 3.42Å
32	N	42.3	Very low	41.8	Very low	94 Å²	94	115.4 Å²	115.4	50%	0.503	61%	0.605	S	S	.	*	H	α-helix	trans	-70.2	-33.5	178.5	-74.6	-17.9	0	0	0	112.1	T28 E29 L35 S36	T28-N32 WeakPolarHBondContact O-CB 3.49Å; T28-N32 PolarHBondContact O-N 3.45Å; T28-N32 PolarHBondContact O-ND2 2.94Å; T28-N32 PolarHBondContact O-OD1 3.29Å; E29-N32 PolarHBondContact O-N 3.27Å; N32-L35 PolarHBondContact O-N 2.93Å; N32-S36 VanDerWaalsContact O-CB 3.28Å; N32-S36 WeakPolarHBondContact O-CB 3.3Å; N32-S36 PolarHBondContact O-N 2.94Å; N32-S36 PolarHBondContact O-OG 3.38Å
33	K	39	Very low	41.7	Very low	158 Å²	158	119.1 Å²	119.1	69%	0.687	61%	0.609	S	S	*	*	H	α-helix	trans	-74	-34.8	176	-167.4	172.2	-175	176.2	0	112.5	E29 S36 S37	E29-K33 WeakPolarHBondContact O-CB 3.33Å; E29-K33 PolarHBondContact O-N 3.08Å; K33-S36 WeakPolarHBondContact CA-OG 3.38Å; K33-S36 PolarHBondContact O-OG 3.32Å; K33-S37 VanDerWaalsContact O-CB 3.27Å; K33-S37 WeakPolarHBondContact O-CB 3.37Å; K33-S37 PolarHBondContact O-N 3.48Å
34	S	45.2	Very low	41.8	Very low	50 Å²	50	119 Å²	119	35%	0.35	61%	0.609	S	S	.	*	H	α-helix	trans	-72.3	-36.1	170.2	51.8	0	0	0	0	111.9	F30 Y31 S37 F38	F30-S34 WeakPolarHBondContact O-CB 3.29Å; F30-S34 PolarHBondContact O-N 2.95Å; F30-S34 PolarHBondContact O-OG 3.4Å; Y31-S34 WeakPolarHBondContact CA-OG 3.32Å; Y31-S34 PolarHBondContact O-N 2.95Å; Y31-S34 PolarHBondContact O-OG 3.47Å; S34-S37 PolarHBondContact O-N 3.22Å; S34-F38 WeakPolarHBondContact O-CB 3.48Å; S34-F38 PolarHBondContact O-N 3.48Å
35	L	42.4	Very low	41.9	Very low	92 Å²	92	117.6 Å²	117.6	48%	0.482	60%	0.595	S	S	.	*	H	α-helix	trans	-70.2	-34.9	174.3	-166.5	73.8	0	0	0	112.5	Y31 N32 F38 K39	Y31-L35 WeakPolarHBondContact O-CB 3.37Å; Y31-L35 PolarHBondContact O-N 3.42Å; N32-L35 PolarHBondContact O-N 2.93Å; L35-F38 PolarHBondContact O-N 3.43Å; L35-K39 WeakPolarHBondContact O-CB 3.27Å; L35-K39 PolarHBondContact O-N 3.32Å
36	S	42.1	Very low	41.3	Very low	56 Å²	56	120.7 Å²	120.7	39%	0.392	60%	0.601	S	S	.	*	H	α-helix	trans	-72.2	-39	173.9	70	0	0	0	0	111.4	N32 K33 F38 K39 E40	N32-S36 VanDerWaalsContact O-CB 3.28Å; N32-S36 WeakPolarHBondContact O-CB 3.3Å; N32-S36 PolarHBondContact O-N 2.94Å; N32-S36 PolarHBondContact O-OG 3.38Å; K33-S36 WeakPolarHBondContact CA-OG 3.38Å; K33-S36 PolarHBondContact O-OG 3.32Å; S36-F38 VanDerWaalsContact C-N 3.28Å; S36-F38 PolarHBondContact O-N 2.87Å; S36-K39 PolarHBondContact O-N 2.92Å; S36-E40 PolarHBondContact O-N 2.93Å
37	S	33.3	Very low	41.2	Very low	67 Å²	67	120.4 Å²	120.4	47%	0.469	61%	0.605	S	S	.	*	H	α-helix	trans	-63.9	-32.1	170	169.4	0	0	0	0	112.4	K33 S34 N41	K33-S37 VanDerWaalsContact O-CB 3.27Å; K33-S37 WeakPolarHBondContact O-CB 3.37Å; K33-S37 PolarHBondContact O-N 3.48Å; S34-S37 PolarHBondContact O-N 3.22Å; S37-N41 PolarHBondContact O-N 2.66Å
38	F	40	Very low	40.5	Very low	160 Å²	160	116 Å²	116	70%	0.702	59%	0.594	S	S	*	*	H	α-helix	trans	-70.8	-40.7	171.5	-117.9	-89.6	0	0	0	111.9	S34 L35 S36 N41 E42	S34-F38 WeakPolarHBondContact O-CB 3.48Å; S34-F38 PolarHBondContact O-N 3.48Å; L35-F38 PolarHBondContact O-N 3.43Å; S36-F38 VanDerWaalsContact C-N 3.28Å; S36-F38 PolarHBondContact O-N 2.87Å; F38-N41 PolarHBondContact O-N 2.89Å; F38-E42 PolarHBondContact O-N 2.82Å
39	K	42.2	Very low	40.4	Very low	130 Å²	130	121.5 Å²	121.5	57%	0.565	61%	0.614	S	S	*	*	H	α-helix	trans	-69.4	-40	177.4	-89.5	-178.3	171.1	-179.5	0	113.6	L35 S36 N41 E42	L35-K39 WeakPolarHBondContact O-CB 3.27Å; L35-K39 PolarHBondContact O-N 3.32Å; S36-K39 PolarHBondContact O-N 2.92Å; K39-N41 PolarHBondContact O-N 3.49Å; K39-E42 WeakPolarHBondContact O-CB 3.44Å; K39-E42 PolarHBondContact O-N 3.45Å; K39-E42 VanDerWaalsContact O-N 3.08Å
40	E	37.6	Very low	40.1	Very low	149 Å²	149	122.2 Å²	122.2	70%	0.696	62%	0.622	S	S	*	*	H	α-helix	trans	-66.9	-25.6	176	-85.3	-176.5	149.6	0	0	112.5	S36	S36-E40 PolarHBondContact O-N 2.93Å
41	N	37.3	Very low	40	Very low	117 Å²	117	119.1 Å²	119.1	63%	0.626	61%	0.608	S	S	*	*	H	α-helix	trans	-80	-18.3	171.3	-91.8	-6.3	0	0	0	113.5	S37 F38 K39 I45	S37-N41 PolarHBondContact O-N 2.66Å; F38-N41 PolarHBondContact O-N 2.89Å; K39-N41 PolarHBondContact O-N 3.49Å; N41-I45 WeakPolarHBondContact O-CG1 3.3Å
42	E	43.4	Very low	40.1	Very low	114 Å²	114	116.2 Å²	116.2	53%	0.533	60%	0.602	S	S	.	*	H	α-helix	trans	-77.1	-30.4	178.9	-112.4	-172.2	135.9	0	0	112.8	F38 K39	F38-E42 PolarHBondContact O-N 2.82Å; K39-E42 WeakPolarHBondContact O-CB 3.44Å; K39-E42 PolarHBondContact O-N 3.45Å; K39-E42 VanDerWaalsContact O-N 3.08Å
43	D	38.4	Very low	40.2	Very low	142 Å²	142	114.4 Å²	114.4	76%	0.759	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.3	-5.3	-173.9	-73.4	-27.9	0	0	0	114
44	N	34.2	Very low	40.7	Very low	147 Å²	147	110.4 Å²	110.4	79%	0.786	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.3	18.4	-179.4	-89.4	-29.2	0	0	0	114.6	Q46	N44-Q46 PolarHBondContact O-N 3.25Å
45	I	41.8	Very low	40.8	Very low	99 Å²	99	113.7 Å²	113.7	51%	0.508	59%	0.587	S	S	.	*			trans	-82.1	87.7	170.9	-48.4	-175.8	0	0	0	108.6	N41 C47	N41-I45 WeakPolarHBondContact O-CG1 3.3Å; I45-C47 VanDerWaalsContact C-N 3.34Å; I45-C47 PolarHBondContact O-N 3.25Å
46	Q	33.7	Very low	41.1	Very low	184 Å²	184	111.1 Å²	111.1	86%	0.86	58%	0.576	S	S	*	*			trans	-69.6	95.9	161.6	-165.7	157.7	0.5	0	0	106.5	N44 G48	N44-Q46 PolarHBondContact O-N 3.25Å; Q46-G48 VanDerWaalsContact C-N 3.32Å; Q46-G48 PolarHBondContact O-N 2.88Å
47	C	42.7	Very low	41.7	Very low	85 Å²	85	112.3 Å²	112.3	57%	0.574	57%	0.574	S	S	*	*			trans	-57.7	98.6	179.5	-55.5	0	0	0	0	107.3	I45 C56	I45-C47 VanDerWaalsContact C-N 3.34Å; I45-C47 PolarHBondContact O-N 3.25Å; C47-C56 WeakPolarHBondContact CB-SG 3.13Å; C47-C56 WeakPolarHBondContact SG-CB 3.49Å; C47-C56 CovalentContact SG-SG 2.11Å; C47-C56 PolarHBondContact SG-SG 3.46Å
48	G	36.1	Very low	42.7	Very low	47 Å²	47	112.6 Å²	112.6	49%	0.485	57%	0.569	S	S	.	*			trans	-85.3	158.4	-172.6	0	0	0	0	0	110.9	Q46 N50	Q46-G48 VanDerWaalsContact C-N 3.32Å; Q46-G48 PolarHBondContact O-N 2.88Å; G48-N50 PolarHBondContact O-N 3.34Å
49	E	45.4	Very low	43.9	Very low	204 Å²	204	107 Å²	107	95%	0.953	55%	0.546	S	S	*	.	S	Bend	trans	-58.1	7.7	-174.7	-64.2	-177.6	131.8	0	0	116.5
50	N	38.7	Very low	45.2	Very low	143 Å²	143	102.4 Å²	102.4	77%	0.765	53%	0.527	S	S	*	.	S	Bend	trans	-110.5	98.1	-177.7	-70.5	-37.5	0	0	0	112.2	G48 M52	G48-N50 PolarHBondContact O-N 3.34Å; N50-M52 PolarHBondContact O-N 3.17Å
51	F	43.4	Very low	47.1	Very low	100 Å²	100	99.9 Å²	99.9	44%	0.439	52%	0.519	S	S	.	.	S	Bend	trans	14.1	19	151.2	-167.3	-109.3	0	0	0	123	D133 P135	F51-D133 WeakPolarHBondContact CZ-O 3.36Å; F51-P135 HydrophobicContact CD2-CB 4.47Å; F51-P135 HydrophobicContact CD2-CG 3.87Å; F51-P135 HydrophobicContact CE1-CG 4.02Å; F51-P135 HydrophobicContact CE2-CB 3.68Å; F51-P135 HydrophobicContact CE2-CG 3.28Å; F51-P135 HydrophobicContact CG-CG 4.49Å; F51-P135 HydrophobicContact CZ-CB 4.06Å; F51-P135 HydrophobicContact CZ-CG 3.41Å; F51-P135 VanDerWaalsContact CZ-CG 3.41Å
52	M	42.1	Very low	49.1	Very low	103 Å²	103	99.3 Å²	99.3	51%	0.507	52%	0.521	S	S	.	.			trans	-130	20.1	-177.1	-80.4	-65.2	-165.4	0	0	114.9	N50 K132	N50-M52 PolarHBondContact O-N 3.17Å; M52-K132 HydrophobicContact CE-CB 4.41Å; M52-K132 HydrophobicContact CE-CD 3.86Å; M52-K132 HydrophobicContact SD-CB 4.42Å; M52-K132 HydrophobicContact SD-CD 3.52Å; M52-K132 VanDerWaalsContact SD-CD 3.52Å
53	D	44.4	Very low	50.9	Low	55 Å²	55	98 Å²	98	29%	0.294	53%	0.525	S	S	.	.			trans	-111.2	50.1	178	-78.1	-21	0	0	0	112.7	E55 C56 F57	D53-E55 PolarHBondContact O-N 2.9Å; D53-C56 HydrophobicContact CB-CB 3.78Å; D53-C56 VanDerWaalsContact CG-SG 3.57Å; D53-C56 PolarHBondContact O-N 3.11Å; D53-C56 VanDerWaalsContact O-N 3.16Å; D53-C56 PolarHBondContact OD2-SG 3.13Å; D53-F57 WeakPolarHBondContact O-CD2 3.21Å
54	M	49.6	Very low	52.9	Low	74 Å²	74	93.7 Å²	93.7	37%	0.365	50%	0.5	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-20.5	155.1	-159.3	141.3	-172.5	0	0	110.5	F57 M58 F126 F138	M54-F57 PolarHBondContact O-N 2.94Å; M54-M58 PolarHBondContact O-N 3.43Å; M54-F126 HydrophobicContact CG-CE2 4.21Å; M54-F126 HydrophobicContact CG-CZ 4.46Å; M54-F126 HydrophobicContact SD-CE2 4.42Å; M54-F138 HydrophobicContact CE-CD2 3.47Å; M54-F138 VanDerWaalsContact CE-CD2 3.47Å; M54-F138 HydrophobicContact CE-CE2 3.17Å; M54-F138 HydrophobicContact CE-CZ 4.02Å; M54-F138 HydrophobicContact SD-CD2 4.03Å; M54-F138 HydrophobicContact SD-CE2 4.26Å
55	E	48.5	Very low	55	Low	120 Å²	120	89.1 Å²	89.1	56%	0.561	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-34.4	168.3	-69	172.8	-156.7	0	0	112.6	D53 F57 M58 K132	D53-E55 PolarHBondContact O-N 2.9Å; E55-F57 PolarHBondContact O-N 3.35Å; E55-M58 PolarHBondContact O-N 2.77Å; E55-K132 IonicContact OE1-NZ 2.81Å
56	C	49	Very low	56.9	Low	38 Å²	38	89.9 Å²	89.9	26%	0.257	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-24.2	173.9	-82.8	0	0	0	0	112.4	C47 D53	C47-C56 WeakPolarHBondContact CB-SG 3.13Å; C47-C56 WeakPolarHBondContact SG-CB 3.49Å; C47-C56 CovalentContact SG-SG 2.11Å; C47-C56 PolarHBondContact SG-SG 3.46Å; D53-C56 HydrophobicContact CB-CB 3.78Å; D53-C56 VanDerWaalsContact CG-SG 3.57Å; D53-C56 PolarHBondContact O-N 3.11Å; D53-C56 VanDerWaalsContact O-N 3.16Å; D53-C56 PolarHBondContact OD2-SG 3.13Å
57	F	53	Low	59.4	Low	80 Å²	80	83.2 Å²	83.2	35%	0.351	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-12.5	176.8	-67.7	-89.6	0	0	0	113	D53 M54 E55 I59 D215 P218	D53-F57 WeakPolarHBondContact O-CD2 3.21Å; M54-F57 PolarHBondContact O-N 2.94Å; E55-F57 PolarHBondContact O-N 3.35Å; F57-I59 VanDerWaalsContact C-N 3.29Å; F57-I59 PolarHBondContact O-N 3.1Å; F57-D215 WeakPolarHBondContact CE1-O 3.48Å; F57-P218 HydrophobicContact CD1-CG 4.22Å; F57-P218 HydrophobicContact CD2-CG 3.88Å; F57-P218 HydrophobicContact CE1-CG 4.32Å; F57-P218 HydrophobicContact CE2-CB 4.24Å; F57-P218 HydrophobicContact CE2-CG 4Å; F57-P218 HydrophobicContact CG-CG 4Å; F57-P218 HydrophobicContact CZ-CB 4.43Å; F57-P218 HydrophobicContact CZ-CG 4.21Å
58	M	56.3	Low	61.3	Low	73 Å²	73	80.2 Å²	80.2	36%	0.36	43%	0.432	S	S	.	.			trans	-84.1	74.6	179.9	-160.7	167.8	67.6	0	0	110	M54 E55 L60 F126	M54-M58 PolarHBondContact O-N 3.43Å; E55-M58 PolarHBondContact O-N 2.77Å; M58-L60 PolarHBondContact O-N 3.47Å; M58-F126 HydrophobicContact SD-CE1 4.01Å; M58-F126 HydrophobicContact SD-CZ 4.29Å
59	I	63.3	Low	63.4	Low	44 Å²	44	78.8 Å²	78.8	23%	0.226	42%	0.416	C	S	.	.			trans	-79.6	5.9	-176.7	-60.7	160.7	0	0	0	112	F57 K322 K325	F57-I59 VanDerWaalsContact C-N 3.29Å; F57-I59 PolarHBondContact O-N 3.1Å; I59-K322 HydrophobicContact CG2-CB 3.91Å; I59-K322 HydrophobicContact CG2-CD 4.26Å; I59-K322 HydrophobicContact CG2-CG 4.03Å; I59-K325 HydrophobicContact CD1-CB 3.68Å; I59-K325 HydrophobicContact CD1-CD 3.34Å; I59-K325 HydrophobicContact CD1-CG 4.08Å
60	L	70.1	Confident	65.3	Low	32 Å²	32	73 Å²	73	17%	0.168	40%	0.395	C	S	.	.			trans	-93.4	138.1	-171	-76.4	82	0	0	0	112.1	M58 Q64 I68 A329	M58-L60 PolarHBondContact O-N 3.47Å; L60-Q64 HydrophobicContact CB-CB 4.32Å; L60-Q64 HydrophobicContact CD2-CB 4.27Å; L60-I68 HydrophobicContact CD2-CD1 3.17Å; L60-I68 HydrophobicContact CD2-CG1 4.34Å; L60-A329 HydrophobicContact CD1-CB 3.82Å; L60-A329 HydrophobicContact CD2-CB 4.05Å; L60-A329 HydrophobicContact CG-CB 4.49Å
61	N	78	Confident	67.7	Low	97 Å²	97	70.5 Å²	70.5	52%	0.519	38%	0.381	S	S	.	.			trans	-66.3	154.5	171.5	-64.7	-59.6	0	0	0	111.1	S63 Q64 Q65	N61-S63 PolarHBondContact O-N 3.16Å; N61-S63 VanDerWaalsContact O-N 3.13Å; N61-Q64 HydrophobicContact CB-CB 4.48Å; N61-Q64 HydrophobicContact CB-CG 4.27Å; N61-Q64 VanDerWaalsContact N-OE1 3.07Å; N61-Q64 PolarHBondContact ND2-OE1 2.82Å; N61-Q64 WeakPolarHBondContact O-CA 3.34Å; N61-Q64 WeakPolarHBondContact O-CB 3.41Å; N61-Q64 PolarHBondContact O-N 3.32Å; N61-Q65 PolarHBondContact O-N 3.41Å
62	P	78.5	Confident	69.6	Low	105 Å²	105	66.7 Å²	66.7	68%	0.682	37%	0.367	S	S	*	.	H	α-helix	trans	-54.7	-36.8	179.7	-27.9	34.8	0	0	0	114.1	L66	P62-L66 WeakPolarHBondContact O-CB 3.47Å; P62-L66 PolarHBondContact O-N 3.25Å
63	S	81.8	Confident	71.8	Confident	86 Å²	86	65.4 Å²	65.4	60%	0.601	36%	0.361	S	S	*	.	H	α-helix	trans	-68.1	-37.9	175.8	54.8	0	0	0	0	113	N61 A67	N61-S63 PolarHBondContact O-N 3.16Å; N61-S63 VanDerWaalsContact O-N 3.13Å; S63-A67 WeakPolarHBondContact O-CB 3.39Å; S63-A67 PolarHBondContact O-N 3.12Å
64	Q	80.7	Confident	74	Confident	51 Å²	51	66.2 Å²	66.2	24%	0.238	37%	0.368	C	S	.	.	H	α-helix	trans	-71	-41.2	176.6	-68	173.8	-49.5	0	0	110.8	L60 N61 L66 A67 I68 F330	L60-Q64 HydrophobicContact CB-CB 4.32Å; L60-Q64 HydrophobicContact CD2-CB 4.27Å; N61-Q64 HydrophobicContact CB-CB 4.48Å; N61-Q64 HydrophobicContact CB-CG 4.27Å; N61-Q64 VanDerWaalsContact N-OE1 3.07Å; N61-Q64 PolarHBondContact ND2-OE1 2.82Å; N61-Q64 WeakPolarHBondContact O-CA 3.34Å; N61-Q64 WeakPolarHBondContact O-CB 3.41Å; N61-Q64 PolarHBondContact O-N 3.32Å; Q64-L66 VanDerWaalsContact C-N 3.34Å; Q64-L66 PolarHBondContact O-N 3.5Å; Q64-A67 PolarHBondContact O-N 3.18Å; Q64-I68 WeakPolarHBondContact O-CG1 3.22Å; Q64-I68 PolarHBondContact O-N 3.44Å; Q64-F330 HydrophobicContact CB-CE2 4.48Å; Q64-F330 HydrophobicContact CB-CZ 4.01Å; Q64-F330 HydrophobicContact CG-CZ 4.2Å
65	Q	78.2	Confident	76	Confident	52 Å²	52	67.8 Å²	67.8	24%	0.243	38%	0.378	C	S	.	.	H	α-helix	trans	-59.2	-45.7	174.8	-167.6	-176.8	11.2	0	0	110.9	N61 A69 H127	N61-Q65 PolarHBondContact O-N 3.41Å; Q65-A69 VanDerWaalsContact O-CB 3.25Å; Q65-A69 WeakPolarHBondContact O-CB 3.41Å; Q65-A69 PolarHBondContact O-N 3.05Å; Q65-H127 PolarHBondContact NE2-CE1 3.37Å; Q65-H127 PolarHBondContact NE2-ND1 3.39Å
66	L	82.3	Confident	78	Confident	115 Å²	115	62.4 Å²	62.4	60%	0.602	35%	0.354	S	S	*	.	H	α-helix	trans	-64	-41.6	175	-178.9	63.8	0	0	0	112.3	P62 Q64 A69 V70	P62-L66 WeakPolarHBondContact O-CB 3.47Å; P62-L66 PolarHBondContact O-N 3.25Å; Q64-L66 VanDerWaalsContact C-N 3.34Å; Q64-L66 PolarHBondContact O-N 3.5Å; L66-A69 WeakPolarHBondContact O-CB 3.48Å; L66-A69 PolarHBondContact O-N 3.28Å; L66-V70 HydrophobicContact CD1-CG2 4.31Å; L66-V70 WeakPolarHBondContact O-CG2 3.27Å; L66-V70 PolarHBondContact O-N 3.29Å
67	A	85.1	Confident	79.9	Confident	43 Å²	43	63.8 Å²	63.8	36%	0.355	36%	0.362	S	S	.	.	H	α-helix	trans	-62.6	-48.3	178.7	0	0	0	0	0	111.8	S63 Q64 A69 V70 L71	S63-A67 WeakPolarHBondContact O-CB 3.39Å; S63-A67 PolarHBondContact O-N 3.12Å; Q64-A67 PolarHBondContact O-N 3.18Å; A67-A69 VanDerWaalsContact C-N 3.29Å; A67-A69 PolarHBondContact O-N 3.47Å; A67-V70 PolarHBondContact O-N 3.41Å; A67-L71 WeakPolarHBondContact O-CB 3.29Å; A67-L71 VanDerWaalsContact O-CG 3.29Å; A67-L71 WeakPolarHBondContact O-CG 3.5Å; A67-L71 PolarHBondContact O-N 3.31Å
68	I	82.3	Confident	81.9	Confident	22 Å²	22	65.6 Å²	65.6	11%	0.113	37%	0.369	C	S	.	.	H	α-helix	trans	-61.9	-41.5	175.3	-66.3	-179.5	0	0	0	110.1	L60 Q64 V70 L71 S72 A329 F330	L60-I68 HydrophobicContact CD2-CD1 3.17Å; L60-I68 HydrophobicContact CD2-CG1 4.34Å; Q64-I68 WeakPolarHBondContact O-CG1 3.22Å; Q64-I68 PolarHBondContact O-N 3.44Å; I68-V70 PolarHBondContact O-N 3.04Å; I68-L71 PolarHBondContact O-N 2.96Å; I68-S72 WeakPolarHBondContact O-CB 3.31Å; I68-S72 PolarHBondContact O-N 3.45Å; I68-S72 PolarHBondContact O-OG 2.76Å; I68-A329 HydrophobicContact CD1-CB 4.17Å; I68-F330 HydrophobicContact CD1-CD1 3.77Å; I68-F330 HydrophobicContact CD1-CD2 4.01Å; I68-F330 HydrophobicContact CD1-CE1 3.68Å; I68-F330 HydrophobicContact CD1-CE2 3.91Å; I68-F330 HydrophobicContact CD1-CG 3.93Å; I68-F330 HydrophobicContact CD1-CZ 3.74Å; I68-F330 HydrophobicContact CG1-CD1 3.51Å; I68-F330 HydrophobicContact CG1-CE1 3.25Å; I68-F330 HydrophobicContact CG1-CE2 4.38Å; I68-F330 HydrophobicContact CG1-CG 4.2Å; I68-F330 HydrophobicContact CG1-CZ 3.73Å
69	A	80.9	Confident	83.7	Confident	18 Å²	18	64.1 Å²	64.1	15%	0.149	37%	0.365	C	S	.	.	H	α-helix	trans	-54.3	-51.6	177.3	0	0	0	0	0	112.8	Q65 L66 A67 L73 F123	Q65-A69 VanDerWaalsContact O-CB 3.25Å; Q65-A69 WeakPolarHBondContact O-CB 3.41Å; Q65-A69 PolarHBondContact O-N 3.05Å; L66-A69 WeakPolarHBondContact O-CB 3.48Å; L66-A69 PolarHBondContact O-N 3.28Å; A67-A69 VanDerWaalsContact C-N 3.29Å; A67-A69 PolarHBondContact O-N 3.47Å; A69-L73 VanDerWaalsContact O-CB 3.3Å; A69-L73 WeakPolarHBondContact O-CB 3.5Å; A69-L73 PolarHBondContact O-N 2.99Å; A69-F123 HydrophobicContact CB-CE1 3.74Å; A69-F123 HydrophobicContact CB-CE2 4.04Å; A69-F123 HydrophobicContact CB-CZ 3.16Å
70	V	86	Confident	85.2	Confident	82 Å²	82	63.6 Å²	63.6	50%	0.497	36%	0.363	S	S	.	.	H	α-helix	trans	-65.6	-44.4	-179.4	173.9	0	0	0	0	110.3	L66 A67 I68 T74	L66-V70 HydrophobicContact CD1-CG2 4.31Å; L66-V70 WeakPolarHBondContact O-CG2 3.27Å; L66-V70 PolarHBondContact O-N 3.29Å; A67-V70 PolarHBondContact O-N 3.41Å; I68-V70 PolarHBondContact O-N 3.04Å; V70-T74 HydrophobicContact CG1-CG2 4.29Å; V70-T74 WeakPolarHBondContact O-CB 3.23Å; V70-T74 VanDerWaalsContact O-CG2 3.22Å; V70-T74 WeakPolarHBondContact O-CG2 3.34Å; V70-T74 PolarHBondContact O-N 3.25Å; V70-T74 PolarHBondContact O-OG1 3.23Å
71	L	87.3	Confident	86.4	Confident	90 Å²	90	67.5 Å²	67.5	47%	0.471	38%	0.384	S	S	.	.	H	α-helix	trans	-61.4	-50.5	177.4	-73.1	169.2	0	0	0	111.9	A67 I68 L73 T74 L75	A67-L71 WeakPolarHBondContact O-CB 3.29Å; A67-L71 VanDerWaalsContact O-CG 3.29Å; A67-L71 WeakPolarHBondContact O-CG 3.5Å; A67-L71 PolarHBondContact O-N 3.31Å; I68-L71 PolarHBondContact O-N 2.96Å; L71-L73 PolarHBondContact O-N 3.46Å; L71-T74 PolarHBondContact O-N 3.47Å; L71-T74 PolarHBondContact O-OG1 2.93Å; L71-T74 VanDerWaalsContact O-OG1 3.06Å; L71-L75 VanDerWaalsContact O-CB 3.23Å; L71-L75 WeakPolarHBondContact O-CB 3.46Å; L71-L75 VanDerWaalsContact O-CG 3.27Å; L71-L75 WeakPolarHBondContact O-CG 3.37Å; L71-L75 PolarHBondContact O-N 3.47Å
72	S	84.8	Confident	87.3	Confident	20 Å²	20	67.5 Å²	67.5	14%	0.14	38%	0.381	C	S	.	.	H	α-helix	trans	-60.1	-43.1	178.8	-68.5	0	0	0	0	112.5	I68 G76	I68-S72 WeakPolarHBondContact O-CB 3.31Å; I68-S72 PolarHBondContact O-N 3.45Å; I68-S72 PolarHBondContact O-OG 2.76Å; S72-G76 WeakPolarHBondContact O-CA 3.44Å; S72-G76 PolarHBondContact O-N 3.01Å
73	L	87	Confident	88.2	Confident	76 Å²	76	63.5 Å²	63.5	40%	0.398	35%	0.354	S	S	.	.	H	α-helix	trans	-69.2	-44.3	179.2	-176.9	62.9	0	0	0	111.7	A69 L71 T77 V120	A69-L73 VanDerWaalsContact O-CB 3.3Å; A69-L73 WeakPolarHBondContact O-CB 3.5Å; A69-L73 PolarHBondContact O-N 2.99Å; L71-L73 PolarHBondContact O-N 3.46Å; L73-T77 HydrophobicContact CD1-CG2 4.31Å; L73-T77 WeakPolarHBondContact O-CB 3.49Å; L73-T77 WeakPolarHBondContact O-CG2 3.23Å; L73-T77 PolarHBondContact O-N 3.23Å; L73-T77 PolarHBondContact O-OG1 3.18Å; L73-V120 HydrophobicContact CD1-CG1 3.94Å
74	T	90.6	Very high	88.9	Confident	72 Å²	72	63.2 Å²	63.2	44%	0.442	35%	0.345	S	S	.	.	H	α-helix	trans	-69.5	-49.6	-178.8	52.3	0	0	0	0	111.9	V70 L71 T77 F78	V70-T74 HydrophobicContact CG1-CG2 4.29Å; V70-T74 WeakPolarHBondContact O-CB 3.23Å; V70-T74 VanDerWaalsContact O-CG2 3.22Å; V70-T74 WeakPolarHBondContact O-CG2 3.34Å; V70-T74 PolarHBondContact O-N 3.25Å; V70-T74 PolarHBondContact O-OG1 3.23Å; L71-T74 PolarHBondContact O-N 3.47Å; L71-T74 PolarHBondContact O-OG1 2.93Å; L71-T74 VanDerWaalsContact O-OG1 3.06Å; T74-T77 PolarHBondContact O-OG1 2.67Å; T74-F78 WeakPolarHBondContact O-CB 3.41Å; T74-F78 PolarHBondContact O-N 3.38Å; T74-F78 VanDerWaalsContact O-N 3.07Å
75	L	91.6	Very high	89.6	Confident	108 Å²	108	66.2 Å²	66.2	57%	0.565	36%	0.362	S	S	*	.	H	α-helix	trans	-65.9	-44.3	177	-64.8	175.7	0	0	0	110.8	L71 T77 F78 T79	L71-L75 VanDerWaalsContact O-CB 3.23Å; L71-L75 WeakPolarHBondContact O-CB 3.46Å; L71-L75 VanDerWaalsContact O-CG 3.27Å; L71-L75 WeakPolarHBondContact O-CG 3.37Å; L71-L75 PolarHBondContact O-N 3.47Å; L75-T77 PolarHBondContact O-N 3.01Å; L75-F78 PolarHBondContact O-N 3.09Å; L75-T79 WeakPolarHBondContact O-CB 3.17Å; L75-T79 PolarHBondContact O-N 2.95Å; L75-T79 PolarHBondContact O-OG1 3.5Å
76	G	90.6	Very high	90.5	Very high	6 Å²	6	66.5 Å²	66.5	6%	0.062	37%	0.367	C	S	.	.	H	α-helix	trans	-60.8	-43.6	179.1	0	0	0	0	0	112.9	S72 T79 V80	S72-G76 WeakPolarHBondContact O-CA 3.44Å; S72-G76 PolarHBondContact O-N 3.01Å; G76-T79 PolarHBondContact O-N 3.38Å; G76-V80 WeakPolarHBondContact O-CG2 3.49Å; G76-V80 PolarHBondContact O-N 2.93Å
77	T	89.6	Confident	91.1	Very high	67 Å²	67	62.6 Å²	62.6	41%	0.411	35%	0.347	S	S	.	.	H	α-helix	trans	-66.1	-40.8	175.7	45.6	0	0	0	0	112	L73 T74 L75 V80 L81	L73-T77 HydrophobicContact CD1-CG2 4.31Å; L73-T77 WeakPolarHBondContact O-CB 3.49Å; L73-T77 WeakPolarHBondContact O-CG2 3.23Å; L73-T77 PolarHBondContact O-N 3.23Å; L73-T77 PolarHBondContact O-OG1 3.18Å; T74-T77 PolarHBondContact O-OG1 2.67Å; L75-T77 PolarHBondContact O-N 3.01Å; T77-V80 PolarHBondContact O-N 3.33Å; T77-L81 WeakPolarHBondContact O-CG 3.46Å; T77-L81 PolarHBondContact O-N 3Å
78	F	94.9	Very high	91.6	Very high	118 Å²	118	63.7 Å²	63.7	52%	0.518	35%	0.351	S	S	.	.	H	α-helix	trans	-61.9	-46.1	175.2	-169.8	-104.8	0	0	0	111.8	T74 L75 V80 L81 E82	T74-F78 WeakPolarHBondContact O-CB 3.41Å; T74-F78 PolarHBondContact O-N 3.38Å; T74-F78 VanDerWaalsContact O-N 3.07Å; L75-F78 PolarHBondContact O-N 3.09Å; F78-V80 VanDerWaalsContact C-N 3.3Å; F78-V80 PolarHBondContact O-N 2.92Å; F78-L81 PolarHBondContact O-N 3.39Å; F78-L81 VanDerWaalsContact O-N 3.12Å; F78-E82 HydrophobicContact CD1-CG 4.1Å; F78-E82 HydrophobicContact CE1-CG 3.8Å; F78-E82 WeakPolarHBondContact CE1-OE1 3.32Å; F78-E82 WeakPolarHBondContact CE1-OE2 3.41Å; F78-E82 HydrophobicContact CE2-CG 4.48Å; F78-E82 HydrophobicContact CZ-CG 3.98Å; F78-E82 VanDerWaalsContact CZ-OE1 3.23Å; F78-E82 WeakPolarHBondContact CZ-OE1 3.33Å; F78-E82 WeakPolarHBondContact O-CG 3.32Å; F78-E82 PolarHBondContact O-N 3.28Å
79	T	94.4	Very high	92.3	Very high	42 Å²	42	66.2 Å²	66.2	26%	0.258	37%	0.368	S	S	.	.	H	α-helix	trans	-59.4	-39.2	176	-56.5	0	0	0	0	112.1	L75 G76 N83 S116	L75-T79 WeakPolarHBondContact O-CB 3.17Å; L75-T79 PolarHBondContact O-N 2.95Å; L75-T79 PolarHBondContact O-OG1 3.5Å; G76-T79 PolarHBondContact O-N 3.38Å; T79-N83 VanDerWaalsContact CG2-ND2 3.32Å; T79-N83 WeakPolarHBondContact CG2-ND2 3.29Å; T79-N83 WeakPolarHBondContact O-CB 3.47Å; T79-N83 PolarHBondContact O-N 2.98Å; T79-N83 PolarHBondContact O-ND2 2.89Å; T79-S116 WeakPolarHBondContact CG2-OG 3.45Å
80	V	94.3	Very high	92.9	Very high	33 Å²	33	66.1 Å²	66.1	20%	0.2	36%	0.364	C	S	.	.	H	α-helix	trans	-61.8	-47.8	174.2	164.8	0	0	0	0	111.2	G76 T77 F78 L84 L113 V117	G76-V80 WeakPolarHBondContact O-CG2 3.49Å; G76-V80 PolarHBondContact O-N 2.93Å; T77-V80 PolarHBondContact O-N 3.33Å; F78-V80 VanDerWaalsContact C-N 3.3Å; F78-V80 PolarHBondContact O-N 2.92Å; V80-L84 WeakPolarHBondContact O-CB 3.44Å; V80-L84 PolarHBondContact O-N 3.11Å; V80-L113 HydrophobicContact CB-CD1 4.19Å; V80-L113 HydrophobicContact CG1-CD1 3.79Å; V80-L113 HydrophobicContact CG2-CD1 4.26Å; V80-V117 HydrophobicContact CG2-CG2 3.85Å
81	L	95.7	Very high	93.2	Very high	115 Å²	115	66.7 Å²	66.7	60%	0.602	36%	0.364	S	S	*	.	H	α-helix	trans	-63.6	-44.7	-178.9	-68.7	173.6	0	0	0	112.1	T77 F78 L85	T77-L81 WeakPolarHBondContact O-CG 3.46Å; T77-L81 PolarHBondContact O-N 3Å; F78-L81 PolarHBondContact O-N 3.39Å; F78-L81 VanDerWaalsContact O-N 3.12Å; L81-L85 WeakPolarHBondContact O-CB 3.33Å; L81-L85 PolarHBondContact O-N 3.38Å
82	E	96.9	Very high	93.5	Very high	96 Å²	96	70.4 Å²	70.4	45%	0.449	38%	0.379	S	S	.	.	H	α-helix	trans	-63.9	-48.4	178.9	-71.1	-171.1	132.6	0	0	112.1	F78 L84 L85 V86	F78-E82 HydrophobicContact CD1-CG 4.1Å; F78-E82 HydrophobicContact CE1-CG 3.8Å; F78-E82 WeakPolarHBondContact CE1-OE1 3.32Å; F78-E82 WeakPolarHBondContact CE1-OE2 3.41Å; F78-E82 HydrophobicContact CE2-CG 4.48Å; F78-E82 HydrophobicContact CZ-CG 3.98Å; F78-E82 VanDerWaalsContact CZ-OE1 3.23Å; F78-E82 WeakPolarHBondContact CZ-OE1 3.33Å; F78-E82 WeakPolarHBondContact O-CG 3.32Å; F78-E82 PolarHBondContact O-N 3.28Å; E82-L84 VanDerWaalsContact C-N 3.33Å; E82-L84 PolarHBondContact O-N 2.91Å; E82-L85 WeakPolarHBondContact O-CB 3.35Å; E82-L85 PolarHBondContact O-N 2.82Å; E82-V86 WeakPolarHBondContact O-CG2 3.42Å; E82-V86 PolarHBondContact O-N 2.72Å
83	N	96.6	Very high	94	Very high	21 Å²	21	71.3 Å²	71.3	11%	0.112	39%	0.385	C	S	.	.	H	α-helix	trans	-68.3	-34.4	-179.5	-78.3	-67.6	0	0	0	112.3	T79 V86 L87 A109 L113	T79-N83 VanDerWaalsContact CG2-ND2 3.32Å; T79-N83 WeakPolarHBondContact CG2-ND2 3.29Å; T79-N83 WeakPolarHBondContact O-CB 3.47Å; T79-N83 PolarHBondContact O-N 2.98Å; T79-N83 PolarHBondContact O-ND2 2.89Å; N83-V86 PolarHBondContact O-N 3.43Å; N83-L87 WeakPolarHBondContact O-CB 3.38Å; N83-L87 PolarHBondContact O-N 3.32Å; N83-A109 HydrophobicContact CB-CB 4.4Å; N83-A109 WeakPolarHBondContact OD1-CA 3.47Å; N83-L113 HydrophobicContact CB-CB 4.33Å
84	L	96.6	Very high	94.1	Very high	80 Å²	80	77.1 Å²	77.1	42%	0.419	40%	0.402	S	S	.	.	H	α-helix	trans	-63.3	-44.3	172.3	-175.2	65.5	0	0	0	111.2	V80 E82 L87 C88 L113	V80-L84 WeakPolarHBondContact O-CB 3.44Å; V80-L84 PolarHBondContact O-N 3.11Å; E82-L84 VanDerWaalsContact C-N 3.33Å; E82-L84 PolarHBondContact O-N 2.91Å; L84-L87 PolarHBondContact O-N 3.2Å; L84-C88 WeakPolarHBondContact O-CB 3.35Å; L84-C88 PolarHBondContact O-N 3.39Å; L84-C88 PolarHBondContact O-SG 2.92Å; L84-L113 HydrophobicContact CB-CD1 4.44Å
85	L	96.8	Very high	94	Very high	114 Å²	114	77.4 Å²	77.4	60%	0.597	41%	0.407	S	S	*	.	H	α-helix	trans	-60.6	-47.6	176.4	177.5	64.5	0	0	0	111.5	L81 E82 L87 C88 V89	L81-L85 WeakPolarHBondContact O-CB 3.33Å; L81-L85 PolarHBondContact O-N 3.38Å; E82-L85 WeakPolarHBondContact O-CB 3.35Å; E82-L85 PolarHBondContact O-N 2.82Å; L85-L87 VanDerWaalsContact C-N 3.32Å; L85-L87 PolarHBondContact O-N 3.42Å; L85-C88 WeakPolarHBondContact O-CB 3.35Å; L85-C88 PolarHBondContact O-N 2.82Å; L85-V89 HydrophobicContact CD1-CG2 4.39Å; L85-V89 WeakPolarHBondContact O-CG2 3.28Å; L85-V89 PolarHBondContact O-N 3.25Å
86	V	96	Very high	93.8	Very high	58 Å²	58	74 Å²	74	35%	0.352	39%	0.388	S	S	.	.	H	α-helix	trans	-57.4	-47.7	176.9	170.2	0	0	0	0	110.6	E82 N83 V89 I90 I105 A109	E82-V86 WeakPolarHBondContact O-CG2 3.42Å; E82-V86 PolarHBondContact O-N 2.72Å; N83-V86 PolarHBondContact O-N 3.43Å; V86-V89 PolarHBondContact O-N 3.49Å; V86-I90 HydrophobicContact CG1-CD1 3.83Å; V86-I90 WeakPolarHBondContact O-CG1 3.42Å; V86-I90 PolarHBondContact O-N 2.88Å; V86-I105 HydrophobicContact CG1-CG2 4.45Å; V86-A109 HydrophobicContact CG1-CB 4.13Å
87	L	95.4	Very high	93.6	Very high	33 Å²	33	78.9 Å²	78.9	17%	0.173	41%	0.405	C	S	.	.	H	α-helix	trans	-62.7	-44.9	179.3	-171.8	62.5	0	0	0	111.4	N83 L84 L85 V89 I90 L91 V110	N83-L87 WeakPolarHBondContact O-CB 3.38Å; N83-L87 PolarHBondContact O-N 3.32Å; L84-L87 PolarHBondContact O-N 3.2Å; L85-L87 VanDerWaalsContact C-N 3.32Å; L85-L87 PolarHBondContact O-N 3.42Å; L87-V89 PolarHBondContact O-N 3.42Å; L87-I90 PolarHBondContact O-N 3.4Å; L87-L91 HydrophobicContact CD1-CD1 4.14Å; L87-L91 HydrophobicContact CD1-CG 4.19Å; L87-L91 HydrophobicContact CD2-CD1 4.47Å; L87-L91 HydrophobicContact CG-CD1 3.86Å; L87-L91 HydrophobicContact CG-CG 4.28Å; L87-L91 WeakPolarHBondContact O-CB 3.45Å; L87-L91 VanDerWaalsContact O-CG 3.25Å; L87-L91 WeakPolarHBondContact O-CG 3.25Å; L87-L91 PolarHBondContact O-N 3.49Å; L87-V110 HydrophobicContact CD1-CG2 3.99Å; L87-V110 HydrophobicContact CD2-CG2 3.95Å
88	C	95.8	Very high	93.5	Very high	66 Å²	66	78.6 Å²	78.6	45%	0.446	41%	0.405	S	S	.	.	H	α-helix	trans	-57	-45.2	175.5	-78	0	0	0	0	112.1	L84 L85 L91 H92	L84-C88 WeakPolarHBondContact O-CB 3.35Å; L84-C88 PolarHBondContact O-N 3.39Å; L84-C88 PolarHBondContact O-SG 2.92Å; L85-C88 WeakPolarHBondContact O-CB 3.35Å; L85-C88 PolarHBondContact O-N 2.82Å; C88-L91 PolarHBondContact O-N 3.31Å; C88-H92 WeakPolarHBondContact O-CB 3.37Å; C88-H92 PolarHBondContact O-N 3.5Å
89	V	96.4	Very high	93.2	Very high	76 Å²	76	80 Å²	80	46%	0.461	41%	0.407	S	S	.	.	H	α-helix	trans	-64.4	-44	178.9	171	0	0	0	0	111.6	L85 V86 L87 H92 S93 L96	L85-V89 HydrophobicContact CD1-CG2 4.39Å; L85-V89 WeakPolarHBondContact O-CG2 3.28Å; L85-V89 PolarHBondContact O-N 3.25Å; V86-V89 PolarHBondContact O-N 3.49Å; L87-V89 PolarHBondContact O-N 3.42Å; V89-H92 PolarHBondContact O-N 2.9Å; V89-S93 WeakPolarHBondContact O-CB 3.34Å; V89-S93 PolarHBondContact O-N 3.45Å; V89-L96 HydrophobicContact CG1-CD1 4.02Å
90	I	94.1	Very high	92.8	Very high	15 Å²	15	79 Å²	79	8%	0.077	40%	0.402	C	S	.	.	H	α-helix	trans	-64.9	-43.6	178.3	-67.3	170.2	0	0	0	110.7	V86 L87 Y102 I105	V86-I90 HydrophobicContact CG1-CD1 3.83Å; V86-I90 WeakPolarHBondContact O-CG1 3.42Å; V86-I90 PolarHBondContact O-N 2.88Å; L87-I90 PolarHBondContact O-N 3.4Å; I90-Y102 HydrophobicContact CG1-CD1 4.34Å; I90-I105 HydrophobicContact CD1-CB 4.39Å; I90-I105 HydrophobicContact CD1-CG2 4Å
91	L	92	Very high	92.5	Very high	94 Å²	94	78.1 Å²	78.1	49%	0.492	40%	0.397	S	S	.	.	H	α-helix	trans	-71.2	-36.3	179.7	-68.9	179.7	0	0	0	111.7	L87 C88 R97	L87-L91 HydrophobicContact CD1-CD1 4.14Å; L87-L91 HydrophobicContact CD1-CG 4.19Å; L87-L91 HydrophobicContact CD2-CD1 4.47Å; L87-L91 HydrophobicContact CG-CD1 3.86Å; L87-L91 HydrophobicContact CG-CG 4.28Å; L87-L91 WeakPolarHBondContact O-CB 3.45Å; L87-L91 VanDerWaalsContact O-CG 3.25Å; L87-L91 WeakPolarHBondContact O-CG 3.25Å; L87-L91 PolarHBondContact O-N 3.49Å; C88-L91 PolarHBondContact O-N 3.31Å; L91-R97 VanDerWaalsContact O-CZ 3.25Å; L91-R97 PolarHBondContact O-NE 3.26Å; L91-R97 PolarHBondContact O-NH2 2.94Å
92	H	94.3	Very high	92.3	Very high	169 Å²	169	76 Å²	76	78%	0.782	38%	0.381	S	S	*	.	H	α-helix	trans	-73.1	-39.3	179.5	-169.1	74.8	0	0	0	112.1	C88 V89 R94	C88-H92 WeakPolarHBondContact O-CB 3.37Å; C88-H92 PolarHBondContact O-N 3.5Å; V89-H92 PolarHBondContact O-N 2.9Å; H92-R94 PolarHBondContact O-N 3.37Å
93	S	94.2	Very high	92	Very high	38 Å²	38	73.9 Å²	73.9	27%	0.266	37%	0.371	S	S	.	.			trans	-83.5	109.2	-175.6	-174.3	0	0	0	0	113.3	V89 S95 L96 R97	V89-S93 WeakPolarHBondContact O-CB 3.34Å; V89-S93 PolarHBondContact O-N 3.45Å; S93-S95 PolarHBondContact O-N 3.36Å; S93-L96 PolarHBondContact O-N 2.86Å; S93-R97 PolarHBondContact O-N 3.46Å
94	R	88.7	Confident	91.8	Very high	199 Å²	199	73.4 Å²	73.4	75%	0.751	37%	0.368	S	S	*	.	H	α-helix	trans	-57.7	-36.5	173.3	-172.5	178.3	-179.2	-175.5	1.3	112.4	H92 L96 R97 C98	H92-R94 PolarHBondContact O-N 3.37Å; R94-L96 VanDerWaalsContact C-N 3.34Å; R94-L96 PolarHBondContact O-N 2.85Å; R94-R97 PolarHBondContact O-N 2.8Å; R94-C98 PolarHBondContact O-N 3.14Å; R94-C98 VanDerWaalsContact O-N 3.12Å; R94-C98 PolarHBondContact O-SG 2.91Å
95	S	88.6	Confident	91.7	Very high	78 Å²	78	72.1 Å²	72.1	55%	0.545	36%	0.361	S	S	.	.	H	α-helix	trans	-62.2	-41.1	179.5	-176	0	0	0	0	112	S93	S93-S95 PolarHBondContact O-N 3.36Å
96	L	87.8	Confident	91.5	Very high	35 Å²	35	67.1 Å²	67.1	18%	0.183	34%	0.337	C	S	.	.	H	α-helix	trans	-72.4	-46	177.5	-59	-175.9	0	0	0	111.3	V89 S93 R94 C98 R99 Y102	V89-L96 HydrophobicContact CG1-CD1 4.02Å; S93-L96 PolarHBondContact O-N 2.86Å; R94-L96 VanDerWaalsContact C-N 3.34Å; R94-L96 PolarHBondContact O-N 2.85Å; L96-C98 PolarHBondContact O-N 3.44Å; L96-R99 PolarHBondContact O-N 3.19Å; L96-Y102 HydrophobicContact CB-CD1 4.16Å; L96-Y102 HydrophobicContact CB-CE1 4.44Å; L96-Y102 HydrophobicContact CB-CG 4.24Å; L96-Y102 HydrophobicContact CD1-CE1 4.27Å; L96-Y102 HydrophobicContact CD2-CD1 4.3Å; L96-Y102 HydrophobicContact CD2-CE1 3.72Å; L96-Y102 HydrophobicContact CD2-CE2 4Å; L96-Y102 HydrophobicContact CG-CE1 4.35Å
97	R	87.9	Confident	91.5	Very high	109 Å²	109	64.5 Å²	64.5	41%	0.411	32%	0.321	S	S	.	.	H	α-helix	trans	-63	-24.3	-178.2	-148.7	-168.3	-48.5	156.9	8.9	114.1	L91 S93 R94 R99 H103 R179	L91-R97 VanDerWaalsContact O-CZ 3.25Å; L91-R97 PolarHBondContact O-NE 3.26Å; L91-R97 PolarHBondContact O-NH2 2.94Å; S93-R97 PolarHBondContact O-N 3.46Å; R94-R97 PolarHBondContact O-N 2.8Å; R97-R99 VanDerWaalsContact C-N 3.27Å; R97-R99 PolarHBondContact O-N 2.87Å; R97-H103 PolarHBondContact O-NE2 3.33Å; R97-R179 PolarHBondContact O-NE 3.32Å; R97-R179 PolarHBondContact O-NH2 3.29Å; R97-R179 VanDerWaalsContact O-NH2 3.16Å
98	C	86.6	Confident	91.4	Very high	62 Å²	62	64.6 Å²	64.6	42%	0.419	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-15.9	175	-75.7	0	0	0	0	113.2	R94 L96 R179	R94-C98 PolarHBondContact O-N 3.14Å; R94-C98 VanDerWaalsContact O-N 3.12Å; R94-C98 PolarHBondContact O-SG 2.91Å; L96-C98 PolarHBondContact O-N 3.44Å; C98-R179 VanDerWaalsContact O-CD 3.29Å; C98-R179 WeakPolarHBondContact O-CD 3.5Å
99	R	88.1	Confident	91.4	Very high	148 Å²	148	61.6 Å²	61.6	56%	0.558	30%	0.301	S	S	*	.	S	Bend	trans	-95.4	128	-177.5	-67.3	-169.5	-173.9	-162.4	4.7	110.9	L96 R97 S101 Y102	L96-R99 PolarHBondContact O-N 3.19Å; R97-R99 VanDerWaalsContact C-N 3.27Å; R97-R99 PolarHBondContact O-N 2.87Å; R99-S101 VanDerWaalsContact C-N 3.34Å; R99-S101 PolarHBondContact O-N 3.41Å; R99-Y102 HydrophobicContact CB-CD2 3.68Å; R99-Y102 HydrophobicContact CB-CE2 4.24Å; R99-Y102 PolarHBondContact O-N 3.24Å
100	P	86.4	Confident	91.4	Very high	21 Å²	21	60.1 Å²	60.1	14%	0.136	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-38.9	-174.7	22.8	-32.4	0	0	0	113.2	Y102 H103 V177 A182	P100-Y102 PolarHBondContact O-N 2.93Å; P100-H103 WeakPolarHBondContact O-CB 3.39Å; P100-H103 PolarHBondContact O-N 3.45Å; P100-V177 HydrophobicContact CB-CG1 3.86Å; P100-V177 HydrophobicContact CG-CG1 3.79Å; P100-A182 HydrophobicContact CB-CB 3.89Å
101	S	88.7	Confident	91.5	Very high	14 Å²	14	59.4 Å²	59.4	10%	0.098	29%	0.289	C	S	.	.	H	α-helix	trans	-59.4	-30.2	-179.3	-45.1	0	0	0	0	114	R99 H103 F104 I105 D162 Y173	R99-S101 VanDerWaalsContact C-N 3.34Å; R99-S101 PolarHBondContact O-N 3.41Å; S101-H103 VanDerWaalsContact C-N 3.26Å; S101-H103 PolarHBondContact O-N 2.92Å; S101-F104 PolarHBondContact O-N 2.88Å; S101-I105 PolarHBondContact O-N 3.27Å; S101-D162 VanDerWaalsContact CB-OD2 3.27Å; S101-D162 WeakPolarHBondContact CB-OD2 3.41Å; S101-D162 PolarHBondContact OG-OD1 2.88Å; S101-D162 PolarHBondContact OG-OD2 3.5Å; S101-Y173 PolarHBondContact OG-OH 3.26Å; S101-Y173 VanDerWaalsContact OG-OH 3.09Å
102	Y	91.1	Very high	91.6	Very high	71 Å²	71	57.1 Å²	57.1	28%	0.278	28%	0.277	S	S	.	.	H	α-helix	trans	-74.3	-17	179.6	-75.8	-91.1	0	0	0	112.7	I90 L96 R99 P100 I105 G106	I90-Y102 HydrophobicContact CG1-CD1 4.34Å; L96-Y102 HydrophobicContact CB-CD1 4.16Å; L96-Y102 HydrophobicContact CB-CE1 4.44Å; L96-Y102 HydrophobicContact CB-CG 4.24Å; L96-Y102 HydrophobicContact CD1-CE1 4.27Å; L96-Y102 HydrophobicContact CD2-CD1 4.3Å; L96-Y102 HydrophobicContact CD2-CE1 3.72Å; L96-Y102 HydrophobicContact CD2-CE2 4Å; L96-Y102 HydrophobicContact CG-CE1 4.35Å; R99-Y102 HydrophobicContact CB-CD2 3.68Å; R99-Y102 HydrophobicContact CB-CE2 4.24Å; R99-Y102 PolarHBondContact O-N 3.24Å; P100-Y102 PolarHBondContact O-N 2.93Å; Y102-I105 HydrophobicContact CD1-CD1 4.25Å; Y102-I105 HydrophobicContact CE1-CD1 4.46Å; Y102-G106 PolarHBondContact O-N 3.25Å
103	H	90.5	Very high	91.7	Very high	50 Å²	50	50.7 Å²	50.7	23%	0.231	25%	0.248	C	C	.	.	H	α-helix	trans	-69.9	-34.2	170.3	-72.1	-81	0	0	0	111.7	R97 P100 S101 S107	R97-H103 PolarHBondContact O-NE2 3.33Å; P100-H103 WeakPolarHBondContact O-CB 3.39Å; P100-H103 PolarHBondContact O-N 3.45Å; S101-H103 VanDerWaalsContact C-N 3.26Å; S101-H103 PolarHBondContact O-N 2.92Å; H103-S107 VanDerWaalsContact O-CB 3.3Å; H103-S107 WeakPolarHBondContact O-CB 3.27Å; H103-S107 PolarHBondContact O-N 3.32Å
104	F	92.6	Very high	91.7	Very high	11 Å²	11	52.6 Å²	52.6	5%	0.048	26%	0.255	C	S	.	.	H	α-helix	trans	-70.4	-38.6	174.4	-54	-49	0	0	0	111.9	S101 S107 L108 L158 T159 D162 A182	S101-F104 PolarHBondContact O-N 2.88Å; F104-S107 WeakPolarHBondContact O-CB 3.36Å; F104-S107 PolarHBondContact O-N 3.33Å; F104-L108 PolarHBondContact O-N 2.83Å; F104-L158 HydrophobicContact CD1-CB 3.75Å; F104-L158 HydrophobicContact CD1-CD1 3.93Å; F104-L158 HydrophobicContact CD1-CG 4.46Å; F104-L158 HydrophobicContact CE1-CB 3.96Å; F104-L158 HydrophobicContact CE1-CD1 3.93Å; F104-L158 HydrophobicContact CE1-CG 4.41Å; F104-L158 HydrophobicContact CG-CB 4.12Å; F104-L158 HydrophobicContact CZ-CB 4.48Å; F104-T159 WeakPolarHBondContact CB-OG1 3.3Å; F104-D162 HydrophobicContact CD2-CB 4.14Å; F104-D162 HydrophobicContact CE2-CB 3.97Å; F104-A182 HydrophobicContact CE1-CB 4.16Å; F104-A182 HydrophobicContact CE2-CB 4.42Å; F104-A182 HydrophobicContact CZ-CB 3.72Å
105	I	93.1	Very high	91.8	Very high	54 Å²	54	43.7 Å²	43.7	28%	0.277	23%	0.225	S	C	.	.	H	α-helix	trans	-66.6	-42.2	174.2	-59.1	172.1	0	0	0	110.7	V86 I90 S101 Y102 S107 L108 A109	V86-I105 HydrophobicContact CG1-CG2 4.45Å; I90-I105 HydrophobicContact CD1-CB 4.39Å; I90-I105 HydrophobicContact CD1-CG2 4Å; S101-I105 PolarHBondContact O-N 3.27Å; Y102-I105 HydrophobicContact CD1-CD1 4.25Å; Y102-I105 HydrophobicContact CE1-CD1 4.46Å; I105-S107 VanDerWaalsContact C-N 3.33Å; I105-S107 PolarHBondContact O-N 3.42Å; I105-L108 WeakPolarHBondContact O-CB 3.3Å; I105-L108 PolarHBondContact O-N 2.85Å; I105-A109 PolarHBondContact O-N 3.04Å
106	G	94.1	Very high	91.9	Very high	9 Å²	9	40.8 Å²	40.8	9%	0.093	21%	0.205	C	C	.	.	H	α-helix	trans	-63.7	-38.3	174.3	0	0	0	0	0	112.5	Y102 A109 V110	Y102-G106 PolarHBondContact O-N 3.25Å; G106-A109 PolarHBondContact O-N 2.6Å; G106-V110 WeakPolarHBondContact O-CG2 3.46Å; G106-V110 PolarHBondContact O-N 3.28Å
107	S	94.8	Very high	92.1	Very high	3 Å²	3	42.6 Å²	42.6	2%	0.021	22%	0.218	C	C	.	.	H	α-helix	trans	-59.2	-46.7	172.9	176.3	0	0	0	0	112.1	H103 F104 I105 V110 A111 S155 F186 W190	H103-S107 VanDerWaalsContact O-CB 3.3Å; H103-S107 WeakPolarHBondContact O-CB 3.27Å; H103-S107 PolarHBondContact O-N 3.32Å; F104-S107 WeakPolarHBondContact O-CB 3.36Å; F104-S107 PolarHBondContact O-N 3.33Å; I105-S107 VanDerWaalsContact C-N 3.33Å; I105-S107 PolarHBondContact O-N 3.42Å; S107-V110 PolarHBondContact O-N 3.45Å; S107-A111 PolarHBondContact O-N 2.73Å; S107-S155 PolarHBondContact OG-OG 2.96Å; S107-F186 VanDerWaalsContact CB-CD2 3.43Å; S107-F186 VanDerWaalsContact OG-CD2 3.23Å; S107-F186 WeakPolarHBondContact OG-CD2 3.45Å; S107-F186 WeakPolarHBondContact OG-CE2 3.2Å; S107-W190 PolarHBondContact OG-NE1 3.45Å
108	L	94.3	Very high	92.2	Very high	35 Å²	35	39.7 Å²	39.7	18%	0.183	21%	0.209	C	C	.	.	H	α-helix	trans	-57.5	-49.5	175.2	-179.5	62.6	0	0	0	110.8	F104 I105 V110 A111 D112 S152 L156	F104-L108 PolarHBondContact O-N 2.83Å; I105-L108 WeakPolarHBondContact O-CB 3.3Å; I105-L108 PolarHBondContact O-N 2.85Å; L108-V110 VanDerWaalsContact C-N 3.29Å; L108-V110 PolarHBondContact O-N 2.93Å; L108-A111 WeakPolarHBondContact O-CB 3.45Å; L108-A111 PolarHBondContact O-N 3.35Å; L108-A111 VanDerWaalsContact O-N 3.1Å; L108-D112 VanDerWaalsContact O-CG 3.31Å; L108-D112 PolarHBondContact O-N 3.21Å; L108-S152 WeakPolarHBondContact CD1-OG 3.29Å; L108-L156 HydrophobicContact CD1-CD2 4.41Å; L108-L156 HydrophobicContact CD1-CG 4.18Å; L108-L156 HydrophobicContact CD2-CD2 3.85Å; L108-L156 HydrophobicContact CD2-CG 4.48Å
109	A	96.3	Very high	92	Very high	2 Å²	2	41 Å²	41	2%	0.017	21%	0.208	C	C	.	.	H	α-helix	trans	-60.3	-36.4	179.3	0	0	0	0	0	113.2	N83 V86 I105 G106 L113	N83-A109 HydrophobicContact CB-CB 4.4Å; N83-A109 WeakPolarHBondContact OD1-CA 3.47Å; V86-A109 HydrophobicContact CG1-CB 4.13Å; I105-A109 PolarHBondContact O-N 3.04Å; G106-A109 PolarHBondContact O-N 2.6Å; A109-L113 WeakPolarHBondContact O-CB 3.36Å; A109-L113 PolarHBondContact O-N 2.88Å
110	V	95.9	Very high	91.9	Very high	46 Å²	46	35.3 Å²	35.3	28%	0.279	19%	0.19	S	C	.	.	H	α-helix	trans	-69.9	-41.5	175.2	172.7	0	0	0	0	111.5	L87 G106 S107 L108 L113 L114 W190	L87-V110 HydrophobicContact CD1-CG2 3.99Å; L87-V110 HydrophobicContact CD2-CG2 3.95Å; G106-V110 WeakPolarHBondContact O-CG2 3.46Å; G106-V110 PolarHBondContact O-N 3.28Å; S107-V110 PolarHBondContact O-N 3.45Å; L108-V110 VanDerWaalsContact C-N 3.29Å; L108-V110 PolarHBondContact O-N 2.93Å; V110-L113 PolarHBondContact O-N 2.85Å; V110-L114 HydrophobicContact CG1-CD1 4.01Å; V110-L114 HydrophobicContact CG1-CG 4.38Å; V110-L114 WeakPolarHBondContact O-CB 3.5Å; V110-L114 WeakPolarHBondContact O-CG 3.39Å; V110-L114 PolarHBondContact O-N 2.75Å; V110-W190 HydrophobicContact CB-CZ2 4.32Å; V110-W190 HydrophobicContact CG1-CH2 3.9Å; V110-W190 HydrophobicContact CG1-CZ2 4.06Å
111	A	95.6	Very high	91.9	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-61.6	-46.6	177.2	0	0	0	0	0	111.3	S107 L108 L114 G115 S148 A151 W190	S107-A111 PolarHBondContact O-N 2.73Å; L108-A111 WeakPolarHBondContact O-CB 3.45Å; L108-A111 PolarHBondContact O-N 3.35Å; L108-A111 VanDerWaalsContact O-N 3.1Å; A111-L114 PolarHBondContact O-N 3.26Å; A111-G115 PolarHBondContact O-N 3.36Å; A111-S148 WeakPolarHBondContact O-CB 3.24Å; A111-S148 PolarHBondContact O-OG 3.31Å; A111-A151 HydrophobicContact CB-CB 3.95Å; A111-W190 HydrophobicContact CB-CH2 4Å; A111-W190 HydrophobicContact CB-CZ2 3.91Å
112	D	94.8	Very high	91.4	Very high	45 Å²	45	41.1 Å²	41.1	24%	0.241	21%	0.211	C	C	.	.	H	α-helix	trans	-66.4	-42.7	179.2	-61.9	-19.4	0	0	0	110.8	L108 L114 G115 S116 S152	L108-D112 VanDerWaalsContact O-CG 3.31Å; L108-D112 PolarHBondContact O-N 3.21Å; D112-L114 PolarHBondContact O-N 3.44Å; D112-G115 PolarHBondContact O-N 3.02Å; D112-S116 WeakPolarHBondContact O-CB 3.48Å; D112-S116 PolarHBondContact O-N 2.87Å; D112-S116 PolarHBondContact O-OG 3.49Å; D112-S152 WeakPolarHBondContact OD1-CB 3.34Å; D112-S152 PolarHBondContact OD1-OG 3.07Å
113	L	95	Very high	90.7	Very high	34 Å²	34	39 Å²	39	18%	0.178	20%	0.203	C	C	.	.	H	α-helix	trans	-58.3	-49.4	174.8	-175	75.7	0	0	0	112	V80 N83 L84 A109 V110 S116 V117	V80-L113 HydrophobicContact CB-CD1 4.19Å; V80-L113 HydrophobicContact CG1-CD1 3.79Å; V80-L113 HydrophobicContact CG2-CD1 4.26Å; N83-L113 HydrophobicContact CB-CB 4.33Å; L84-L113 HydrophobicContact CB-CD1 4.44Å; A109-L113 WeakPolarHBondContact O-CB 3.36Å; A109-L113 PolarHBondContact O-N 2.88Å; V110-L113 PolarHBondContact O-N 2.85Å; L113-S116 PolarHBondContact O-N 2.98Å; L113-V117 WeakPolarHBondContact O-CB 3.32Å; L113-V117 VanDerWaalsContact O-CG2 3.27Å; L113-V117 WeakPolarHBondContact O-CG2 3.32Å; L113-V117 PolarHBondContact O-N 3.37Å
114	L	93.9	Very high	90.1	Very high	78 Å²	78	38.5 Å²	38.5	41%	0.408	20%	0.204	S	C	.	.	H	α-helix	trans	-62.6	-45	178.3	-74.1	175	0	0	0	111	V110 A111 D112 V117 I118 W190	V110-L114 HydrophobicContact CG1-CD1 4.01Å; V110-L114 HydrophobicContact CG1-CG 4.38Å; V110-L114 WeakPolarHBondContact O-CB 3.5Å; V110-L114 WeakPolarHBondContact O-CG 3.39Å; V110-L114 PolarHBondContact O-N 2.75Å; A111-L114 PolarHBondContact O-N 3.26Å; D112-L114 PolarHBondContact O-N 3.44Å; L114-V117 PolarHBondContact O-N 3.09Å; L114-I118 WeakPolarHBondContact O-CB 3.46Å; L114-I118 WeakPolarHBondContact O-CD1 3.32Å; L114-I118 WeakPolarHBondContact O-CG1 3.47Å; L114-I118 PolarHBondContact O-N 3.18Å; L114-W190 HydrophobicContact CD1-CH2 3.9Å; L114-W190 HydrophobicContact CD1-CZ3 3.98Å
115	G	91.6	Very high	89.5	Confident	12 Å²	12	38.4 Å²	38.4	12%	0.124	20%	0.204	C	C	.	.	H	α-helix	trans	-58.3	-49.9	177.5	0	0	0	0	0	112	A111 D112 I118 F119 S148	A111-G115 PolarHBondContact O-N 3.36Å; D112-G115 PolarHBondContact O-N 3.02Å; G115-I118 PolarHBondContact O-N 3.35Å; G115-F119 WeakPolarHBondContact O-CB 3.44Å; G115-F119 PolarHBondContact O-N 3.41Å; G115-S148 VanDerWaalsContact CA-CB 3.45Å; G115-S148 WeakPolarHBondContact CA-OG 3.19Å; G115-S148 PolarHBondContact N-OG 3.47Å
116	S	91.3	Very high	88.3	Confident	17 Å²	17	38.6 Å²	38.6	12%	0.119	20%	0.203	C	C	.	.	H	α-helix	trans	-64.6	-40.8	179.2	-58.9	0	0	0	0	112.7	T79 D112 L113 F119 V120	T79-S116 WeakPolarHBondContact CG2-OG 3.45Å; D112-S116 WeakPolarHBondContact O-CB 3.48Å; D112-S116 PolarHBondContact O-N 2.87Å; D112-S116 PolarHBondContact O-OG 3.49Å; L113-S116 PolarHBondContact O-N 2.98Å; S116-F119 PolarHBondContact O-N 3.44Å; S116-V120 WeakPolarHBondContact O-CB 3.37Å; S116-V120 VanDerWaalsContact O-CG2 3.23Å; S116-V120 WeakPolarHBondContact O-CG2 3.46Å; S116-V120 PolarHBondContact O-N 3.3Å
117	V	91.6	Very high	87	Confident	74 Å²	74	40.6 Å²	40.6	45%	0.448	21%	0.21	S	C	.	.	H	α-helix	trans	-65.6	-46.5	177.2	170.1	0	0	0	0	111.2	V80 L113 L114 F119 Y121	V80-V117 HydrophobicContact CG2-CG2 3.85Å; L113-V117 WeakPolarHBondContact O-CB 3.32Å; L113-V117 VanDerWaalsContact O-CG2 3.27Å; L113-V117 WeakPolarHBondContact O-CG2 3.32Å; L113-V117 PolarHBondContact O-N 3.37Å; L114-V117 PolarHBondContact O-N 3.09Å; V117-F119 VanDerWaalsContact C-N 3.29Å; V117-F119 PolarHBondContact O-N 3.43Å; V117-Y121 VanDerWaalsContact O-CB 3.22Å; V117-Y121 WeakPolarHBondContact O-CB 3.48Å; V117-Y121 PolarHBondContact O-N 3.38Å
118	I	89.8	Confident	85.8	Confident	47 Å²	47	44.6 Å²	44.6	24%	0.241	23%	0.234	C	C	.	.	H	α-helix	trans	-61.9	-42	177.9	-67.3	165.3	0	0	0	110.2	L114 G115 S122 V145	L114-I118 WeakPolarHBondContact O-CB 3.46Å; L114-I118 WeakPolarHBondContact O-CD1 3.32Å; L114-I118 WeakPolarHBondContact O-CG1 3.47Å; L114-I118 PolarHBondContact O-N 3.18Å; G115-I118 PolarHBondContact O-N 3.35Å; I118-S122 VanDerWaalsContact O-CB 3.26Å; I118-S122 WeakPolarHBondContact O-CB 3.31Å; I118-S122 PolarHBondContact O-N 2.94Å; I118-S122 PolarHBondContact O-OG 3.46Å; I118-V145 HydrophobicContact CG2-CG2 3.81Å
119	F	83.2	Confident	84.8	Confident	91 Å²	91	49.2 Å²	49.2	40%	0.399	25%	0.253	S	S	.	.	H	α-helix	trans	-65.2	-51.3	179.5	-176	-105	0	0	0	111.8	G115 S116 V117 Y121 S122 F123	G115-F119 WeakPolarHBondContact O-CB 3.44Å; G115-F119 PolarHBondContact O-N 3.41Å; S116-F119 PolarHBondContact O-N 3.44Å; V117-F119 VanDerWaalsContact C-N 3.29Å; V117-F119 PolarHBondContact O-N 3.43Å; F119-Y121 VanDerWaalsContact C-N 3.32Å; F119-Y121 PolarHBondContact O-N 3.06Å; F119-S122 PolarHBondContact O-N 3.31Å; F119-F123 WeakPolarHBondContact O-CB 3.38Å; F119-F123 PolarHBondContact O-N 3.5Å
120	V	85	Confident	83.4	Confident	27 Å²	27	56.3 Å²	56.3	16%	0.164	29%	0.285	C	S	.	.	H	α-helix	trans	-60.5	-42	177	171.2	0	0	0	0	111.1	L73 S116 F123 V124	L73-V120 HydrophobicContact CD1-CG1 3.94Å; S116-V120 WeakPolarHBondContact O-CB 3.37Å; S116-V120 VanDerWaalsContact O-CG2 3.23Å; S116-V120 WeakPolarHBondContact O-CG2 3.46Å; S116-V120 PolarHBondContact O-N 3.3Å; V120-F123 WeakPolarHBondContact O-CB 3.3Å; V120-F123 PolarHBondContact O-N 3.18Å; V120-V124 HydrophobicContact CG1-CG2 4.49Å; V120-V124 VanDerWaalsContact O-CG2 3.32Å; V120-V124 WeakPolarHBondContact O-CG2 3.41Å; V120-V124 PolarHBondContact O-N 2.87Å
121	Y	85.8	Confident	82.2	Confident	135 Å²	135	61.1 Å²	61.1	53%	0.529	30%	0.298	S	S	.	.	H	α-helix	trans	-63.3	-50.4	177	175.6	-99.5	0	0	0	111.9	V117 F119 F123 V124 D125	V117-Y121 VanDerWaalsContact O-CB 3.22Å; V117-Y121 WeakPolarHBondContact O-CB 3.48Å; V117-Y121 PolarHBondContact O-N 3.38Å; F119-Y121 VanDerWaalsContact C-N 3.32Å; F119-Y121 PolarHBondContact O-N 3.06Å; Y121-F123 PolarHBondContact O-N 3.42Å; Y121-V124 PolarHBondContact O-N 3.41Å; Y121-D125 WeakPolarHBondContact O-CB 3.3Å; Y121-D125 PolarHBondContact O-N 2.93Å
122	S	79.2	Confident	81.1	Confident	22 Å²	22	67.4 Å²	67.4	15%	0.154	33%	0.325	C	S	.	.	H	α-helix	trans	-59.3	-38.9	179	-58.8	0	0	0	0	111	I118 F119 F126	I118-S122 VanDerWaalsContact O-CB 3.26Å; I118-S122 WeakPolarHBondContact O-CB 3.31Å; I118-S122 PolarHBondContact O-N 2.94Å; I118-S122 PolarHBondContact O-OG 3.46Å; F119-S122 PolarHBondContact O-N 3.31Å; S122-F126 WeakPolarHBondContact O-CB 3.32Å; S122-F126 PolarHBondContact O-N 3Å
123	F	76.1	Confident	80.2	Confident	26 Å²	26	66.7 Å²	66.7	11%	0.114	32%	0.322	C	S	.	.	H	α-helix	trans	-62.2	-51.9	176.2	-176.9	-85.5	0	0	0	112.1	A69 F119 V120 Y121 D125 F126 H127	A69-F123 HydrophobicContact CB-CE1 3.74Å; A69-F123 HydrophobicContact CB-CE2 4.04Å; A69-F123 HydrophobicContact CB-CZ 3.16Å; F119-F123 WeakPolarHBondContact O-CB 3.38Å; F119-F123 PolarHBondContact O-N 3.5Å; V120-F123 WeakPolarHBondContact O-CB 3.3Å; V120-F123 PolarHBondContact O-N 3.18Å; Y121-F123 PolarHBondContact O-N 3.42Å; F123-D125 PolarHBondContact O-N 3.24Å; F123-F126 PolarHBondContact O-N 2.95Å; F123-H127 AromaticContact CD2-CD2 3.47Å; F123-H127 VanDerWaalsContact CD2-CD2 3.47Å; F123-H127 WeakPolarHBondContact CD2-CD2 3.4Å; F123-H127 AromaticContact CD2-NE2 3.95Å; F123-H127 HydrophobicContact CE1-CB 3.98Å; F123-H127 AromaticContact CE1-CD2 3.99Å; F123-H127 HydrophobicContact CE2-CB 4.47Å; F123-H127 AromaticContact CE2-CD2 3.01Å; F123-H127 WeakPolarHBondContact CE2-CD2 3.29Å; F123-H127 AromaticContact CE2-CG 3.79Å; F123-H127 AromaticContact CE2-NE2 3.37Å; F123-H127 WeakPolarHBondContact CE2-NE2 3.47Å; F123-H127 HydrophobicContact CZ-CB 3.78Å; F123-H127 AromaticContact CZ-CD2 3.22Å; F123-H127 WeakPolarHBondContact CZ-CD2 3.36Å; F123-H127 AromaticContact CZ-CG 3.51Å; F123-H127 AromaticContact CZ-NE2 3.9Å; F123-H127 WeakPolarHBondContact O-CB 3.45Å; F123-H127 PolarHBondContact O-N 3.11Å
124	V	78.2	Confident	79.7	Confident	41 Å²	41	67.5 Å²	67.5	25%	0.248	33%	0.331	C	S	.	.	H	α-helix	trans	-63.6	-43	-180	170	0	0	0	0	111.1	V120 Y121 F126 V128 F129	V120-V124 HydrophobicContact CG1-CG2 4.49Å; V120-V124 VanDerWaalsContact O-CG2 3.32Å; V120-V124 WeakPolarHBondContact O-CG2 3.41Å; V120-V124 PolarHBondContact O-N 2.87Å; Y121-V124 PolarHBondContact O-N 3.41Å; V124-F126 VanDerWaalsContact C-N 3.31Å; V124-F126 PolarHBondContact O-N 2.85Å; V124-V128 HydrophobicContact CB-CG2 4.49Å; V124-V128 HydrophobicContact CG1-CB 4.16Å; V124-V128 HydrophobicContact CG1-CG2 4.11Å; V124-V128 WeakPolarHBondContact O-CA 3.39Å; V124-V128 VanDerWaalsContact O-CB 3.24Å; V124-V128 WeakPolarHBondContact O-CB 3.35Å; V124-V128 PolarHBondContact O-N 3.29Å; V124-F129 HydrophobicContact CG1-CD2 3.92Å; V124-F129 HydrophobicContact CG1-CE2 3.56Å; V124-F129 PolarHBondContact O-N 3.39Å
125	D	79.1	Confident	79.1	Confident	8 Å²	8	65.2 Å²	65.2	4%	0.043	32%	0.32	C	S	.	.	H	α-helix	trans	-61.6	-39.6	179.5	-166	65.1	0	0	0	112.1	Y121 F123 R131 K141	Y121-D125 WeakPolarHBondContact O-CB 3.3Å; Y121-D125 PolarHBondContact O-N 2.93Å; F123-D125 PolarHBondContact O-N 3.24Å; D125-R131 PolarHBondContact O-N 3.29Å; D125-R131 WeakPolarHBondContact OD1-CD 3.24Å; D125-R131 IonicContact OD1-NH1 3.26Å; D125-R131 PolarHBondContact OD1-NH1 3.04Å; D125-K141 IonicContact OD2-NZ 3.66Å; D125-K141 PolarHBondContact OD2-NZ 2.79Å
126	F	69.3	Low	78.8	Confident	58 Å²	58	69.8 Å²	69.8	25%	0.254	34%	0.342	S	S	.	.	H	α-helix	trans	-77.5	-52.9	178	-173.3	-100.5	0	0	0	113	M54 M58 S122 F123 V124 H130	M54-F126 HydrophobicContact CG-CE2 4.21Å; M54-F126 HydrophobicContact CG-CZ 4.46Å; M54-F126 HydrophobicContact SD-CE2 4.42Å; M58-F126 HydrophobicContact SD-CE1 4.01Å; M58-F126 HydrophobicContact SD-CZ 4.29Å; S122-F126 WeakPolarHBondContact O-CB 3.32Å; S122-F126 PolarHBondContact O-N 3Å; F123-F126 PolarHBondContact O-N 2.95Å; V124-F126 VanDerWaalsContact C-N 3.31Å; V124-F126 PolarHBondContact O-N 2.85Å; F126-H130 VanDerWaalsContact O-CA 3.3Å; F126-H130 WeakPolarHBondContact O-CA 3.35Å; F126-H130 PolarHBondContact O-N 2.84Å
127	H	66.8	Low	78.6	Confident	52 Å²	52	71.9 Å²	71.9	24%	0.241	35%	0.354	C	S	.	.	H	α-helix	trans	-87.5	-30.2	-169.9	-73.4	-79.4	0	0	0	115	Q65 F123 H130	Q65-H127 PolarHBondContact NE2-CE1 3.37Å; Q65-H127 PolarHBondContact NE2-ND1 3.39Å; F123-H127 AromaticContact CD2-CD2 3.47Å; F123-H127 VanDerWaalsContact CD2-CD2 3.47Å; F123-H127 WeakPolarHBondContact CD2-CD2 3.4Å; F123-H127 AromaticContact CD2-NE2 3.95Å; F123-H127 HydrophobicContact CE1-CB 3.98Å; F123-H127 AromaticContact CE1-CD2 3.99Å; F123-H127 HydrophobicContact CE2-CB 4.47Å; F123-H127 AromaticContact CE2-CD2 3.01Å; F123-H127 WeakPolarHBondContact CE2-CD2 3.29Å; F123-H127 AromaticContact CE2-CG 3.79Å; F123-H127 AromaticContact CE2-NE2 3.37Å; F123-H127 WeakPolarHBondContact CE2-NE2 3.47Å; F123-H127 HydrophobicContact CZ-CB 3.78Å; F123-H127 AromaticContact CZ-CD2 3.22Å; F123-H127 WeakPolarHBondContact CZ-CD2 3.36Å; F123-H127 AromaticContact CZ-CG 3.51Å; F123-H127 AromaticContact CZ-NE2 3.9Å; F123-H127 WeakPolarHBondContact O-CB 3.45Å; F123-H127 PolarHBondContact O-N 3.11Å; H127-H130 PolarHBondContact O-CE1 3.02Å; H127-H130 VanDerWaalsContact O-CE1 3.26Å
128	V	69.1	Low	78.3	Confident	87 Å²	87	69.8 Å²	69.8	53%	0.527	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-49.7	-178.7	-176.7	0	0	0	0	109.3	V124 H130	V124-V128 HydrophobicContact CB-CG2 4.49Å; V124-V128 HydrophobicContact CG1-CB 4.16Å; V124-V128 HydrophobicContact CG1-CG2 4.11Å; V124-V128 WeakPolarHBondContact O-CA 3.39Å; V124-V128 VanDerWaalsContact O-CB 3.24Å; V124-V128 WeakPolarHBondContact O-CB 3.35Å; V124-V128 PolarHBondContact O-N 3.29Å; V128-H130 PolarHBondContact O-ND1 2.82Å; V128-H130 VanDerWaalsContact O-ND1 3.16Å
129	F	73.3	Confident	78.2	Confident	132 Å²	132	67.8 Å²	67.8	58%	0.579	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	-3.6	-174.5	-61.6	-62	0	0	0	114.3	V124 R131	V124-F129 HydrophobicContact CG1-CD2 3.92Å; V124-F129 HydrophobicContact CG1-CE2 3.56Å; V124-F129 PolarHBondContact O-N 3.39Å; F129-R131 HydrophobicContact CB-CG 4.28Å; F129-R131 PolarHBondContact O-N 3.43Å
130	H	67.6	Low	78.6	Confident	151 Å²	151	70.3 Å²	70.3	70%	0.699	34%	0.34	S	S	*	.			trans	49.7	34.1	177	-64.3	77.3	0	0	0	113	F126 H127 V128	F126-H130 VanDerWaalsContact O-CA 3.3Å; F126-H130 WeakPolarHBondContact O-CA 3.35Å; F126-H130 PolarHBondContact O-N 2.84Å; H127-H130 PolarHBondContact O-CE1 3.02Å; H127-H130 VanDerWaalsContact O-CE1 3.26Å; V128-H130 PolarHBondContact O-ND1 2.82Å; V128-H130 VanDerWaalsContact O-ND1 3.16Å
131	R	70.4	Confident	78.7	Confident	147 Å²	147	70.1 Å²	70.1	56%	0.555	34%	0.336	S	S	*	.			trans	-78.2	131.2	-179.2	-78.1	-167.4	176.3	154.5	-5.6	110.3	D125 F129	D125-R131 PolarHBondContact O-N 3.29Å; D125-R131 WeakPolarHBondContact OD1-CD 3.24Å; D125-R131 IonicContact OD1-NH1 3.26Å; D125-R131 PolarHBondContact OD1-NH1 3.04Å; F129-R131 HydrophobicContact CB-CG 4.28Å; F129-R131 PolarHBondContact O-N 3.43Å
132	K	71.6	Confident	78.8	Confident	131 Å²	131	65 Å²	65	57%	0.57	32%	0.318	S	S	*	.			trans	-84.1	115	172.1	-58.3	-161.8	176.9	-160.8	0	108.7	M52 E55	M52-K132 HydrophobicContact CE-CB 4.41Å; M52-K132 HydrophobicContact CE-CD 3.86Å; M52-K132 HydrophobicContact SD-CB 4.42Å; M52-K132 HydrophobicContact SD-CD 3.52Å; M52-K132 VanDerWaalsContact SD-CD 3.52Å; E55-K132 IonicContact OE1-NZ 2.81Å
133	D	76.9	Confident	79.4	Confident	30 Å²	30	64.3 Å²	64.3	16%	0.16	32%	0.315	C	S	.	.			trans	-73.1	142.2	179.8	-79.3	-30.9	0	0	0	111.4	F51 V137 F138 K141	F51-D133 WeakPolarHBondContact CZ-O 3.36Å; D133-V137 HydrophobicContact CB-CB 4.46Å; D133-V137 HydrophobicContact CB-CG1 4.31Å; D133-V137 WeakPolarHBondContact OD1-CG1 3.38Å; D133-F138 HydrophobicContact CB-CB 4.2Å; D133-K141 IonicContact OD1-NZ 2.76Å; D133-K141 PolarHBondContact OD1-NZ 3.47Å; D133-K141 WeakPolarHBondContact OD2-CD 3.33Å; D133-K141 IonicContact OD2-NZ 2.72Å; D133-K141 PolarHBondContact OD2-NZ 3.42Å
134	S	83.8	Confident	80.2	Confident	52 Å²	52	64 Å²	64	36%	0.364	32%	0.318	S	S	.	.			trans	-72.1	160	164.3	78.3	0	0	0	0	110.2	N136 V137 F138	S134-N136 PolarHBondContact O-N 3.1Å; S134-V137 PolarHBondContact O-N 3.26Å; S134-V137 VanDerWaalsContact OG-CG2 3.23Å; S134-V137 WeakPolarHBondContact OG-CG2 3.31Å; S134-V137 PolarHBondContact OG-N 3.45Å; S134-F138 PolarHBondContact O-N 2.94Å
135	P	81.6	Confident	80.8	Confident	30 Å²	30	63.3 Å²	63.3	20%	0.195	31%	0.314	C	S	.	.	H	α-helix	trans	-57.3	-40.1	-175.7	-9.3	17.6	0	0	0	111.7	F51 L139 L219	F51-P135 HydrophobicContact CD2-CB 4.47Å; F51-P135 HydrophobicContact CD2-CG 3.87Å; F51-P135 HydrophobicContact CE1-CG 4.02Å; F51-P135 HydrophobicContact CE2-CB 3.68Å; F51-P135 HydrophobicContact CE2-CG 3.28Å; F51-P135 HydrophobicContact CG-CG 4.49Å; F51-P135 HydrophobicContact CZ-CB 4.06Å; F51-P135 HydrophobicContact CZ-CG 3.41Å; F51-P135 VanDerWaalsContact CZ-CG 3.41Å; P135-L139 WeakPolarHBondContact O-CB 3.32Å; P135-L139 WeakPolarHBondContact O-CG 3.33Å; P135-L139 PolarHBondContact O-N 3.27Å; P135-L219 HydrophobicContact CB-CD2 3.66Å
136	N	85.7	Confident	81.5	Confident	108 Å²	108	63.9 Å²	63.9	58%	0.578	32%	0.318	S	S	*	.	H	α-helix	trans	-72.6	-34.9	-178.9	-64.3	-20.6	0	0	0	112	S134 F140 L201	S134-N136 PolarHBondContact O-N 3.1Å; N136-F140 WeakPolarHBondContact O-CB 3.2Å; N136-F140 PolarHBondContact O-N 3.43Å; N136-L201 WeakPolarHBondContact O-CD2 3.27Å
137	V	86.6	Confident	82.7	Confident	61 Å²	61	61.8 Å²	61.8	37%	0.37	31%	0.312	S	S	.	.	H	α-helix	trans	-68.8	-43.2	176.2	172.1	0	0	0	0	110.2	D133 S134 F140 K141	D133-V137 HydrophobicContact CB-CB 4.46Å; D133-V137 HydrophobicContact CB-CG1 4.31Å; D133-V137 WeakPolarHBondContact OD1-CG1 3.38Å; S134-V137 PolarHBondContact O-N 3.26Å; S134-V137 VanDerWaalsContact OG-CG2 3.23Å; S134-V137 WeakPolarHBondContact OG-CG2 3.31Å; S134-V137 PolarHBondContact OG-N 3.45Å; V137-F140 PolarHBondContact O-N 3.23Å; V137-K141 HydrophobicContact CG1-CD 4.28Å; V137-K141 WeakPolarHBondContact O-CG 3.36Å; V137-K141 PolarHBondContact O-N 3.29Å
138	F	84.6	Confident	84.1	Confident	29 Å²	29	59.7 Å²	59.7	13%	0.127	30%	0.303	C	S	.	.	H	α-helix	trans	-60	-51.5	174.8	173.9	-100.8	0	0	0	111.7	M54 D133 S134 F140 K141 L142 P218	M54-F138 HydrophobicContact CE-CD2 3.47Å; M54-F138 VanDerWaalsContact CE-CD2 3.47Å; M54-F138 HydrophobicContact CE-CE2 3.17Å; M54-F138 HydrophobicContact CE-CZ 4.02Å; M54-F138 HydrophobicContact SD-CD2 4.03Å; M54-F138 HydrophobicContact SD-CE2 4.26Å; D133-F138 HydrophobicContact CB-CB 4.2Å; S134-F138 PolarHBondContact O-N 2.94Å; F138-F140 PolarHBondContact O-N 2.9Å; F138-K141 PolarHBondContact O-N 2.97Å; F138-L142 HydrophobicContact CE1-CD2 3.95Å; F138-L142 HydrophobicContact CZ-CD2 4.03Å; F138-L142 WeakPolarHBondContact O-CB 3.49Å; F138-L142 PolarHBondContact O-N 2.97Å; F138-P218 HydrophobicContact CE1-CB 4.09Å; F138-P218 HydrophobicContact CE1-CG 4.43Å; F138-P218 WeakPolarHBondContact CE1-O 3.19Å; F138-P218 HydrophobicContact CZ-CB 4.36Å; F138-P218 HydrophobicContact CZ-CG 4.2Å
139	L	88.4	Confident	85.2	Confident	6 Å²	6	60.3 Å²	60.3	3%	0.031	30%	0.298	C	S	.	.	H	α-helix	trans	-61.8	-29.2	177.4	-72.9	176	0	0	0	112.5	P135 G143 P200 L201 N205 L219 I220	P135-L139 WeakPolarHBondContact O-CB 3.32Å; P135-L139 WeakPolarHBondContact O-CG 3.33Å; P135-L139 PolarHBondContact O-N 3.27Å; L139-G143 WeakPolarHBondContact O-CA 3.33Å; L139-G143 PolarHBondContact O-N 2.93Å; L139-P200 HydrophobicContact CD2-CB 4.2Å; L139-L201 HydrophobicContact CB-CD2 3.49Å; L139-L201 VanDerWaalsContact CB-CD2 3.49Å; L139-L201 HydrophobicContact CB-CG 3.94Å; L139-N205 HydrophobicContact CD1-CB 4.41Å; L139-L219 HydrophobicContact CD1-CD2 4.18Å; L139-L219 HydrophobicContact CD2-CB 4.03Å; L139-L219 HydrophobicContact CG-CB 4.46Å; L139-L219 HydrophobicContact CG-CD2 4.22Å; L139-I220 HydrophobicContact CD2-CD1 3.84Å
140	F	90.6	Very high	86.3	Confident	144 Å²	144	54.5 Å²	54.5	63%	0.632	27%	0.274	S	S	*	.	H	α-helix	trans	-72.6	-44.6	174.6	-177.9	-95.1	0	0	0	112.7	N136 V137 F138 G143 G144 L201	N136-F140 WeakPolarHBondContact O-CB 3.2Å; N136-F140 PolarHBondContact O-N 3.43Å; V137-F140 PolarHBondContact O-N 3.23Å; F138-F140 PolarHBondContact O-N 2.9Å; F140-G143 PolarHBondContact O-N 3.09Å; F140-G144 PolarHBondContact O-N 3.11Å; F140-L201 HydrophobicContact CB-CD1 4.3Å; F140-L201 HydrophobicContact CB-CD2 4.34Å; F140-L201 HydrophobicContact CD2-CD1 4.14Å
141	K	88.3	Confident	87.7	Confident	22 Å²	22	47.3 Å²	47.3	10%	0.096	24%	0.241	C	C	.	.	H	α-helix	trans	-59.5	-49.9	173.1	-72.2	173.4	176.4	176.6	0	110.5	D125 D133 V137 F138 G144 V145	D125-K141 IonicContact OD2-NZ 3.66Å; D125-K141 PolarHBondContact OD2-NZ 2.79Å; D133-K141 IonicContact OD1-NZ 2.76Å; D133-K141 PolarHBondContact OD1-NZ 3.47Å; D133-K141 WeakPolarHBondContact OD2-CD 3.33Å; D133-K141 IonicContact OD2-NZ 2.72Å; D133-K141 PolarHBondContact OD2-NZ 3.42Å; V137-K141 HydrophobicContact CG1-CD 4.28Å; V137-K141 WeakPolarHBondContact O-CG 3.36Å; V137-K141 PolarHBondContact O-N 3.29Å; F138-K141 PolarHBondContact O-N 2.97Å; K141-G144 PolarHBondContact O-N 3.38Å; K141-V145 WeakPolarHBondContact O-CG2 3.43Å; K141-V145 PolarHBondContact O-N 2.98Å; K141-V145 VanDerWaalsContact O-N 3.07Å
142	L	87.8	Confident	88.9	Confident	29 Å²	29	40.9 Å²	40.9	15%	0.152	22%	0.218	C	C	.	.	H	α-helix	trans	-62.2	-46	177.9	-178.1	58.5	0	0	0	111.6	F138 G144 V145 T146 F217 I220	F138-L142 HydrophobicContact CE1-CD2 3.95Å; F138-L142 HydrophobicContact CZ-CD2 4.03Å; F138-L142 WeakPolarHBondContact O-CB 3.49Å; F138-L142 PolarHBondContact O-N 2.97Å; L142-G144 VanDerWaalsContact C-N 3.29Å; L142-G144 PolarHBondContact O-N 3.49Å; L142-V145 WeakPolarHBondContact O-CB 3.36Å; L142-V145 PolarHBondContact O-N 2.94Å; L142-V145 VanDerWaalsContact O-N 3.13Å; L142-T146 PolarHBondContact O-N 3.35Å; L142-T146 PolarHBondContact O-OG1 3.46Å; L142-F217 HydrophobicContact CD1-CD1 4.2Å; L142-F217 HydrophobicContact CD1-CE1 4.24Å; L142-F217 HydrophobicContact CD2-CD1 4.33Å; L142-I220 HydrophobicContact CD2-CD1 3.81Å; L142-I220 HydrophobicContact CD2-CG1 3.65Å
143	G	91.8	Very high	90	Very high	7 Å²	7	34.7 Å²	34.7	7%	0.072	19%	0.191	C	C	.	.	H	α-helix	trans	-59.8	-37.5	175.3	0	0	0	0	0	112.5	L139 F140 T146 A147 A197	L139-G143 WeakPolarHBondContact O-CA 3.33Å; L139-G143 PolarHBondContact O-N 2.93Å; F140-G143 PolarHBondContact O-N 3.09Å; G143-T146 PolarHBondContact O-N 3.48Å; G143-A147 VanDerWaalsContact O-CB 3.24Å; G143-A147 WeakPolarHBondContact O-CB 3.45Å; G143-A147 PolarHBondContact O-N 3.13Å; G143-A197 WeakPolarHBondContact O-CB 3.4Å
144	G	92.9	Very high	90.9	Very high	18 Å²	18	33.4 Å²	33.4	19%	0.186	19%	0.185	C	C	.	.	H	α-helix	trans	-61.1	-46.3	172.5	0	0	0	0	0	112.6	F140 K141 L142 A147 S148	F140-G144 PolarHBondContact O-N 3.11Å; K141-G144 PolarHBondContact O-N 3.38Å; L142-G144 VanDerWaalsContact C-N 3.29Å; L142-G144 PolarHBondContact O-N 3.49Å; G144-A147 PolarHBondContact O-N 3.38Å; G144-S148 PolarHBondContact O-N 3.48Å; G144-S148 PolarHBondContact O-OG 3.4Å
145	V	90.8	Very high	91.5	Very high	27 Å²	27	31 Å²	31	16%	0.164	17%	0.168	C	C	.	.	H	α-helix	trans	-62	-48.9	175.3	174.1	0	0	0	0	110.9	I118 K141 L142 A147 S148 F149	I118-V145 HydrophobicContact CG2-CG2 3.81Å; K141-V145 WeakPolarHBondContact O-CG2 3.43Å; K141-V145 PolarHBondContact O-N 2.98Å; K141-V145 VanDerWaalsContact O-N 3.07Å; L142-V145 WeakPolarHBondContact O-CB 3.36Å; L142-V145 PolarHBondContact O-N 2.94Å; L142-V145 VanDerWaalsContact O-N 3.13Å; V145-A147 VanDerWaalsContact C-N 3.34Å; V145-A147 PolarHBondContact O-N 3.07Å; V145-S148 PolarHBondContact O-N 3.13Å; V145-F149 HydrophobicContact CG1-CD2 3.57Å; V145-F149 HydrophobicContact CG1-CE2 3.5Å; V145-F149 VanDerWaalsContact O-CD2 3.28Å; V145-F149 WeakPolarHBondContact O-CD2 3.37Å; V145-F149 PolarHBondContact O-N 3.3Å
146	T	92.9	Very high	92.1	Very high	20 Å²	20	31.3 Å²	31.3	12%	0.123	17%	0.168	C	C	.	.	H	α-helix	trans	-58.9	-43.5	177	-56.8	0	0	0	0	111.7	L142 G143 S148 F149 T150 A197 W228	L142-T146 PolarHBondContact O-N 3.35Å; L142-T146 PolarHBondContact O-OG1 3.46Å; G143-T146 PolarHBondContact O-N 3.48Å; T146-S148 PolarHBondContact O-N 2.97Å; T146-F149 PolarHBondContact O-N 2.87Å; T146-T150 WeakPolarHBondContact O-CB 3.45Å; T146-T150 PolarHBondContact O-N 2.9Å; T146-T150 PolarHBondContact O-OG1 3.27Å; T146-A197 HydrophobicContact CG2-CB 4.12Å; T146-W228 VanDerWaalsContact CG2-NE1 3.29Å
147	A	95.5	Very high	92.6	Very high	15 Å²	15	28.4 Å²	28.4	12%	0.124	15%	0.15	C	C	.	.	H	α-helix	trans	-60.9	-45.8	177.4	0	0	0	0	0	111.4	G143 G144 V145 T150 A151 A197	G143-A147 VanDerWaalsContact O-CB 3.24Å; G143-A147 WeakPolarHBondContact O-CB 3.45Å; G143-A147 PolarHBondContact O-N 3.13Å; G144-A147 PolarHBondContact O-N 3.38Å; V145-A147 VanDerWaalsContact C-N 3.34Å; V145-A147 PolarHBondContact O-N 3.07Å; A147-T150 PolarHBondContact O-N 3.01Å; A147-A151 WeakPolarHBondContact O-CB 3.42Å; A147-A151 PolarHBondContact O-N 3.34Å; A147-A197 HydrophobicContact CB-CB 3.59Å
148	S	95.2	Very high	93.1	Very high	8 Å²	8	26.4 Å²	26.4	6%	0.056	14%	0.138	C	C	.	.	H	α-helix	trans	-62.2	-46.4	177.1	-72.1	0	0	0	0	112.1	A111 G115 G144 V145 T146 A151 S152	A111-S148 WeakPolarHBondContact O-CB 3.24Å; A111-S148 PolarHBondContact O-OG 3.31Å; G115-S148 VanDerWaalsContact CA-CB 3.45Å; G115-S148 WeakPolarHBondContact CA-OG 3.19Å; G115-S148 PolarHBondContact N-OG 3.47Å; G144-S148 PolarHBondContact O-N 3.48Å; G144-S148 PolarHBondContact O-OG 3.4Å; V145-S148 PolarHBondContact O-N 3.13Å; T146-S148 PolarHBondContact O-N 2.97Å; S148-A151 PolarHBondContact O-N 3.48Å; S148-S152 VanDerWaalsContact O-CB 3.29Å; S148-S152 WeakPolarHBondContact O-CB 3.36Å; S148-S152 PolarHBondContact O-N 3.34Å
149	F	93.7	Very high	93.5	Very high	99 Å²	99	26 Å²	26	43%	0.434	14%	0.137	S	C	.	.	H	α-helix	trans	-62.8	-46.1	176.6	-85.2	-69.1	0	0	0	112.3	V145 T146 A151 S152 V153 W305	V145-F149 HydrophobicContact CG1-CD2 3.57Å; V145-F149 HydrophobicContact CG1-CE2 3.5Å; V145-F149 VanDerWaalsContact O-CD2 3.28Å; V145-F149 WeakPolarHBondContact O-CD2 3.37Å; V145-F149 PolarHBondContact O-N 3.3Å; T146-F149 PolarHBondContact O-N 2.87Å; F149-A151 VanDerWaalsContact C-N 3.33Å; F149-A151 PolarHBondContact O-N 3.42Å; F149-S152 PolarHBondContact O-N 3.32Å; F149-V153 WeakPolarHBondContact O-CG2 3.49Å; F149-V153 PolarHBondContact O-N 2.88Å; F149-W305 HydrophobicContact CB-CH2 4.27Å; F149-W305 AromaticContact CD1-CH2 3.84Å; F149-W305 HydrophobicContact CD1-CH2 3.84Å; F149-W305 HydrophobicContact CD1-CZ2 4.06Å; F149-W305 HydrophobicContact CG-CH2 4.44Å
150	T	95.6	Very high	93.8	Very high	11 Å²	11	25.7 Å²	25.7	7%	0.067	14%	0.136	C	C	.	.	H	α-helix	trans	-63	-40.1	177.2	-60.6	0	0	0	0	111.5	T146 A147 G154 A193 W228	T146-T150 WeakPolarHBondContact O-CB 3.45Å; T146-T150 PolarHBondContact O-N 2.9Å; T146-T150 PolarHBondContact O-OG1 3.27Å; A147-T150 PolarHBondContact O-N 3.01Å; T150-G154 PolarHBondContact O-N 2.9Å; T150-A193 HydrophobicContact CG2-CB 3.74Å; T150-W228 PolarHBondContact OG1-NE1 3.49Å
151	A	96.1	Very high	93.9	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-68	-35.1	175.6	0	0	0	0	0	112.7	A111 A147 S148 F149 G154 S155 M189 W190 A193	A111-A151 HydrophobicContact CB-CB 3.95Å; A147-A151 WeakPolarHBondContact O-CB 3.42Å; A147-A151 PolarHBondContact O-N 3.34Å; S148-A151 PolarHBondContact O-N 3.48Å; F149-A151 VanDerWaalsContact C-N 3.33Å; F149-A151 PolarHBondContact O-N 3.42Å; A151-G154 PolarHBondContact O-N 2.91Å; A151-S155 WeakPolarHBondContact O-CB 3.48Å; A151-S155 PolarHBondContact O-N 2.91Å; A151-S155 PolarHBondContact O-OG 3.31Å; A151-M189 HydrophobicContact CB-SD 4.34Å; A151-M189 WeakPolarHBondContact O-CE 3.49Å; A151-W190 HydrophobicContact CB-CD2 4.2Å; A151-W190 HydrophobicContact CB-CE3 4.24Å; A151-W190 HydrophobicContact CB-CH2 4.16Å; A151-W190 HydrophobicContact CB-CZ2 4.11Å; A151-W190 HydrophobicContact CB-CZ3 4.22Å; A151-A193 HydrophobicContact CB-CB 4.1Å
152	S	95.6	Very high	94.1	Very high	12 Å²	12	20.2 Å²	20.2	8%	0.084	11%	0.114	C	C	.	.	H	α-helix	trans	-65	-50.8	175.2	-174.4	0	0	0	0	110.7	L108 D112 S148 F149 G154 S155 L156	L108-S152 WeakPolarHBondContact CD1-OG 3.29Å; D112-S152 WeakPolarHBondContact OD1-CB 3.34Å; D112-S152 PolarHBondContact OD1-OG 3.07Å; S148-S152 VanDerWaalsContact O-CB 3.29Å; S148-S152 WeakPolarHBondContact O-CB 3.36Å; S148-S152 PolarHBondContact O-N 3.34Å; F149-S152 PolarHBondContact O-N 3.32Å; S152-G154 PolarHBondContact O-N 2.88Å; S152-S155 WeakPolarHBondContact O-CB 3.48Å; S152-S155 PolarHBondContact O-N 3.49Å; S152-S155 VanDerWaalsContact O-N 3.11Å; S152-L156 WeakPolarHBondContact O-CG 3.48Å; S152-L156 PolarHBondContact O-N 3.28Å
153	V	95.9	Very high	94.3	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-60.2	-43.5	173.7	176.6	0	0	0	0	111.6	F149 S155 L156 F157 T232 L235 L236 W305	F149-V153 WeakPolarHBondContact O-CG2 3.49Å; F149-V153 PolarHBondContact O-N 2.88Å; V153-S155 VanDerWaalsContact C-N 3.29Å; V153-S155 PolarHBondContact O-N 3.3Å; V153-L156 WeakPolarHBondContact O-CB 3.42Å; V153-L156 PolarHBondContact O-N 2.86Å; V153-F157 WeakPolarHBondContact O-CB 3.26Å; V153-F157 PolarHBondContact O-N 3.46Å; V153-T232 HydrophobicContact CG2-CG2 4.41Å; V153-L235 HydrophobicContact CG1-CB 3.9Å; V153-L235 HydrophobicContact CG1-CD1 4.11Å; V153-L236 HydrophobicContact CG1-CD2 4.2Å; V153-L236 HydrophobicContact CG1-CG 4.35Å; V153-W305 HydrophobicContact CG2-CD2 4.48Å; V153-W305 HydrophobicContact CG2-CH2 3.3Å; V153-W305 HydrophobicContact CG2-CZ2 3.11Å; V153-W305 HydrophobicContact CG2-CZ3 4.07Å
154	G	96.4	Very high	94.3	Very high	4 Å²	4	25.9 Å²	25.9	4%	0.041	13%	0.131	C	C	.	.	H	α-helix	trans	-61	-37	175.6	0	0	0	0	0	112.8	T150 A151 S152 F157 L158	T150-G154 PolarHBondContact O-N 2.9Å; A151-G154 PolarHBondContact O-N 2.91Å; S152-G154 PolarHBondContact O-N 2.88Å; G154-F157 WeakPolarHBondContact O-CB 3.46Å; G154-F157 PolarHBondContact O-N 2.8Å; G154-L158 WeakPolarHBondContact O-CG 3.35Å; G154-L158 PolarHBondContact O-N 3.28Å
155	S	96	Very high	94.2	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-69.6	-39.1	175.5	-59.8	0	0	0	0	111.9	S107 A151 S152 V153 F157 L158 T159 M189	S107-S155 PolarHBondContact OG-OG 2.96Å; A151-S155 WeakPolarHBondContact O-CB 3.48Å; A151-S155 PolarHBondContact O-N 2.91Å; A151-S155 PolarHBondContact O-OG 3.31Å; S152-S155 WeakPolarHBondContact O-CB 3.48Å; S152-S155 PolarHBondContact O-N 3.49Å; S152-S155 VanDerWaalsContact O-N 3.11Å; V153-S155 VanDerWaalsContact C-N 3.29Å; V153-S155 PolarHBondContact O-N 3.3Å; S155-F157 VanDerWaalsContact C-N 3.34Å; S155-L158 PolarHBondContact O-N 3.33Å; S155-T159 WeakPolarHBondContact O-CB 3.09Å; S155-T159 PolarHBondContact O-N 3.05Å; S155-T159 PolarHBondContact O-OG1 3.41Å; S155-M189 VanDerWaalsContact OG-CE 3.27Å; S155-M189 WeakPolarHBondContact OG-CE 3.17Å
156	L	94.4	Very high	94.1	Very high	37 Å²	37	26.7 Å²	26.7	19%	0.194	13%	0.133	C	C	.	.	H	α-helix	trans	-62.7	-41.5	171.3	-69.5	172.8	0	0	0	111.3	L108 S152 V153 T159 A160 I239 L301	L108-L156 HydrophobicContact CD1-CD2 4.41Å; L108-L156 HydrophobicContact CD1-CG 4.18Å; L108-L156 HydrophobicContact CD2-CD2 3.85Å; L108-L156 HydrophobicContact CD2-CG 4.48Å; S152-L156 WeakPolarHBondContact O-CG 3.48Å; S152-L156 PolarHBondContact O-N 3.28Å; V153-L156 WeakPolarHBondContact O-CB 3.42Å; V153-L156 PolarHBondContact O-N 2.86Å; L156-T159 WeakPolarHBondContact O-CB 3.38Å; L156-T159 PolarHBondContact O-N 3.03Å; L156-A160 WeakPolarHBondContact O-CB 3.41Å; L156-A160 PolarHBondContact O-N 2.94Å; L156-I239 HydrophobicContact CB-CD1 3.91Å; L156-L301 HydrophobicContact CD1-CD1 4.05Å
157	F	96.3	Very high	93.7	Very high	47 Å²	47	28.8 Å²	28.8	21%	0.206	14%	0.142	C	C	.	.	H	α-helix	trans	-62.3	-48.3	176.2	173.1	-101.9	0	0	0	112.3	V153 G154 S155 T159 A160 I161 L235 F238 I239	V153-F157 WeakPolarHBondContact O-CB 3.26Å; V153-F157 PolarHBondContact O-N 3.46Å; G154-F157 WeakPolarHBondContact O-CB 3.46Å; G154-F157 PolarHBondContact O-N 2.8Å; S155-F157 VanDerWaalsContact C-N 3.34Å; F157-T159 VanDerWaalsContact C-N 3.28Å; F157-T159 PolarHBondContact O-N 3.25Å; F157-A160 WeakPolarHBondContact O-CB 3.43Å; F157-A160 PolarHBondContact O-N 2.99Å; F157-A160 VanDerWaalsContact O-N 3.11Å; F157-I161 HydrophobicContact CD1-CD1 3.9Å; F157-I161 HydrophobicContact CE1-CD1 3.31Å; 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 3.21Å; F157-I161 PolarHBondContact O-N 3.28Å; F157-L235 HydrophobicContact CB-CD2 4.45Å; F157-L235 HydrophobicContact CD1-CD2 4.09Å; F157-L235 HydrophobicContact CD2-CD2 3.81Å; F157-L235 HydrophobicContact CE1-CD2 4.22Å; F157-L235 HydrophobicContact CE2-CD2 3.94Å; F157-L235 HydrophobicContact CG-CD2 3.88Å; F157-L235 HydrophobicContact CZ-CD2 4.14Å; F157-F238 HydrophobicContact CD2-CB 4.25Å; F157-F238 AromaticContact CD2-CD1 3.54Å; F157-F238 HydrophobicContact CD2-CD1 3.54Å; F157-F238 HydrophobicContact CD2-CE1 4.2Å; F157-F238 HydrophobicContact CD2-CG 4.13Å; F157-F238 HydrophobicContact CE2-CB 3.89Å; F157-F238 AromaticContact CE2-CD1 3.18Å; F157-F238 HydrophobicContact CE2-CD1 3.18Å; F157-F238 HydrophobicContact CE2-CD2 4.27Å; F157-F238 AromaticContact CE2-CE1 3.69Å; F157-F238 HydrophobicContact CE2-CE1 3.69Å; F157-F238 AromaticContact CE2-CG 3.51Å; F157-F238 HydrophobicContact CE2-CG 3.51Å; F157-F238 HydrophobicContact CE2-CZ 4.41Å; F157-F238 HydrophobicContact CZ-CD1 4.23Å; F157-F238 HydrophobicContact CZ-CE1 4.38Å; F157-I239 HydrophobicContact CB-CD1 4.03Å; F157-I239 HydrophobicContact CB-CG1 4.14Å; F157-I239 HydrophobicContact CD2-CG1 4.35Å
158	L	95.3	Very high	93.2	Very high	20 Å²	20	30.8 Å²	30.8	11%	0.105	15%	0.149	C	C	.	.	H	α-helix	trans	-61.3	-38.4	175.1	-71	176.4	0	0	0	111.9	F104 G154 S155 I161 D162 A185 M189	F104-L158 HydrophobicContact CD1-CB 3.75Å; F104-L158 HydrophobicContact CD1-CD1 3.93Å; F104-L158 HydrophobicContact CD1-CG 4.46Å; F104-L158 HydrophobicContact CE1-CB 3.96Å; F104-L158 HydrophobicContact CE1-CD1 3.93Å; F104-L158 HydrophobicContact CE1-CG 4.41Å; F104-L158 HydrophobicContact CG-CB 4.12Å; F104-L158 HydrophobicContact CZ-CB 4.48Å; G154-L158 WeakPolarHBondContact O-CG 3.35Å; G154-L158 PolarHBondContact O-N 3.28Å; S155-L158 PolarHBondContact O-N 3.33Å; L158-I161 PolarHBondContact O-N 2.94Å; L158-D162 WeakPolarHBondContact O-CB 3.33Å; L158-D162 PolarHBondContact O-N 3.32Å; L158-A185 HydrophobicContact CD2-CB 4.22Å; L158-M189 HydrophobicContact CD1-CB 4.02Å; L158-M189 HydrophobicContact CD1-CE 4.33Å; L158-M189 HydrophobicContact CD1-CG 4.22Å
159	T	94.2	Very high	92.8	Very high	19 Å²	19	37.4 Å²	37.4	12%	0.117	17%	0.173	C	C	.	.	H	α-helix	trans	-63.4	-41.9	173.5	-58.1	0	0	0	0	111.2	F104 S155 L156 F157 D162 R163	F104-T159 WeakPolarHBondContact CB-OG1 3.3Å; S155-T159 WeakPolarHBondContact O-CB 3.09Å; S155-T159 PolarHBondContact O-N 3.05Å; S155-T159 PolarHBondContact O-OG1 3.41Å; L156-T159 WeakPolarHBondContact O-CB 3.38Å; L156-T159 PolarHBondContact O-N 3.03Å; F157-T159 VanDerWaalsContact C-N 3.28Å; F157-T159 PolarHBondContact O-N 3.25Å; T159-D162 PolarHBondContact O-N 2.86Å; T159-R163 VanDerWaalsContact O-CG 3.31Å; T159-R163 WeakPolarHBondContact O-CG 3.16Å; T159-R163 PolarHBondContact O-N 3.49Å
160	A	93.6	Very high	92.4	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-63.8	-41.8	177	0	0	0	0	0	111.5	L156 F157 R163 Y164 I239 A242 Y243	L156-A160 WeakPolarHBondContact O-CB 3.41Å; L156-A160 PolarHBondContact O-N 2.94Å; F157-A160 WeakPolarHBondContact O-CB 3.43Å; F157-A160 PolarHBondContact O-N 2.99Å; F157-A160 VanDerWaalsContact O-N 3.11Å; A160-R163 PolarHBondContact O-N 3.1Å; A160-Y164 VanDerWaalsContact O-CB 3.23Å; A160-Y164 WeakPolarHBondContact O-CB 3.21Å; A160-Y164 PolarHBondContact O-N 2.98Å; A160-I239 HydrophobicContact CB-CB 4.41Å; A160-I239 HydrophobicContact CB-CG1 4.06Å; A160-I239 HydrophobicContact CB-CG2 4.27Å; A160-A242 HydrophobicContact CB-CB 4.23Å; A160-Y243 HydrophobicContact CB-CE2 4.24Å
161	I	94.1	Very high	92.1	Very high	47 Å²	47	44.9 Å²	44.9	24%	0.241	22%	0.22	C	C	.	.	H	α-helix	trans	-61.2	-47.9	173.3	-70.2	176	0	0	0	111.2	F157 L158 R163 Y164 I165 F238	F157-I161 HydrophobicContact CD1-CD1 3.9Å; F157-I161 HydrophobicContact CE1-CD1 3.31Å; 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 3.21Å; F157-I161 PolarHBondContact O-N 3.28Å; L158-I161 PolarHBondContact O-N 2.94Å; I161-R163 VanDerWaalsContact C-N 3.31Å; I161-R163 PolarHBondContact O-N 3Å; I161-Y164 WeakPolarHBondContact O-CB 3.46Å; I161-Y164 PolarHBondContact O-N 2.93Å; 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 3.21Å; I161-I165 PolarHBondContact O-N 3.1Å; I161-F238 HydrophobicContact CD1-CE1 4.36Å; I161-F238 HydrophobicContact CG1-CE1 3.64Å; I161-F238 HydrophobicContact CG1-CZ 4.09Å
162	D	93	Very high	91.8	Very high	4 Å²	4	45.9 Å²	45.9	2%	0.021	23%	0.229	C	C	.	.	H	α-helix	trans	-55.3	-48.4	178	176.1	65.4	0	0	0	111	S101 F104 L158 T159 I165 S166 Y173	S101-D162 VanDerWaalsContact CB-OD2 3.27Å; S101-D162 WeakPolarHBondContact CB-OD2 3.41Å; S101-D162 PolarHBondContact OG-OD1 2.88Å; S101-D162 PolarHBondContact OG-OD2 3.5Å; F104-D162 HydrophobicContact CD2-CB 4.14Å; F104-D162 HydrophobicContact CE2-CB 3.97Å; L158-D162 WeakPolarHBondContact O-CB 3.33Å; L158-D162 PolarHBondContact O-N 3.32Å; T159-D162 PolarHBondContact O-N 2.86Å; D162-I165 PolarHBondContact O-N 3.43Å; D162-S166 WeakPolarHBondContact O-CB 3.34Å; D162-S166 PolarHBondContact O-N 3.42Å; D162-Y173 VanDerWaalsContact OD1-CE2 3.27Å; D162-Y173 WeakPolarHBondContact OD1-CE2 3.32Å; D162-Y173 PolarHBondContact OD1-OH 3.05Å
163	R	91.1	Very high	91.6	Very high	103 Å²	103	47.5 Å²	47.5	39%	0.389	23%	0.234	S	C	.	.	H	α-helix	trans	-64.3	-43.4	177.3	-64.7	-56.8	179.4	-168.5	-2.1	112.1	T159 A160 I161 I165 S166 I167 I246	T159-R163 VanDerWaalsContact O-CG 3.31Å; T159-R163 WeakPolarHBondContact O-CG 3.16Å; T159-R163 PolarHBondContact O-N 3.49Å; A160-R163 PolarHBondContact O-N 3.1Å; I161-R163 VanDerWaalsContact C-N 3.31Å; I161-R163 PolarHBondContact O-N 3Å; R163-I165 PolarHBondContact O-N 3.44Å; R163-S166 PolarHBondContact O-N 2.84Å; R163-S166 PolarHBondContact O-OG 3.36Å; R163-I167 PolarHBondContact O-N 3.47Å; R163-I246 HydrophobicContact CB-CD1 3.74Å
164	Y	90.8	Very high	91.1	Very high	52 Å²	52	56.3 Å²	56.3	20%	0.204	27%	0.272	C	S	.	.	H	α-helix	trans	-57.9	-48.9	177.3	176.6	-93	0	0	0	111.2	A160 I161 S166 I167 H168 A242 Y245	A160-Y164 VanDerWaalsContact O-CB 3.23Å; A160-Y164 WeakPolarHBondContact O-CB 3.21Å; A160-Y164 PolarHBondContact O-N 2.98Å; I161-Y164 WeakPolarHBondContact O-CB 3.46Å; I161-Y164 PolarHBondContact O-N 2.93Å; Y164-S166 PolarHBondContact O-N 3.45Å; Y164-I167 PolarHBondContact O-N 3.09Å; Y164-H168 HydrophobicContact CD1-CB 4.46Å; Y164-H168 HydrophobicContact CE1-CB 4.17Å; Y164-H168 WeakPolarHBondContact O-CB 3.33Å; Y164-H168 PolarHBondContact O-N 2.88Å; Y164-A242 HydrophobicContact CD2-CB 4.45Å; Y164-Y245 AromaticContact CD2-CD1 3.71Å; Y164-Y245 HydrophobicContact CD2-CD1 3.71Å; Y164-Y245 HydrophobicContact CD2-CE1 4.24Å; Y164-Y245 HydrophobicContact CD2-CG 4.38Å; Y164-Y245 AromaticContact CE2-CD1 3.34Å; Y164-Y245 HydrophobicContact CE2-CD1 3.34Å; Y164-Y245 AromaticContact CE2-CE1 3.64Å; Y164-Y245 HydrophobicContact CE2-CE1 3.64Å; Y164-Y245 AromaticContact CE2-CG 3.85Å; Y164-Y245 HydrophobicContact CE2-CG 3.85Å
165	I	91.4	Very high	90.8	Very high	34 Å²	34	65.4 Å²	65.4	17%	0.174	31%	0.305	C	S	.	.	H	α-helix	trans	-64	-41.8	178.7	-62.3	167.5	0	0	0	110.7	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 3.21Å; I161-I165 PolarHBondContact O-N 3.1Å; D162-I165 PolarHBondContact O-N 3.43Å; R163-I165 PolarHBondContact O-N 3.44Å; I165-I167 PolarHBondContact O-N 2.81Å; I165-H168 PolarHBondContact O-N 3.39Å; I165-R169 CarbonylContact O-C 3.54Å; I165-R169 PolarHBondContact O-N 3.02Å; I165-Y173 HydrophobicContact CB-CD2 4.47Å; I165-Y173 HydrophobicContact CG2-CD2 4.09Å; I165-I176 HydrophobicContact CD1-CG2 4.21Å; I165-I176 HydrophobicContact CG2-CB 4.29Å; I165-I176 HydrophobicContact CG2-CD1 4Å; I165-I176 HydrophobicContact CG2-CG2 4.03Å; I165-V177 HydrophobicContact CD1-CG2 4.25Å; I165-V177 HydrophobicContact CG2-CG2 4.27Å
166	S	87.9	Confident	90.5	Very high	29 Å²	29	68.4 Å²	68.4	20%	0.203	32%	0.32	C	S	.	.	H	α-helix	trans	-59.5	-33.8	-179	77.3	0	0	0	0	113.1	D162 R163 Y164 P170 Y173	D162-S166 WeakPolarHBondContact O-CB 3.34Å; D162-S166 PolarHBondContact O-N 3.42Å; R163-S166 PolarHBondContact O-N 2.84Å; R163-S166 PolarHBondContact O-OG 3.36Å; Y164-S166 PolarHBondContact O-N 3.45Å; S166-P170 WeakPolarHBondContact O-CA 3.47Å; S166-Y173 VanDerWaalsContact CA-CD2 3.42Å
167	I	85.4	Confident	90.3	Very high	63 Å²	63	67.6 Å²	67.6	32%	0.323	32%	0.317	S	S	.	.	H	α-helix	trans	-95.3	-36	-177.5	-67.1	175.3	0	0	0	111.6	R163 Y164 I165 I246 K249	R163-I167 PolarHBondContact O-N 3.47Å; Y164-I167 PolarHBondContact O-N 3.09Å; I165-I167 PolarHBondContact O-N 2.81Å; I167-I246 HydrophobicContact CD1-CB 4.24Å; I167-I246 HydrophobicContact CD1-CG1 4.06Å; I167-I246 HydrophobicContact CD1-CG2 3.33Å; I167-K249 HydrophobicContact CG2-CB 4.2Å; I167-K249 HydrophobicContact CG2-CG 3.96Å
168	H	85.7	Confident	90.1	Very high	58 Å²	58	67.5 Å²	67.5	27%	0.269	32%	0.32	S	S	.	.	H	α-helix	trans	-72.7	-37.7	178.7	-174	68.9	0	0	0	112.1	Y164 I165 Y245	Y164-H168 HydrophobicContact CD1-CB 4.46Å; Y164-H168 HydrophobicContact CE1-CB 4.17Å; Y164-H168 WeakPolarHBondContact O-CB 3.33Å; Y164-H168 PolarHBondContact O-N 2.88Å; I165-H168 PolarHBondContact O-N 3.39Å; H168-Y245 HydrophobicContact CB-CE1 4.35Å; H168-Y245 PolarHBondContact CE1-OH 3.41Å; H168-Y245 AromaticContact ND1-CE1 3.88Å; H168-Y245 AromaticContact ND1-CZ 3.7Å; H168-Y245 PolarHBondContact ND1-OH 2.95Å
169	R	87.1	Confident	89.7	Confident	146 Å²	146	71.8 Å²	71.8	55%	0.551	34%	0.335	S	S	*	.	S	Bend	trans	-134.1	65.2	-177	-57.7	-66.4	177.6	159.6	2.8	111.9	I165 L171 A172 Y173 I176	I165-R169 CarbonylContact O-C 3.54Å; I165-R169 PolarHBondContact O-N 3.02Å; R169-L171 VanDerWaalsContact C-N 3.34Å; R169-L171 PolarHBondContact O-N 2.96Å; R169-A172 HydrophobicContact CB-CB 4.23Å; R169-A172 PolarHBondContact O-N 3.24Å; R169-A172 VanDerWaalsContact O-N 3.08Å; R169-Y173 PolarHBondContact O-N 2.77Å; R169-I176 HydrophobicContact CB-CD1 4.41Å
170	P	85.2	Confident	89.6	Confident	88 Å²	88	75.3 Å²	75.3	57%	0.571	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-39.9	-172.7	22.7	-33.9	0	0	0	113.6	S166 A172	S166-P170 WeakPolarHBondContact O-CA 3.47Å; P170-A172 VanDerWaalsContact C-N 3.34Å; P170-A172 PolarHBondContact O-N 2.84Å
171	L	88.8	Confident	89.5	Confident	179 Å²	179	81.4 Å²	81.4	94%	0.937	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-28.9	179.9	-59.4	178.7	0	0	0	113.2	R169	R169-L171 VanDerWaalsContact C-N 3.34Å; R169-L171 PolarHBondContact O-N 2.96Å
172	A	89.7	Confident	89.3	Confident	22 Å²	22	79.3 Å²	79.3	18%	0.182	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-11.6	-179.2	0	0	0	0	0	112.9	R169 P170 K174 R175 I176	R169-A172 HydrophobicContact CB-CB 4.23Å; R169-A172 PolarHBondContact O-N 3.24Å; R169-A172 VanDerWaalsContact O-N 3.08Å; P170-A172 VanDerWaalsContact C-N 3.34Å; P170-A172 PolarHBondContact O-N 2.84Å; A172-K174 PolarHBondContact O-N 3.14Å; A172-R175 WeakPolarHBondContact O-CA 3.41Å; A172-R175 WeakPolarHBondContact O-CB 3.38Å; A172-R175 PolarHBondContact O-N 2.93Å; A172-I176 HydrophobicContact CB-CD1 3.66Å; A172-I176 HydrophobicContact CB-CG1 4.23Å; A172-I176 WeakPolarHBondContact O-CG1 3.18Å; A172-I176 PolarHBondContact O-N 2.94Å
173	Y	90.4	Very high	89.2	Confident	45 Å²	45	81.9 Å²	81.9	18%	0.176	39%	0.39	C	S	.	.	H	α-helix	trans	-50.6	-51.4	-175	174.1	-103.6	0	0	0	112.8	S101 D162 I165 S166 R169 R175 I176 V177	S101-Y173 PolarHBondContact OG-OH 3.26Å; S101-Y173 VanDerWaalsContact OG-OH 3.09Å; D162-Y173 VanDerWaalsContact OD1-CE2 3.27Å; D162-Y173 WeakPolarHBondContact OD1-CE2 3.32Å; D162-Y173 PolarHBondContact OD1-OH 3.05Å; I165-Y173 HydrophobicContact CB-CD2 4.47Å; I165-Y173 HydrophobicContact CG2-CD2 4.09Å; S166-Y173 VanDerWaalsContact CA-CD2 3.42Å; R169-Y173 PolarHBondContact O-N 2.77Å; Y173-R175 PolarHBondContact O-N 3.17Å; Y173-R175 VanDerWaalsContact O-N 3.14Å; Y173-I176 PolarHBondContact O-N 2.87Å; Y173-I176 VanDerWaalsContact O-N 3.12Å; Y173-V177 HydrophobicContact CD2-CB 4.3Å; Y173-V177 HydrophobicContact CD2-CG2 3.88Å; Y173-V177 HydrophobicContact CE2-CB 3.86Å; Y173-V177 HydrophobicContact CE2-CG1 4.38Å; Y173-V177 HydrophobicContact CE2-CG2 3.6Å; Y173-V177 PolarHBondContact O-N 2.92Å
174	K	87.3	Confident	89.3	Confident	185 Å²	185	81.8 Å²	81.8	80%	0.804	40%	0.401	S	S	*	.	H	α-helix	trans	-60.9	-24.9	180	-69.6	-172.5	178.6	-179.6	0	113.9	A172	A172-K174 PolarHBondContact O-N 3.14Å
175	R	90.1	Very high	89.4	Confident	196 Å²	196	81 Å²	81	74%	0.74	41%	0.405	S	S	*	.	H	α-helix	trans	-87.2	-35.5	177.3	-173.5	-177.6	68.4	-171.6	2.1	111.9	A172 Y173	A172-R175 WeakPolarHBondContact O-CA 3.41Å; A172-R175 WeakPolarHBondContact O-CB 3.38Å; A172-R175 PolarHBondContact O-N 2.93Å; Y173-R175 PolarHBondContact O-N 3.17Å; Y173-R175 VanDerWaalsContact O-N 3.14Å
176	I	89.2	Confident	89.4	Confident	63 Å²	63	82.1 Å²	82.1	32%	0.323	41%	0.409	S	S	.	.	H	α-helix	trans	-76.5	-54	-177.7	-64.6	165.9	0	0	0	110	I165 R169 A172 Y173 T178 K181	I165-I176 HydrophobicContact CD1-CG2 4.21Å; I165-I176 HydrophobicContact CG2-CB 4.29Å; I165-I176 HydrophobicContact CG2-CD1 4Å; I165-I176 HydrophobicContact CG2-CG2 4.03Å; R169-I176 HydrophobicContact CB-CD1 4.41Å; A172-I176 HydrophobicContact CB-CD1 3.66Å; A172-I176 HydrophobicContact CB-CG1 4.23Å; A172-I176 WeakPolarHBondContact O-CG1 3.18Å; A172-I176 PolarHBondContact O-N 2.94Å; Y173-I176 PolarHBondContact O-N 2.87Å; Y173-I176 VanDerWaalsContact O-N 3.12Å; I176-T178 PolarHBondContact O-N 3.01Å; I176-K181 WeakPolarHBondContact O-CD 3.48Å
177	V	90.3	Very high	89.7	Confident	19 Å²	19	83.5 Å²	83.5	12%	0.115	42%	0.418	C	S	.	.	S	Bend	trans	-95.1	102.1	-175.8	-173.7	0	0	0	0	109.1	P100 I165 Y173	P100-V177 HydrophobicContact CB-CG1 3.86Å; P100-V177 HydrophobicContact CG-CG1 3.79Å; I165-V177 HydrophobicContact CD1-CG2 4.25Å; I165-V177 HydrophobicContact CG2-CG2 4.27Å; Y173-V177 HydrophobicContact CD2-CB 4.3Å; Y173-V177 HydrophobicContact CD2-CG2 3.88Å; Y173-V177 HydrophobicContact CE2-CB 3.86Å; Y173-V177 HydrophobicContact CE2-CG1 4.38Å; Y173-V177 HydrophobicContact CE2-CG2 3.6Å; Y173-V177 PolarHBondContact O-N 2.92Å
178	T	90.7	Very high	90.2	Very high	46 Å²	46	85.5 Å²	85.5	28%	0.282	43%	0.428	S	S	.	.			trans	-118.5	157.1	177.6	59.6	0	0	0	0	109.7	I176 K181 A182	I176-T178 PolarHBondContact O-N 3.01Å; T178-K181 PolarHBondContact O-N 3.01Å; T178-K181 WeakPolarHBondContact OG1-CG 3.44Å; T178-A182 WeakPolarHBondContact O-CB 3.17Å; T178-A182 PolarHBondContact O-N 3.41Å
179	R	88.6	Confident	90.7	Very high	110 Å²	110	83.8 Å²	83.8	42%	0.415	42%	0.421	S	S	.	.	H	α-helix	trans	-56.2	-46.7	-178.7	-61.5	177.7	74.4	-155.6	-1.7	113.3	R97 C98 K181 A182 V183	R97-R179 PolarHBondContact O-NE 3.32Å; R97-R179 PolarHBondContact O-NH2 3.29Å; R97-R179 VanDerWaalsContact O-NH2 3.16Å; C98-R179 VanDerWaalsContact O-CD 3.29Å; C98-R179 WeakPolarHBondContact O-CD 3.5Å; R179-K181 VanDerWaalsContact C-N 3.34Å; R179-K181 PolarHBondContact O-N 3.4Å; R179-A182 PolarHBondContact O-N 3.06Å; R179-V183 WeakPolarHBondContact O-CG2 3.39Å; R179-V183 PolarHBondContact O-N 3.27Å
180	P	90.4	Very high	91.2	Very high	93 Å²	93	78.6 Å²	78.6	60%	0.604	40%	0.401	S	S	*	.	H	α-helix	trans	-61	-43.1	179.6	-23	34.6	0	0	0	112.3	A182 V183 V184	P180-A182 PolarHBondContact O-N 3.45Å; P180-V183 PolarHBondContact O-N 3.26Å; P180-V184 WeakPolarHBondContact O-CG2 3.34Å; P180-V184 PolarHBondContact O-N 3.4Å
181	K	92.3	Very high	91.8	Very high	128 Å²	128	78.3 Å²	78.3	56%	0.557	40%	0.398	S	S	*	.	H	α-helix	trans	-64.5	-39.7	177.1	-68.7	-176.4	179.4	179.7	0	112.3	I176 T178 R179 V184 A185	I176-K181 WeakPolarHBondContact O-CD 3.48Å; T178-K181 PolarHBondContact O-N 3.01Å; T178-K181 WeakPolarHBondContact OG1-CG 3.44Å; R179-K181 VanDerWaalsContact C-N 3.34Å; R179-K181 PolarHBondContact O-N 3.4Å; K181-V184 PolarHBondContact O-N 2.82Å; K181-A185 WeakPolarHBondContact O-CB 3.37Å; K181-A185 PolarHBondContact O-N 2.48Å
182	A	90.1	Very high	92.1	Very high	3 Å²	3	73.9 Å²	73.9	3%	0.025	37%	0.374	C	S	.	.	H	α-helix	trans	-63.6	-43.1	176.3	0	0	0	0	0	111.5	P100 F104 T178 R179 P180 A185 F186	P100-A182 HydrophobicContact CB-CB 3.89Å; F104-A182 HydrophobicContact CE1-CB 4.16Å; F104-A182 HydrophobicContact CE2-CB 4.42Å; F104-A182 HydrophobicContact CZ-CB 3.72Å; T178-A182 WeakPolarHBondContact O-CB 3.17Å; T178-A182 PolarHBondContact O-N 3.41Å; R179-A182 PolarHBondContact O-N 3.06Å; P180-A182 PolarHBondContact O-N 3.45Å; A182-A185 PolarHBondContact O-N 2.83Å; A182-F186 VanDerWaalsContact O-CB 3.3Å; A182-F186 WeakPolarHBondContact O-CB 3.41Å; A182-F186 PolarHBondContact O-N 3.4Å
183	V	90.6	Very high	92.5	Very high	58 Å²	58	72.9 Å²	72.9	35%	0.352	37%	0.366	S	S	.	.	H	α-helix	trans	-63.3	-45.6	175.9	173	0	0	0	0	111	R179 P180 A185 F186 C187	R179-V183 WeakPolarHBondContact O-CG2 3.39Å; R179-V183 PolarHBondContact O-N 3.27Å; P180-V183 PolarHBondContact O-N 3.26Å; V183-A185 PolarHBondContact O-N 3.17Å; V183-F186 PolarHBondContact O-N 3.13Å; V183-C187 WeakPolarHBondContact O-CB 3.36Å; V183-C187 PolarHBondContact O-N 3.13Å; V183-C187 PolarHBondContact O-SG 2.92Å
184	V	94.2	Very high	92.7	Very high	101 Å²	101	74.7 Å²	74.7	61%	0.612	38%	0.378	S	S	*	.	H	α-helix	trans	-60	-46.4	176.6	171	0	0	0	0	111.3	P180 K181 F186 C187 L188	P180-V184 WeakPolarHBondContact O-CG2 3.34Å; P180-V184 PolarHBondContact O-N 3.4Å; K181-V184 PolarHBondContact O-N 2.82Å; V184-F186 PolarHBondContact O-N 2.48Å; V184-C187 PolarHBondContact O-N 2.9Å; V184-L188 WeakPolarHBondContact O-CB 3.36Å; V184-L188 PolarHBondContact O-N 3.38Å
185	A	92.8	Very high	93.2	Very high	35 Å²	35	69.6 Å²	69.6	29%	0.289	36%	0.362	S	S	.	.	H	α-helix	trans	-62.1	-42.9	178.5	0	0	0	0	0	112.2	L158 K181 A182 V183 M189	L158-A185 HydrophobicContact CD2-CB 4.22Å; K181-A185 WeakPolarHBondContact O-CB 3.37Å; K181-A185 PolarHBondContact O-N 2.48Å; A182-A185 PolarHBondContact O-N 2.83Å; V183-A185 PolarHBondContact O-N 3.17Å; A185-M189 WeakPolarHBondContact O-CB 3.27Å; A185-M189 PolarHBondContact O-N 2.99Å
186	F	90.7	Very high	93.4	Very high	57 Å²	57	61.1 Å²	61.1	25%	0.25	33%	0.331	C	S	.	.	H	α-helix	trans	-59.8	-52.8	173.9	152.1	-100.3	0	0	0	111.7	S107 A182 V183 V184 L188 M189 W190	S107-F186 VanDerWaalsContact CB-CD2 3.43Å; S107-F186 VanDerWaalsContact OG-CD2 3.23Å; S107-F186 WeakPolarHBondContact OG-CD2 3.45Å; S107-F186 WeakPolarHBondContact OG-CE2 3.2Å; A182-F186 VanDerWaalsContact O-CB 3.3Å; A182-F186 WeakPolarHBondContact O-CB 3.41Å; A182-F186 PolarHBondContact O-N 3.4Å; V183-F186 PolarHBondContact O-N 3.13Å; V184-F186 PolarHBondContact O-N 2.48Å; F186-L188 VanDerWaalsContact C-N 3.33Å; F186-L188 PolarHBondContact O-N 3.26Å; F186-M189 PolarHBondContact O-N 3.36Å; F186-W190 AromaticContact CD2-CD1 3.36Å; F186-W190 AromaticContact CD2-NE1 3.44Å; F186-W190 AromaticContact CE2-CD1 3.21Å; F186-W190 AromaticContact CE2-CE2 3.92Å; F186-W190 HydrophobicContact CE2-CG 4.19Å; F186-W190 AromaticContact CE2-NE1 3.02Å; F186-W190 AromaticContact CZ-CD1 3.95Å; F186-W190 AromaticContact CZ-NE1 3.97Å; F186-W190 VanDerWaalsContact O-CD1 3.3Å; F186-W190 PolarHBondContact O-N 3.23Å
187	C	94.5	Very high	93.6	Very high	58 Å²	58	58.2 Å²	58.2	39%	0.392	32%	0.317	S	S	.	.	H	α-helix	trans	-61.6	-40.7	-179	-69.4	0	0	0	0	112.3	V183 V184 W190 T191	V183-C187 WeakPolarHBondContact O-CB 3.36Å; V183-C187 PolarHBondContact O-N 3.13Å; V183-C187 PolarHBondContact O-SG 2.92Å; V184-C187 PolarHBondContact O-N 2.9Å; C187-W190 PolarHBondContact O-N 2.95Å; C187-T191 WeakPolarHBondContact O-CB 3.35Å; C187-T191 PolarHBondContact O-N 2.86Å; C187-T191 PolarHBondContact O-OG1 2.99Å
188	L	96.2	Very high	93.8	Very high	105 Å²	105	59.6 Å²	59.6	55%	0.55	33%	0.325	S	S	.	.	H	α-helix	trans	-63	-45.9	176.9	-178.3	63.8	0	0	0	111.2	V184 F186 W190 T191 I192	V184-L188 WeakPolarHBondContact O-CB 3.36Å; V184-L188 PolarHBondContact O-N 3.38Å; F186-L188 VanDerWaalsContact C-N 3.33Å; F186-L188 PolarHBondContact O-N 3.26Å; L188-W190 PolarHBondContact O-N 3.31Å; L188-T191 PolarHBondContact O-N 3.48Å; L188-I192 HydrophobicContact CD1-CD1 4.15Å; L188-I192 HydrophobicContact CD1-CG1 4.48Å; L188-I192 HydrophobicContact CG-CD1 3.9Å; L188-I192 VanDerWaalsContact O-CG1 3.29Å; L188-I192 WeakPolarHBondContact O-CG1 3.33Å; L188-I192 PolarHBondContact O-N 3.26Å
189	M	96.3	Very high	94	Very high	23 Å²	23	59.4 Å²	59.4	11%	0.113	32%	0.322	C	S	.	.	H	α-helix	trans	-60	-45.6	178.2	-178.8	-77.5	-68.8	0	0	111.6	A151 S155 L158 A185 F186 T191 I192 A193	A151-M189 HydrophobicContact CB-SD 4.34Å; A151-M189 WeakPolarHBondContact O-CE 3.49Å; S155-M189 VanDerWaalsContact OG-CE 3.27Å; S155-M189 WeakPolarHBondContact OG-CE 3.17Å; L158-M189 HydrophobicContact CD1-CB 4.02Å; L158-M189 HydrophobicContact CD1-CE 4.33Å; L158-M189 HydrophobicContact CD1-CG 4.22Å; A185-M189 WeakPolarHBondContact O-CB 3.27Å; A185-M189 PolarHBondContact O-N 2.99Å; F186-M189 PolarHBondContact O-N 3.36Å; M189-T191 VanDerWaalsContact C-N 3.34Å; M189-T191 PolarHBondContact O-N 2.89Å; M189-I192 PolarHBondContact O-N 2.91Å; M189-A193 WeakPolarHBondContact O-CB 3.21Å; M189-A193 PolarHBondContact O-N 3.49Å
190	W	96.8	Very high	94.1	Very high	37 Å²	37	54.4 Å²	54.4	14%	0.14	30%	0.304	C	S	.	.	H	α-helix	trans	-61.3	-42.9	175.8	-87.6	81.7	0	0	0	112.7	S107 V110 A111 L114 A151 F186 C187 L188 I192 A193 I194	S107-W190 PolarHBondContact OG-NE1 3.45Å; V110-W190 HydrophobicContact CB-CZ2 4.32Å; V110-W190 HydrophobicContact CG1-CH2 3.9Å; V110-W190 HydrophobicContact CG1-CZ2 4.06Å; A111-W190 HydrophobicContact CB-CH2 4Å; A111-W190 HydrophobicContact CB-CZ2 3.91Å; L114-W190 HydrophobicContact CD1-CH2 3.9Å; L114-W190 HydrophobicContact CD1-CZ3 3.98Å; A151-W190 HydrophobicContact CB-CD2 4.2Å; A151-W190 HydrophobicContact CB-CE3 4.24Å; A151-W190 HydrophobicContact CB-CH2 4.16Å; A151-W190 HydrophobicContact CB-CZ2 4.11Å; A151-W190 HydrophobicContact CB-CZ3 4.22Å; F186-W190 AromaticContact CD2-CD1 3.36Å; F186-W190 AromaticContact CD2-NE1 3.44Å; F186-W190 AromaticContact CE2-CD1 3.21Å; F186-W190 AromaticContact CE2-CE2 3.92Å; F186-W190 HydrophobicContact CE2-CG 4.19Å; F186-W190 AromaticContact CE2-NE1 3.02Å; F186-W190 AromaticContact CZ-CD1 3.95Å; F186-W190 AromaticContact CZ-NE1 3.97Å; F186-W190 VanDerWaalsContact O-CD1 3.3Å; F186-W190 PolarHBondContact O-N 3.23Å; C187-W190 PolarHBondContact O-N 2.95Å; L188-W190 PolarHBondContact O-N 3.31Å; W190-I192 VanDerWaalsContact C-N 3.32Å; W190-I192 PolarHBondContact O-N 2.89Å; W190-A193 PolarHBondContact O-N 3.48Å; W190-I194 HydrophobicContact CE3-CD1 4.43Å; W190-I194 VanDerWaalsContact O-CG1 3.3Å; W190-I194 WeakPolarHBondContact O-CG1 3.4Å; W190-I194 PolarHBondContact O-N 3.26Å
191	T	97.4	Very high	94.1	Very high	81 Å²	81	52.6 Å²	52.6	50%	0.497	29%	0.289	S	S	.	.	H	α-helix	trans	-60.4	-45.7	177.9	-54	0	0	0	0	110.4	C187 L188 M189 I194 V195	C187-T191 WeakPolarHBondContact O-CB 3.35Å; C187-T191 PolarHBondContact O-N 2.86Å; C187-T191 PolarHBondContact O-OG1 2.99Å; L188-T191 PolarHBondContact O-N 3.48Å; M189-T191 VanDerWaalsContact C-N 3.34Å; M189-T191 PolarHBondContact O-N 2.89Å; T191-I194 PolarHBondContact O-N 2.73Å; T191-V195 HydrophobicContact CG2-CG2 4.46Å; T191-V195 WeakPolarHBondContact O-CB 3.4Å; T191-V195 WeakPolarHBondContact O-CG2 3.42Å; T191-V195 PolarHBondContact O-N 2.83Å
192	I	96.3	Very high	94.1	Very high	86 Å²	86	52.6 Å²	52.6	44%	0.441	30%	0.295	S	S	.	.	H	α-helix	trans	-62.7	-45.2	177.2	-66.8	164.9	0	0	0	110.9	L188 M189 W190 I194 V195 I196	L188-I192 HydrophobicContact CD1-CD1 4.15Å; L188-I192 HydrophobicContact CD1-CG1 4.48Å; L188-I192 HydrophobicContact CG-CD1 3.9Å; L188-I192 VanDerWaalsContact O-CG1 3.29Å; L188-I192 WeakPolarHBondContact O-CG1 3.33Å; L188-I192 PolarHBondContact O-N 3.26Å; M189-I192 PolarHBondContact O-N 2.91Å; W190-I192 VanDerWaalsContact C-N 3.32Å; W190-I192 PolarHBondContact O-N 2.89Å; I192-I194 PolarHBondContact O-N 3.01Å; I192-V195 PolarHBondContact O-N 3.26Å; I192-I196 HydrophobicContact CG2-CD1 3.73Å; I192-I196 HydrophobicContact CG2-CG1 4.37Å; I192-I196 WeakPolarHBondContact O-CG1 3.32Å; I192-I196 PolarHBondContact O-N 3.23Å
193	A	96.6	Very high	94	Very high	1 Å²	1	53 Å²	53	1%	0.008	30%	0.299	C	S	.	.	H	α-helix	trans	-59.7	-46.2	179.2	0	0	0	0	0	112	T150 A151 M189 W190 A197	T150-A193 HydrophobicContact CG2-CB 3.74Å; A151-A193 HydrophobicContact CB-CB 4.1Å; M189-A193 WeakPolarHBondContact O-CB 3.21Å; M189-A193 PolarHBondContact O-N 3.49Å; W190-A193 PolarHBondContact O-N 3.48Å; A193-A197 WeakPolarHBondContact O-CB 3.44Å; A193-A197 PolarHBondContact O-N 3.48Å
194	I	96.1	Very high	94	Very high	83 Å²	83	54.3 Å²	54.3	43%	0.426	30%	0.297	S	S	.	.	H	α-helix	trans	-64.1	-47.2	177.2	-66.8	166	0	0	0	110.3	W190 T191 I192 I196 A197 V198	W190-I194 HydrophobicContact CE3-CD1 4.43Å; W190-I194 VanDerWaalsContact O-CG1 3.3Å; W190-I194 WeakPolarHBondContact O-CG1 3.4Å; W190-I194 PolarHBondContact O-N 3.26Å; T191-I194 PolarHBondContact O-N 2.73Å; I192-I194 PolarHBondContact O-N 3.01Å; I194-I196 VanDerWaalsContact C-N 3.35Å; I194-I196 PolarHBondContact O-N 3.35Å; I194-A197 PolarHBondContact O-N 3.42Å; I194-V198 HydrophobicContact CG2-CG1 4.28Å; I194-V198 WeakPolarHBondContact O-CG1 3.33Å; I194-V198 WeakPolarHBondContact O-CG2 3.43Å; I194-V198 PolarHBondContact O-N 3.41Å
195	V	96.3	Very high	93.8	Very high	79 Å²	79	50.4 Å²	50.4	48%	0.479	27%	0.273	S	S	.	.	H	α-helix	trans	-57	-49.2	179.8	167	0	0	0	0	110.7	T191 I192 A197 V198 L199	T191-V195 HydrophobicContact CG2-CG2 4.46Å; T191-V195 WeakPolarHBondContact O-CB 3.4Å; T191-V195 WeakPolarHBondContact O-CG2 3.42Å; T191-V195 PolarHBondContact O-N 2.83Å; I192-V195 PolarHBondContact O-N 3.26Å; V195-A197 VanDerWaalsContact C-N 3.33Å; V195-A197 PolarHBondContact O-N 3.43Å; V195-V198 WeakPolarHBondContact O-CG2 3.39Å; V195-V198 PolarHBondContact O-N 2.98Å; V195-L199 WeakPolarHBondContact O-CG 3.45Å; V195-L199 PolarHBondContact O-N 2.96Å
196	I	94.7	Very high	93.5	Very high	17 Å²	17	48.9 Å²	48.9	9%	0.087	26%	0.26	C	S	.	.	H	α-helix	trans	-58	-47.5	177.9	-69.8	170.7	0	0	0	110.4	I192 I194 V198 L199 Y224 F227	I192-I196 HydrophobicContact CG2-CD1 3.73Å; I192-I196 HydrophobicContact CG2-CG1 4.37Å; I192-I196 WeakPolarHBondContact O-CG1 3.32Å; I192-I196 PolarHBondContact O-N 3.23Å; I194-I196 VanDerWaalsContact C-N 3.35Å; I194-I196 PolarHBondContact O-N 3.35Å; I196-V198 VanDerWaalsContact C-N 3.34Å; I196-V198 PolarHBondContact O-N 2.94Å; I196-L199 WeakPolarHBondContact O-CB 3.49Å; I196-L199 WeakPolarHBondContact O-CG 3.28Å; I196-L199 PolarHBondContact O-N 3.48Å; I196-Y224 WeakPolarHBondContact O-CE2 3.25Å; I196-Y224 PolarHBondContact O-OH 3.41Å; I196-F227 HydrophobicContact CD1-CE1 4.48Å; I196-F227 HydrophobicContact CG1-CE1 4.23Å; I196-F227 HydrophobicContact CG2-CE1 4.1Å
197	A	94.6	Very high	93.3	Very high	2 Å²	2	52.8 Å²	52.8	2%	0.017	28%	0.277	C	S	.	.	H	α-helix	trans	-69.2	-27.2	-174.3	0	0	0	0	0	114.5	G143 T146 A147 A193 I194 V195 P200	G143-A197 WeakPolarHBondContact O-CB 3.4Å; T146-A197 HydrophobicContact CG2-CB 4.12Å; A147-A197 HydrophobicContact CB-CB 3.59Å; A193-A197 WeakPolarHBondContact O-CB 3.44Å; A193-A197 PolarHBondContact O-N 3.48Å; I194-A197 PolarHBondContact O-N 3.42Å; V195-A197 VanDerWaalsContact C-N 3.33Å; V195-A197 PolarHBondContact O-N 3.43Å; A197-P200 WeakPolarHBondContact O-CD 3Å
198	V	94.2	Very high	92.9	Very high	49 Å²	49	57 Å²	57	30%	0.297	29%	0.289	S	S	.	.	H	α-helix	trans	-88.3	-5	177.9	-57.8	0	0	0	0	113.7	I194 V195 I196 L201 L202	I194-V198 HydrophobicContact CG2-CG1 4.28Å; I194-V198 WeakPolarHBondContact O-CG1 3.33Å; I194-V198 WeakPolarHBondContact O-CG2 3.43Å; I194-V198 PolarHBondContact O-N 3.41Å; V195-V198 WeakPolarHBondContact O-CG2 3.39Å; V195-V198 PolarHBondContact O-N 2.98Å; I196-V198 VanDerWaalsContact C-N 3.34Å; I196-V198 PolarHBondContact O-N 2.94Å; V198-L201 HydrophobicContact CB-CD1 4.49Å; V198-L201 HydrophobicContact CG1-CD1 4.5Å; V198-L201 WeakPolarHBondContact O-CB 3.4Å; V198-L201 PolarHBondContact O-N 2.95Å; V198-L201 VanDerWaalsContact O-N 3.1Å; V198-L202 HydrophobicContact CG2-CD1 4.1Å; V198-L202 WeakPolarHBondContact O-CG 3.39Å; V198-L202 PolarHBondContact O-N 3.05Å; V198-L202 VanDerWaalsContact O-N 3.09Å
199	L	94.1	Very high	92.5	Very high	42 Å²	42	56.1 Å²	56.1	22%	0.22	28%	0.284	C	S	.	.	H	α-helix	trans	-55.1	-42.2	179.6	-67	173.5	0	0	0	113.7	V195 I196 L201 L202 G203 W204 Y224	V195-L199 WeakPolarHBondContact O-CG 3.45Å; V195-L199 PolarHBondContact O-N 2.96Å; I196-L199 WeakPolarHBondContact O-CB 3.49Å; I196-L199 WeakPolarHBondContact O-CG 3.28Å; I196-L199 PolarHBondContact O-N 3.48Å; L199-L201 VanDerWaalsContact C-N 3.29Å; L199-L201 PolarHBondContact O-N 2.98Å; L199-L202 PolarHBondContact O-N 2.94Å; L199-G203 PolarHBondContact O-N 3.46Å; L199-G203 VanDerWaalsContact O-N 3.09Å; L199-W204 HydrophobicContact CB-CB 4.31Å; L199-W204 HydrophobicContact CB-CE3 4.28Å; L199-W204 HydrophobicContact CD1-CE3 3.91Å; L199-W204 HydrophobicContact CD1-CZ3 4.02Å; L199-W204 PolarHBondContact O-N 3.46Å; L199-Y224 HydrophobicContact CB-CD2 4.37Å; L199-Y224 HydrophobicContact CB-CE2 4.1Å; L199-Y224 HydrophobicContact CD1-CE2 4.47Å
200	P	91.4	Very high	92	Very high	5 Å²	5	63.9 Å²	63.9	3%	0.032	32%	0.32	C	S	.	.	H	α-helix	trans	-63.4	-34.5	177.8	-23.9	36.3	0	0	0	113.1	L139 A197 G203 W204 N205 I220 Y224	L139-P200 HydrophobicContact CD2-CB 4.2Å; A197-P200 WeakPolarHBondContact O-CD 3Å; P200-G203 PolarHBondContact O-N 3.37Å; P200-W204 WeakPolarHBondContact CA-O 3.09Å; P200-N205 PolarHBondContact O-ND2 3.2Å; P200-I220 HydrophobicContact CB-CD1 3.92Å; P200-I220 HydrophobicContact CG-CD1 3.98Å; P200-Y224 HydrophobicContact CG-CD1 4.01Å; P200-Y224 HydrophobicContact CG-CD2 4Å; P200-Y224 HydrophobicContact CG-CE1 3.66Å; P200-Y224 HydrophobicContact CG-CE2 3.66Å; P200-Y224 HydrophobicContact CG-CG 4.15Å; P200-Y224 VanDerWaalsContact CG-CZ 3.46Å
201	L	90.4	Very high	91.5	Very high	54 Å²	54	64.3 Å²	64.3	28%	0.283	33%	0.329	S	S	.	.	H	α-helix	trans	-67.1	-39	174.4	-76.8	165.4	0	0	0	112.3	N136 L139 F140 V198 L199 G203	N136-L201 WeakPolarHBondContact O-CD2 3.27Å; L139-L201 HydrophobicContact CB-CD2 3.49Å; L139-L201 VanDerWaalsContact CB-CD2 3.49Å; L139-L201 HydrophobicContact CB-CG 3.94Å; F140-L201 HydrophobicContact CB-CD1 4.3Å; F140-L201 HydrophobicContact CB-CD2 4.34Å; F140-L201 HydrophobicContact CD2-CD1 4.14Å; V198-L201 HydrophobicContact CB-CD1 4.49Å; V198-L201 HydrophobicContact CG1-CD1 4.5Å; V198-L201 WeakPolarHBondContact O-CB 3.4Å; V198-L201 PolarHBondContact O-N 2.95Å; V198-L201 VanDerWaalsContact O-N 3.1Å; L199-L201 VanDerWaalsContact C-N 3.29Å; L199-L201 PolarHBondContact O-N 2.98Å; L201-G203 PolarHBondContact O-N 3.05Å
202	L	91.3	Very high	91	Very high	129 Å²	129	64.9 Å²	64.9	68%	0.675	33%	0.332	S	S	*	.	H	α-helix	trans	-73.3	-20.2	179.6	-64.9	177.7	0	0	0	112.6	V198 L199 K208	V198-L202 HydrophobicContact CG2-CD1 4.1Å; V198-L202 WeakPolarHBondContact O-CG 3.39Å; V198-L202 PolarHBondContact O-N 3.05Å; V198-L202 VanDerWaalsContact O-N 3.09Å; L199-L202 PolarHBondContact O-N 2.94Å; L202-K208 PolarHBondContact O-NZ 3.07Å
203	G	87.8	Confident	90.5	Very high	11 Å²	11	63.7 Å²	63.7	11%	0.113	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	145.1	-1.1	168	0	0	0	0	0	116	L199 P200 L201 N205 L209	L199-G203 PolarHBondContact O-N 3.46Å; L199-G203 VanDerWaalsContact O-N 3.09Å; P200-G203 PolarHBondContact O-N 3.37Å; L201-G203 PolarHBondContact O-N 3.05Å; G203-N205 PolarHBondContact O-N 2.94Å; G203-L209 WeakPolarHBondContact O-CD1 3.49Å
204	W	90.7	Very high	89.9	Confident	86 Å²	86	63.8 Å²	63.8	33%	0.326	33%	0.331	S	S	.	.			trans	-80.8	58.2	174.7	-159.6	-19.1	0	0	0	110.9	L199 P200 T223 Y224	L199-W204 HydrophobicContact CB-CB 4.31Å; L199-W204 HydrophobicContact CB-CE3 4.28Å; L199-W204 HydrophobicContact CD1-CE3 3.91Å; L199-W204 HydrophobicContact CD1-CZ3 4.02Å; L199-W204 PolarHBondContact O-N 3.46Å; P200-W204 WeakPolarHBondContact CA-O 3.09Å; W204-T223 PolarHBondContact NE1-OG1 3.17Å; W204-T223 VanDerWaalsContact NE1-OG1 3.11Å; W204-Y224 HydrophobicContact CD2-CD2 4.47Å
205	N	90.3	Very high	89.1	Confident	18 Å²	18	62.7 Å²	62.7	10%	0.096	33%	0.326	C	S	.	.	B	Isolated β-bridge	trans	-125.4	150.5	177.2	65.3	70.5	0	0	0	109.4	L139 P200 G203 K207 K208 L209 L219	L139-N205 HydrophobicContact CD1-CB 4.41Å; P200-N205 PolarHBondContact O-ND2 3.2Å; G203-N205 PolarHBondContact O-N 2.94Å; N205-K207 PolarHBondContact O-N 2.92Å; N205-K207 PolarHBondContact OD1-N 2.88Å; N205-K208 PolarHBondContact O-N 3.23Å; N205-K208 VanDerWaalsContact O-N 3.14Å; N205-K208 WeakPolarHBondContact OD1-CB 3.31Å; N205-K208 PolarHBondContact OD1-N 3.24Å; N205-L209 PolarHBondContact O-N 3.13Å; N205-L219 WeakPolarHBondContact CA-O 3.46Å; N205-L219 VanDerWaalsContact CB-O 3.25Å; N205-L219 WeakPolarHBondContact CB-O 3.28Å
206	C	87.1	Confident	88.3	Confident	4 Å²	4	60 Å²	60	3%	0.027	31%	0.309	C	S	.	.	H	α-helix	trans	-63.4	-29.1	-170.5	61.1	0	0	0	0	112.8	Q210 S211 C213 L219 D221	C206-Q210 WeakPolarHBondContact O-CA 3.37Å; C206-Q210 PolarHBondContact O-N 3.36Å; C206-S211 WeakPolarHBondContact CA-OG 3.21Å; C206-S211 PolarHBondContact O-N 3.33Å; C206-S211 VanDerWaalsContact O-N 3.16Å; C206-C213 HydrophobicContact CB-CB 3.85Å; C206-C213 WeakPolarHBondContact CB-SG 3.35Å; C206-C213 WeakPolarHBondContact SG-CB 3.3Å; C206-C213 CovalentContact SG-SG 2.03Å; C206-C213 PolarHBondContact SG-SG 3.45Å; C206-L219 PolarHBondContact N-O 3.03Å; C206-L219 VanDerWaalsContact N-O 3.15Å; C206-L219 VanDerWaalsContact SG-C 3.54Å; C206-L219 VanDerWaalsContact SG-CA 3.59Å; C206-L219 PolarHBondContact SG-O 2.81Å; C206-D221 HydrophobicContact CB-CB 4.24Å
207	K	86.3	Confident	87.8	Confident	139 Å²	139	61 Å²	61	60%	0.604	31%	0.313	S	S	*	.	H	α-helix	trans	-65.7	-42.4	177.3	-174	176	-177.3	175.3	0	112.5	N205	N205-K207 PolarHBondContact O-N 2.92Å; N205-K207 PolarHBondContact OD1-N 2.88Å
208	K	86.9	Confident	87.1	Confident	145 Å²	145	61.9 Å²	61.9	63%	0.63	32%	0.318	S	S	*	.	H	α-helix	trans	-81	-31.6	-178.9	-166.3	175	-179.3	-180	0	112.3	L202 N205	L202-K208 PolarHBondContact O-NZ 3.07Å; N205-K208 PolarHBondContact O-N 3.23Å; N205-K208 VanDerWaalsContact O-N 3.14Å; N205-K208 WeakPolarHBondContact OD1-CB 3.31Å; N205-K208 PolarHBondContact OD1-N 3.24Å
209	L	87.2	Confident	86.6	Confident	88 Å²	88	61.2 Å²	61.2	46%	0.461	31%	0.313	S	S	.	.	H	α-helix	trans	-84.9	-10.6	177	-99.1	63.5	0	0	0	113.9	G203 N205 S211	G203-L209 WeakPolarHBondContact O-CD1 3.49Å; N205-L209 PolarHBondContact O-N 3.13Å; L209-S211 PolarHBondContact O-N 3.23Å
210	Q	85.4	Confident	86.4	Confident	186 Å²	186	59.5 Å²	59.5	87%	0.869	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	43.3	-172.7	-59.2	-177.9	-45	0	0	112.1	C206	C206-Q210 WeakPolarHBondContact O-CA 3.37Å; C206-Q210 PolarHBondContact O-N 3.36Å
211	S	87.5	Confident	86.4	Confident	45 Å²	45	59.4 Å²	59.4	32%	0.315	30%	0.303	S	S	.	.			trans	-113.7	178.1	-175.8	54.9	0	0	0	0	111.6	C206 L209 C213 D221	C206-S211 WeakPolarHBondContact CA-OG 3.21Å; C206-S211 PolarHBondContact O-N 3.33Å; C206-S211 VanDerWaalsContact O-N 3.16Å; L209-S211 PolarHBondContact O-N 3.23Å; S211-C213 PolarHBondContact O-N 3.07Å; S211-D221 WeakPolarHBondContact CB-OD2 3.3Å; S211-D221 PolarHBondContact OG-OD2 3.39Å
212	V	85	Confident	86.4	Confident	93 Å²	93	59.5 Å²	59.5	56%	0.564	30%	0.302	S	S	*	.	P	Polyproline II helix	trans	-71.7	127.8	179	-170.8	0	0	0	0	109.8	E222	V212-E222 HydrophobicContact CB-CG 4.5Å; V212-E222 HydrophobicContact CG1-CG 4.37Å; V212-E222 WeakPolarHBondContact CG1-OE1 3.35Å; V212-E222 PolarHBondContact O-N 3.41Å
213	C	86.7	Confident	86.5	Confident	61 Å²	61	57.1 Å²	57.1	41%	0.412	29%	0.293	S	S	.	.	B	Isolated β-bridge	trans	-87.8	147.8	176.6	-55.5	0	0	0	0	110.8	C206 S211 I220	C206-C213 HydrophobicContact CB-CB 3.85Å; C206-C213 WeakPolarHBondContact CB-SG 3.35Å; C206-C213 WeakPolarHBondContact SG-CB 3.3Å; C206-C213 CovalentContact SG-SG 2.03Å; C206-C213 PolarHBondContact SG-SG 3.45Å; S211-C213 PolarHBondContact O-N 3.07Å; C213-I220 WeakPolarHBondContact CA-O 3.21Å
214	S	85	Confident	86.8	Confident	3 Å²	3	57 Å²	57	2%	0.021	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-60.3	142.9	170.5	167.7	0	0	0	0	111.7	I216 F217 I220 D315	S214-I216 VanDerWaalsContact C-N 3.32Å; S214-I216 PolarHBondContact OG-N 2.86Å; S214-F217 PolarHBondContact OG-N 2.87Å; S214-F217 VanDerWaalsContact OG-N 3.11Å; S214-I220 PolarHBondContact N-O 3.25Å; S214-D315 WeakPolarHBondContact CB-OD2 3.45Å; S214-D315 PolarHBondContact OG-OD2 3.32Å
215	D	78	Confident	86.9	Confident	60 Å²	60	53.2 Å²	53.2	32%	0.321	28%	0.275	S	S	.	.	S	Bend	trans	-77.6	-22	179.1	-118.8	-25.7	0	0	0	111.8	F57 D315 M320 K325	F57-D215 WeakPolarHBondContact CE1-O 3.48Å; D215-D315 WeakPolarHBondContact CB-OD1 3.42Å; D215-D315 PolarHBondContact N-OD1 2.88Å; D215-M320 HydrophobicContact CB-CB 4.06Å; D215-M320 HydrophobicContact CB-CG 4.01Å; D215-K325 WeakPolarHBondContact O-CE 3.21Å; D215-K325 PolarHBondContact O-NZ 3.03Å; D215-K325 IonicContact OD1-NZ 2.79Å; D215-K325 PolarHBondContact OD1-NZ 3.25Å
216	I	79.4	Confident	87.1	Confident	22 Å²	22	56.9 Å²	56.9	11%	0.113	29%	0.293	C	S	.	.	S	Bend	trans	-94	-43.1	178.6	-69.1	173.2	0	0	0	111.9	S214 I311 D315 M320 F328	S214-I216 VanDerWaalsContact C-N 3.32Å; S214-I216 PolarHBondContact OG-N 2.86Å; I216-I311 HydrophobicContact CD1-CG2 3.84Å; I216-D315 HydrophobicContact CD1-CB 3.69Å; I216-D315 HydrophobicContact CG1-CB 4.25Å; I216-D315 WeakPolarHBondContact CG1-OD1 3.36Å; I216-D315 PolarHBondContact N-OD1 3Å; I216-M320 HydrophobicContact CD1-CE 3.73Å; I216-M320 HydrophobicContact CD1-SD 4.48Å; I216-M320 HydrophobicContact CG1-CE 3.84Å; I216-F328 HydrophobicContact CD1-CD2 4.22Å; I216-F328 HydrophobicContact CD1-CG 4.29Å; I216-F328 HydrophobicContact CG2-CD1 3.51Å; I216-F328 HydrophobicContact CG2-CE1 3.27Å; I216-F328 HydrophobicContact CG2-CE2 4.32Å; I216-F328 HydrophobicContact CG2-CG 4.15Å; I216-F328 HydrophobicContact CG2-CZ 3.73Å
217	F	83.9	Confident	87.5	Confident	40 Å²	40	60.6 Å²	60.6	18%	0.175	31%	0.308	C	S	.	.	S	Bend	trans	-113.6	109.1	-173.2	-65.5	-70.4	0	0	0	111.6	L142 S214 L219 I220 L225 M312 F328	L142-F217 HydrophobicContact CD1-CD1 4.2Å; L142-F217 HydrophobicContact CD1-CE1 4.24Å; L142-F217 HydrophobicContact CD2-CD1 4.33Å; S214-F217 PolarHBondContact OG-N 2.87Å; S214-F217 VanDerWaalsContact OG-N 3.11Å; F217-L219 PolarHBondContact O-N 2.81Å; F217-I220 HydrophobicContact CB-CB 3.76Å; F217-I220 HydrophobicContact CB-CG1 3.67Å; F217-I220 HydrophobicContact CB-CG2 4.46Å; F217-I220 PolarHBondContact O-N 3.44Å; F217-L225 HydrophobicContact CD2-CD1 4.28Å; F217-L225 HydrophobicContact CE2-CD1 4.3Å; F217-M312 HydrophobicContact CE2-CE 4.06Å; F217-M312 HydrophobicContact CE2-CG 4.47Å; F217-M312 HydrophobicContact CE2-SD 4.48Å; F217-M312 HydrophobicContact CZ-CE 3.94Å; F217-F328 HydrophobicContact CE1-CE1 4.25Å; F217-F328 HydrophobicContact CE1-CZ 4.24Å; F217-F328 HydrophobicContact CE2-CZ 4.09Å; F217-F328 AromaticContact CZ-CE1 3.97Å; F217-F328 HydrophobicContact CZ-CE1 3.97Å; F217-F328 AromaticContact CZ-CZ 3.54Å; F217-F328 HydrophobicContact CZ-CZ 3.54Å
218	P	80.9	Confident	87.9	Confident	19 Å²	19	55 Å²	55	12%	0.123	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	141.8	177	-22.2	30.7	0	0	0	111.4	F57 F138 I220	F57-P218 HydrophobicContact CD1-CG 4.22Å; F57-P218 HydrophobicContact CD2-CG 3.88Å; F57-P218 HydrophobicContact CE1-CG 4.32Å; F57-P218 HydrophobicContact CE2-CB 4.24Å; F57-P218 HydrophobicContact CE2-CG 4Å; F57-P218 HydrophobicContact CG-CG 4Å; F57-P218 HydrophobicContact CZ-CB 4.43Å; F57-P218 HydrophobicContact CZ-CG 4.21Å; F138-P218 HydrophobicContact CE1-CB 4.09Å; F138-P218 HydrophobicContact CE1-CG 4.43Å; F138-P218 WeakPolarHBondContact CE1-O 3.19Å; F138-P218 HydrophobicContact CZ-CB 4.36Å; F138-P218 HydrophobicContact CZ-CG 4.2Å; P218-I220 PolarHBondContact O-N 2.94Å
219	L	84.1	Confident	88.3	Confident	35 Å²	35	48.6 Å²	48.6	18%	0.183	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.9	-7.9	177.7	-73	60	0	0	0	115.5	P135 L139 N205 C206 F217	P135-L219 HydrophobicContact CB-CD2 3.66Å; L139-L219 HydrophobicContact CD1-CD2 4.18Å; L139-L219 HydrophobicContact CD2-CB 4.03Å; L139-L219 HydrophobicContact CG-CB 4.46Å; L139-L219 HydrophobicContact CG-CD2 4.22Å; N205-L219 WeakPolarHBondContact CA-O 3.46Å; N205-L219 VanDerWaalsContact CB-O 3.25Å; N205-L219 WeakPolarHBondContact CB-O 3.28Å; C206-L219 PolarHBondContact N-O 3.03Å; C206-L219 VanDerWaalsContact N-O 3.15Å; C206-L219 VanDerWaalsContact SG-C 3.54Å; C206-L219 VanDerWaalsContact SG-CA 3.59Å; C206-L219 PolarHBondContact SG-O 2.81Å; F217-L219 PolarHBondContact O-N 2.81Å
220	I	89.2	Confident	88.8	Confident	7 Å²	7	46 Å²	46	4%	0.036	25%	0.25	C	S	.	.	B	Isolated β-bridge	trans	-81.6	132.3	176.9	-62.9	-56	0	0	0	109.7	L139 L142 P200 C213 S214 F217 P218 Y224 L225	L139-I220 HydrophobicContact CD2-CD1 3.84Å; L142-I220 HydrophobicContact CD2-CD1 3.81Å; L142-I220 HydrophobicContact CD2-CG1 3.65Å; P200-I220 HydrophobicContact CB-CD1 3.92Å; P200-I220 HydrophobicContact CG-CD1 3.98Å; C213-I220 WeakPolarHBondContact CA-O 3.21Å; S214-I220 PolarHBondContact N-O 3.25Å; F217-I220 HydrophobicContact CB-CB 3.76Å; F217-I220 HydrophobicContact CB-CG1 3.67Å; F217-I220 HydrophobicContact CB-CG2 4.46Å; F217-I220 PolarHBondContact O-N 3.44Å; P218-I220 PolarHBondContact O-N 2.94Å; I220-Y224 HydrophobicContact CD1-CE1 4.48Å; I220-Y224 HydrophobicContact CG2-CD1 3.7Å; I220-Y224 HydrophobicContact CG2-CE1 4.31Å; I220-L225 HydrophobicContact CG2-CB 4.25Å
221	D	91.6	Very high	89.3	Confident	3 Å²	3	39.2 Å²	39.2	2%	0.016	22%	0.222	C	C	.	.	B	Isolated β-bridge	trans	-79.8	140.5	175.4	173.5	-96.3	0	0	0	111.4	C206 S211 T223 Y224 L225	C206-D221 HydrophobicContact CB-CB 4.24Å; S211-D221 WeakPolarHBondContact CB-OD2 3.3Å; S211-D221 PolarHBondContact OG-OD2 3.39Å; D221-T223 VanDerWaalsContact C-N 3.27Å; D221-T223 PolarHBondContact O-N 3.15Å; D221-T223 WeakPolarHBondContact OD1-CA 3.23Å; D221-T223 WeakPolarHBondContact OD1-CB 3.35Å; D221-T223 PolarHBondContact OD1-N 3.5Å; D221-T223 PolarHBondContact OD1-OG1 3.44Å; D221-Y224 PolarHBondContact O-N 3.36Å; D221-Y224 PolarHBondContact OD1-N 2.97Å; D221-L225 PolarHBondContact O-N 3.01Å
222	E	90.5	Very high	89.7	Confident	56 Å²	56	37.2 Å²	37.2	26%	0.262	21%	0.208	S	C	.	.	H	α-helix	trans	-60.9	-33.2	-179.4	-70.4	-179.8	171.4	0	0	113.1	V212 L225 M226	V212-E222 HydrophobicContact CB-CG 4.5Å; V212-E222 HydrophobicContact CG1-CG 4.37Å; V212-E222 WeakPolarHBondContact CG1-OE1 3.35Å; V212-E222 PolarHBondContact O-N 3.41Å; E222-L225 PolarHBondContact O-N 3.49Å; E222-M226 WeakPolarHBondContact O-CB 3.22Å; E222-M226 PolarHBondContact O-N 3.16Å
223	T	92.4	Very high	90.2	Very high	78 Å²	78	34.3 Å²	34.3	48%	0.479	19%	0.192	S	C	.	.	H	α-helix	trans	-72	-37.1	179	76.1	0	0	0	0	111.6	W204 D221 F227	W204-T223 PolarHBondContact NE1-OG1 3.17Å; W204-T223 VanDerWaalsContact NE1-OG1 3.11Å; D221-T223 VanDerWaalsContact C-N 3.27Å; D221-T223 PolarHBondContact O-N 3.15Å; D221-T223 WeakPolarHBondContact OD1-CA 3.23Å; D221-T223 WeakPolarHBondContact OD1-CB 3.35Å; D221-T223 PolarHBondContact OD1-N 3.5Å; D221-T223 PolarHBondContact OD1-OG1 3.44Å; T223-F227 WeakPolarHBondContact O-CB 3.44Å; T223-F227 PolarHBondContact O-N 3.47Å
224	Y	94	Very high	90.7	Very high	9 Å²	9	36.1 Å²	36.1	4%	0.035	20%	0.201	C	C	.	.	H	α-helix	trans	-63.6	-44.7	170.6	170.1	-92.5	0	0	0	111	I196 L199 P200 W204 I220 D221 M226 F227 W228	I196-Y224 WeakPolarHBondContact O-CE2 3.25Å; I196-Y224 PolarHBondContact O-OH 3.41Å; L199-Y224 HydrophobicContact CB-CD2 4.37Å; L199-Y224 HydrophobicContact CB-CE2 4.1Å; L199-Y224 HydrophobicContact CD1-CE2 4.47Å; P200-Y224 HydrophobicContact CG-CD1 4.01Å; P200-Y224 HydrophobicContact CG-CD2 4Å; P200-Y224 HydrophobicContact CG-CE1 3.66Å; P200-Y224 HydrophobicContact CG-CE2 3.66Å; P200-Y224 HydrophobicContact CG-CG 4.15Å; P200-Y224 VanDerWaalsContact CG-CZ 3.46Å; W204-Y224 HydrophobicContact CD2-CD2 4.47Å; I220-Y224 HydrophobicContact CD1-CE1 4.48Å; I220-Y224 HydrophobicContact CG2-CD1 3.7Å; I220-Y224 HydrophobicContact CG2-CE1 4.31Å; D221-Y224 PolarHBondContact O-N 3.36Å; D221-Y224 PolarHBondContact OD1-N 2.97Å; Y224-M226 PolarHBondContact O-N 3.44Å; Y224-F227 WeakPolarHBondContact O-CB 3.26Å; Y224-F227 PolarHBondContact O-N 2.99Å; Y224-W228 PolarHBondContact O-N 3.32Å
225	L	93.4	Very high	91.2	Very high	6 Å²	6	37.7 Å²	37.7	3%	0.031	21%	0.208	C	C	.	.	H	α-helix	trans	-60.5	-46.6	178.2	-178.9	59.2	0	0	0	110.9	F217 I220 D221 E222 F227 W228 I229 D315 V316	F217-L225 HydrophobicContact CD2-CD1 4.28Å; F217-L225 HydrophobicContact CE2-CD1 4.3Å; I220-L225 HydrophobicContact CG2-CB 4.25Å; D221-L225 PolarHBondContact O-N 3.01Å; E222-L225 PolarHBondContact O-N 3.49Å; L225-F227 PolarHBondContact O-N 2.88Å; L225-W228 PolarHBondContact O-N 2.99Å; 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 4.48Å; L225-I229 WeakPolarHBondContact O-CB 3.47Å; L225-I229 WeakPolarHBondContact O-CG1 3.47Å; L225-I229 PolarHBondContact O-N 3.48Å; L225-D315 WeakPolarHBondContact CD2-OD2 3.45Å; L225-V316 HydrophobicContact CD2-CG2 3.89Å; L225-V316 HydrophobicContact CG-CG2 4.14Å
226	M	94.1	Very high	92.1	Very high	95 Å²	95	35.5 Å²	35.5	47%	0.468	20%	0.197	S	C	.	.	H	α-helix	trans	-60	-43.3	175.3	-173.1	-173.8	-66.2	0	0	112.2	E222 Y224 I229 G230 V316 F317	E222-M226 WeakPolarHBondContact O-CB 3.22Å; E222-M226 PolarHBondContact O-N 3.16Å; Y224-M226 PolarHBondContact O-N 3.44Å; M226-I229 PolarHBondContact O-N 2.89Å; M226-G230 PolarHBondContact O-N 3.29Å; M226-V316 HydrophobicContact CE-CG1 3.45Å; M226-V316 VanDerWaalsContact CE-CG1 3.45Å; M226-F317 HydrophobicContact CE-CZ 4.36Å
227	F	95.5	Very high	92.9	Very high	82 Å²	82	40.3 Å²	40.3	36%	0.36	22%	0.222	S	C	.	.	H	α-helix	trans	-59	-48.5	175.3	168.9	-103.5	0	0	0	111.4	I196 T223 Y224 L225 G230 V231	I196-F227 HydrophobicContact CD1-CE1 4.48Å; I196-F227 HydrophobicContact CG1-CE1 4.23Å; I196-F227 HydrophobicContact CG2-CE1 4.1Å; T223-F227 WeakPolarHBondContact O-CB 3.44Å; T223-F227 PolarHBondContact O-N 3.47Å; Y224-F227 WeakPolarHBondContact O-CB 3.26Å; Y224-F227 PolarHBondContact O-N 2.99Å; L225-F227 PolarHBondContact O-N 2.88Å; F227-G230 PolarHBondContact O-N 3.36Å; F227-V231 HydrophobicContact CD2-CG2 4.22Å; F227-V231 HydrophobicContact CE1-CG2 4.33Å; F227-V231 HydrophobicContact CE2-CG2 3.78Å; F227-V231 HydrophobicContact CZ-CG2 3.85Å; F227-V231 WeakPolarHBondContact O-CG2 3.17Å; F227-V231 PolarHBondContact O-N 2.03Å
228	W	95.8	Very high	93.4	Very high	21 Å²	21	41.9 Å²	41.9	8%	0.08	23%	0.229	C	C	.	.	H	α-helix	trans	-64.7	-43.2	-179.9	-175.3	89.8	0	0	0	112.5	T146 T150 Y224 L225 G230 V231 T232 W305 L309 M312	T146-W228 VanDerWaalsContact CG2-NE1 3.29Å; T150-W228 PolarHBondContact OG1-NE1 3.49Å; Y224-W228 PolarHBondContact O-N 3.32Å; L225-W228 PolarHBondContact O-N 2.99Å; W228-G230 VanDerWaalsContact C-N 3.33Å; W228-G230 PolarHBondContact O-N 3.08Å; W228-V231 PolarHBondContact O-N 2.92Å; W228-T232 WeakPolarHBondContact O-CB 3.23Å; W228-T232 PolarHBondContact O-N 3.35Å; W228-T232 PolarHBondContact O-OG1 3.47Å; W228-W305 HydrophobicContact CH2-CZ3 4.09Å; W228-L309 HydrophobicContact CZ3-CD2 4.34Å; W228-M312 HydrophobicContact CE3-SD 4.42Å; W228-M312 HydrophobicContact CZ3-CE 4.36Å; W228-M312 HydrophobicContact CZ3-SD 3.73Å
229	I	95.4	Very high	94.1	Very high	11 Å²	11	41.1 Å²	41.1	6%	0.056	22%	0.224	C	C	.	.	H	α-helix	trans	-59	-46.4	174	-69.3	165.1	0	0	0	110.1	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 4.48Å; L225-I229 WeakPolarHBondContact O-CB 3.47Å; L225-I229 WeakPolarHBondContact O-CG1 3.47Å; L225-I229 PolarHBondContact O-N 3.48Å; M226-I229 PolarHBondContact O-N 2.89Å; I229-T232 PolarHBondContact O-N 3.16Å; I229-S233 WeakPolarHBondContact O-CB 3.14Å; I229-S233 PolarHBondContact O-N 3Å; I229-S233 PolarHBondContact O-OG 3.39Å; I229-L309 HydrophobicContact CG2-CD2 4.42Å; I229-M312 HydrophobicContact CD1-CB 3.69Å; I229-M312 HydrophobicContact CG1-CB 4.11Å; I229-V313 HydrophobicContact CD1-CG2 4.36Å; I229-V313 HydrophobicContact CG2-CG2 3.67Å; I229-V316 HydrophobicContact CD1-CG2 4.37Å
230	G	96.3	Very high	94.6	Very high	33 Å²	33	41.5 Å²	41.5	34%	0.34	23%	0.227	S	C	.	.	H	α-helix	trans	-61	-50.3	-179.5	0	0	0	0	0	112.1	M226 F227 W228 T232 S233 V234	M226-G230 PolarHBondContact O-N 3.29Å; F227-G230 PolarHBondContact O-N 3.36Å; W228-G230 VanDerWaalsContact C-N 3.33Å; W228-G230 PolarHBondContact O-N 3.08Å; G230-T232 PolarHBondContact O-N 2.88Å; G230-S233 PolarHBondContact O-N 3.42Å; G230-V234 VanDerWaalsContact O-CG2 3.3Å; G230-V234 WeakPolarHBondContact O-CG2 3.33Å; G230-V234 PolarHBondContact O-N 3.35Å
231	V	96.1	Very high	94.9	Very high	44 Å²	44	47.3 Å²	47.3	27%	0.267	25%	0.25	S	C	.	.	H	α-helix	trans	-58.2	-49.4	176.8	171.2	0	0	0	0	110.8	F227 W228 S233 V234 L235	F227-V231 HydrophobicContact CD2-CG2 4.22Å; F227-V231 HydrophobicContact CE1-CG2 4.33Å; F227-V231 HydrophobicContact CE2-CG2 3.78Å; F227-V231 HydrophobicContact CZ-CG2 3.85Å; F227-V231 WeakPolarHBondContact O-CG2 3.17Å; F227-V231 PolarHBondContact O-N 2.03Å; W228-V231 PolarHBondContact O-N 2.92Å; V231-S233 PolarHBondContact O-N 3.34Å; V231-V234 PolarHBondContact O-N 2.97Å; V231-L235 HydrophobicContact CG1-CD1 4.3Å; V231-L235 WeakPolarHBondContact O-CG 3.34Å; V231-L235 PolarHBondContact O-N 2.93Å; V231-L235 VanDerWaalsContact O-N 3.13Å
232	T	95.9	Very high	95	Very high	3 Å²	3	47.2 Å²	47.2	2%	0.018	25%	0.249	C	C	.	.	H	α-helix	trans	-62.8	-43.8	-179.2	-58.1	0	0	0	0	111.7	V153 W228 I229 G230 V234 L235 L236 W305 L309	V153-T232 HydrophobicContact CG2-CG2 4.41Å; W228-T232 WeakPolarHBondContact O-CB 3.23Å; W228-T232 PolarHBondContact O-N 3.35Å; W228-T232 PolarHBondContact O-OG1 3.47Å; I229-T232 PolarHBondContact O-N 3.16Å; G230-T232 PolarHBondContact O-N 2.88Å; T232-V234 PolarHBondContact O-N 3.4Å; T232-L235 PolarHBondContact O-N 2.97Å; T232-L236 HydrophobicContact CG2-CD1 3.96Å; T232-L236 HydrophobicContact CG2-CG 4.4Å; T232-L236 WeakPolarHBondContact O-CG 3.35Å; T232-L236 PolarHBondContact O-N 3.32Å; T232-W305 HydrophobicContact CG2-CE3 4.02Å; T232-W305 HydrophobicContact CG2-CH2 4.44Å; T232-W305 HydrophobicContact CG2-CZ3 3.72Å; T232-L309 HydrophobicContact CG2-CD2 4.33Å
233	S	95.7	Very high	95.1	Very high	33 Å²	33	45 Å²	45	23%	0.231	24%	0.239	C	C	.	.	H	α-helix	trans	-62.9	-42.9	178.7	-61.2	0	0	0	0	111.9	I229 G230 V231 L235 L236 L237	I229-S233 WeakPolarHBondContact O-CB 3.14Å; I229-S233 PolarHBondContact O-N 3Å; I229-S233 PolarHBondContact O-OG 3.39Å; G230-S233 PolarHBondContact O-N 3.42Å; V231-S233 PolarHBondContact O-N 3.34Å; S233-L235 VanDerWaalsContact C-N 3.34Å; S233-L235 PolarHBondContact O-N 3.43Å; S233-L236 PolarHBondContact O-N 3.29Å; S233-L237 WeakPolarHBondContact O-CB 2.98Å; S233-L237 VanDerWaalsContact O-CG 3.24Å; S233-L237 WeakPolarHBondContact O-CG 3.43Å; S233-L237 PolarHBondContact O-N 2.9Å
234	V	96.8	Very high	95.1	Very high	99 Å²	99	46.4 Å²	46.4	60%	0.6	24%	0.241	S	C	*	.	H	α-helix	trans	-60.9	-43.5	176.2	169.3	0	0	0	0	111.1	G230 V231 T232 F238	G230-V234 VanDerWaalsContact O-CG2 3.3Å; G230-V234 WeakPolarHBondContact O-CG2 3.33Å; G230-V234 PolarHBondContact O-N 3.35Å; V231-V234 PolarHBondContact O-N 2.97Å; T232-V234 PolarHBondContact O-N 3.4Å; V234-F238 PolarHBondContact O-N 3.37Å
235	L	96.2	Very high	94.9	Very high	35 Å²	35	47.8 Å²	47.8	18%	0.183	25%	0.246	C	C	.	.	H	α-helix	trans	-63.7	-45.9	177.2	-67	175.4	0	0	0	111.8	V153 F157 V231 T232 S233 F238 I239	V153-L235 HydrophobicContact CG1-CB 3.9Å; V153-L235 HydrophobicContact CG1-CD1 4.11Å; F157-L235 HydrophobicContact CB-CD2 4.45Å; F157-L235 HydrophobicContact CD1-CD2 4.09Å; F157-L235 HydrophobicContact CD2-CD2 3.81Å; F157-L235 HydrophobicContact CE1-CD2 4.22Å; F157-L235 HydrophobicContact CE2-CD2 3.94Å; F157-L235 HydrophobicContact CG-CD2 3.88Å; F157-L235 HydrophobicContact CZ-CD2 4.14Å; V231-L235 HydrophobicContact CG1-CD1 4.3Å; V231-L235 WeakPolarHBondContact O-CG 3.34Å; V231-L235 PolarHBondContact O-N 2.93Å; V231-L235 VanDerWaalsContact O-N 3.13Å; T232-L235 PolarHBondContact O-N 2.97Å; S233-L235 VanDerWaalsContact C-N 3.34Å; S233-L235 PolarHBondContact O-N 3.43Å; L235-F238 PolarHBondContact O-N 3.12Å; L235-I239 VanDerWaalsContact O-CG1 3.3Å; L235-I239 WeakPolarHBondContact O-CG1 3.11Å; L235-I239 PolarHBondContact O-N 3.01Å
236	L	96.1	Very high	94.7	Very high	15 Å²	15	47.6 Å²	47.6	8%	0.079	25%	0.246	C	C	.	.	H	α-helix	trans	-64.8	-42.9	178.9	-70	172.5	0	0	0	112.3	V153 T232 S233 F238 I239 V240 L301 W305 L309	V153-L236 HydrophobicContact CG1-CD2 4.2Å; V153-L236 HydrophobicContact CG1-CG 4.35Å; T232-L236 HydrophobicContact CG2-CD1 3.96Å; T232-L236 HydrophobicContact CG2-CG 4.4Å; T232-L236 WeakPolarHBondContact O-CG 3.35Å; T232-L236 PolarHBondContact O-N 3.32Å; S233-L236 PolarHBondContact O-N 3.29Å; L236-F238 VanDerWaalsContact C-N 3.28Å; L236-F238 PolarHBondContact O-N 3.05Å; L236-I239 HydrophobicContact CD2-CD1 4.3Å; L236-I239 WeakPolarHBondContact O-CB 3.42Å; L236-I239 PolarHBondContact O-N 2.89Å; L236-I239 VanDerWaalsContact O-N 3.13Å; L236-V240 WeakPolarHBondContact O-CG2 3.42Å; L236-V240 PolarHBondContact O-N 3.44Å; L236-L301 HydrophobicContact CD2-CD1 3.64Å; L236-L301 HydrophobicContact CD2-CD2 3.98Å; L236-L301 HydrophobicContact CD2-CG 3.92Å; L236-W305 HydrophobicContact CD1-CB 3.76Å; L236-W305 HydrophobicContact CD1-CD2 3.92Å; L236-W305 HydrophobicContact CD1-CE3 4Å; L236-W305 HydrophobicContact CD1-CG 3.83Å; L236-W305 HydrophobicContact CD2-CD2 4.42Å; L236-W305 HydrophobicContact CD2-CG 4.18Å; L236-L309 HydrophobicContact CD1-CD1 3.51Å
237	L	96	Very high	94.5	Very high	123 Å²	123	44.6 Å²	44.6	64%	0.644	23%	0.231	S	C	*	.	H	α-helix	trans	-60.2	-40.6	175.3	-74.3	173.1	0	0	0	111.4	S233 V240 Y241	S233-L237 WeakPolarHBondContact O-CB 2.98Å; S233-L237 VanDerWaalsContact O-CG 3.24Å; S233-L237 WeakPolarHBondContact O-CG 3.43Å; S233-L237 PolarHBondContact O-N 2.9Å; L237-V240 PolarHBondContact O-N 2.94Å; L237-Y241 WeakPolarHBondContact O-CB 3.33Å; L237-Y241 PolarHBondContact O-N 3.44Å
238	F	95.5	Very high	94.2	Very high	73 Å²	73	48.2 Å²	48.2	32%	0.32	24%	0.242	S	C	.	.	H	α-helix	trans	-64	-42.9	173.9	-176.3	-83.4	0	0	0	112	F157 I161 V234 L235 L236 V240 Y241 A242	F157-F238 HydrophobicContact CD2-CB 4.25Å; F157-F238 AromaticContact CD2-CD1 3.54Å; F157-F238 HydrophobicContact CD2-CD1 3.54Å; F157-F238 HydrophobicContact CD2-CE1 4.2Å; F157-F238 HydrophobicContact CD2-CG 4.13Å; F157-F238 HydrophobicContact CE2-CB 3.89Å; F157-F238 AromaticContact CE2-CD1 3.18Å; F157-F238 HydrophobicContact CE2-CD1 3.18Å; F157-F238 HydrophobicContact CE2-CD2 4.27Å; F157-F238 AromaticContact CE2-CE1 3.69Å; F157-F238 HydrophobicContact CE2-CE1 3.69Å; F157-F238 AromaticContact CE2-CG 3.51Å; F157-F238 HydrophobicContact CE2-CG 3.51Å; F157-F238 HydrophobicContact CE2-CZ 4.41Å; F157-F238 HydrophobicContact CZ-CD1 4.23Å; F157-F238 HydrophobicContact CZ-CE1 4.38Å; I161-F238 HydrophobicContact CD1-CE1 4.36Å; I161-F238 HydrophobicContact CG1-CE1 3.64Å; I161-F238 HydrophobicContact CG1-CZ 4.09Å; V234-F238 PolarHBondContact O-N 3.37Å; L235-F238 PolarHBondContact O-N 3.12Å; L236-F238 VanDerWaalsContact C-N 3.28Å; L236-F238 PolarHBondContact O-N 3.05Å; F238-V240 VanDerWaalsContact C-N 3.33Å; F238-V240 PolarHBondContact O-N 3.34Å; F238-Y241 PolarHBondContact O-N 3.31Å; F238-A242 HydrophobicContact CD1-CB 4.43Å; F238-A242 HydrophobicContact CE1-CB 4.19Å; F238-A242 VanDerWaalsContact O-CB 3.32Å; F238-A242 WeakPolarHBondContact O-CB 3.28Å; F238-A242 PolarHBondContact O-N 2.88Å
239	I	95.7	Very high	93.7	Very high	3 Å²	3	50.7 Å²	50.7	2%	0.015	25%	0.254	C	S	.	.	H	α-helix	trans	-58.4	-47.8	176.6	-69.5	162.7	0	0	0	110.1	L156 F157 A160 L235 L236 A242 Y243 L301	L156-I239 HydrophobicContact CB-CD1 3.91Å; F157-I239 HydrophobicContact CB-CD1 4.03Å; F157-I239 HydrophobicContact CB-CG1 4.14Å; F157-I239 HydrophobicContact CD2-CG1 4.35Å; A160-I239 HydrophobicContact CB-CB 4.41Å; A160-I239 HydrophobicContact CB-CG1 4.06Å; A160-I239 HydrophobicContact CB-CG2 4.27Å; L235-I239 VanDerWaalsContact O-CG1 3.3Å; L235-I239 WeakPolarHBondContact O-CG1 3.11Å; L235-I239 PolarHBondContact O-N 3.01Å; L236-I239 HydrophobicContact CD2-CD1 4.3Å; L236-I239 WeakPolarHBondContact O-CB 3.42Å; L236-I239 PolarHBondContact O-N 2.89Å; L236-I239 VanDerWaalsContact O-N 3.13Å; I239-A242 PolarHBondContact O-N 2.88Å; I239-Y243 HydrophobicContact CG2-CD2 3.6Å; I239-Y243 HydrophobicContact CG2-CE2 3.53Å; I239-Y243 VanDerWaalsContact O-CD2 3.29Å; I239-Y243 WeakPolarHBondContact O-CD2 3.46Å; I239-Y243 PolarHBondContact O-N 3.48Å; I239-L301 HydrophobicContact CB-CD2 4.25Å; I239-L301 HydrophobicContact CG2-CD2 3.65Å
240	V	95.3	Very high	93.1	Very high	42 Å²	42	51.6 Å²	51.6	26%	0.255	26%	0.263	S	S	.	.	H	α-helix	trans	-59.5	-50.2	177.1	173.5	0	0	0	0	110.4	L236 L237 F238 A242 Y243 M244 L298 L301	L236-V240 WeakPolarHBondContact O-CG2 3.42Å; L236-V240 PolarHBondContact O-N 3.44Å; L237-V240 PolarHBondContact O-N 2.94Å; F238-V240 VanDerWaalsContact C-N 3.33Å; F238-V240 PolarHBondContact O-N 3.34Å; V240-A242 VanDerWaalsContact C-N 3.35Å; V240-A242 PolarHBondContact O-N 2.93Å; V240-Y243 PolarHBondContact O-N 3.26Å; V240-M244 HydrophobicContact CG1-CG 4.17Å; V240-M244 WeakPolarHBondContact O-CB 3.46Å; V240-M244 WeakPolarHBondContact O-CG 3.01Å; V240-M244 PolarHBondContact O-N 2.96Å; 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 4.21Å
241	Y	94.9	Very high	92.5	Very high	130 Å²	130	56 Å²	56	51%	0.51	28%	0.275	S	S	.	.	H	α-helix	trans	-55.6	-47.7	176.6	168.1	-97.1	0	0	0	112.2	L237 F238 Y243 M244 Y245	L237-Y241 WeakPolarHBondContact O-CB 3.33Å; L237-Y241 PolarHBondContact O-N 3.44Å; F238-Y241 PolarHBondContact O-N 3.31Å; Y241-Y243 PolarHBondContact O-N 3.11Å; Y241-M244 PolarHBondContact O-N 2.73Å; Y241-Y245 WeakPolarHBondContact O-CB 3.45Å; Y241-Y245 PolarHBondContact O-N 3.44Å
242	A	93.3	Very high	92	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-61.7	-45.7	-178.4	0	0	0	0	0	111.5	A160 Y164 F238 I239 V240 Y245 I246	A160-A242 HydrophobicContact CB-CB 4.23Å; Y164-A242 HydrophobicContact CD2-CB 4.45Å; F238-A242 HydrophobicContact CD1-CB 4.43Å; F238-A242 HydrophobicContact CE1-CB 4.19Å; F238-A242 VanDerWaalsContact O-CB 3.32Å; F238-A242 WeakPolarHBondContact O-CB 3.28Å; F238-A242 PolarHBondContact O-N 2.88Å; I239-A242 PolarHBondContact O-N 2.88Å; V240-A242 VanDerWaalsContact C-N 3.35Å; V240-A242 PolarHBondContact O-N 2.93Å; A242-Y245 PolarHBondContact O-N 2.83Å; A242-I246 WeakPolarHBondContact O-CB 3.37Å; A242-I246 WeakPolarHBondContact O-CD1 3.48Å; A242-I246 WeakPolarHBondContact O-CG1 3.32Å; A242-I246 PolarHBondContact O-N 2.98Å
243	Y	92.3	Very high	91.2	Very high	11 Å²	11	59.3 Å²	59.3	4%	0.043	29%	0.289	C	S	.	.	H	α-helix	trans	-69.8	-37.8	177.8	-76.4	-55.2	0	0	0	113.2	A160 I239 V240 Y241 Y245 I246 L247 L294 I297 L298	A160-Y243 HydrophobicContact CB-CE2 4.24Å; I239-Y243 HydrophobicContact CG2-CD2 3.6Å; I239-Y243 HydrophobicContact CG2-CE2 3.53Å; I239-Y243 VanDerWaalsContact O-CD2 3.29Å; I239-Y243 WeakPolarHBondContact O-CD2 3.46Å; I239-Y243 PolarHBondContact O-N 3.48Å; V240-Y243 PolarHBondContact O-N 3.26Å; Y241-Y243 PolarHBondContact O-N 3.11Å; Y243-Y245 VanDerWaalsContact C-N 3.34Å; Y243-I246 HydrophobicContact CD1-CD1 3.96Å; Y243-I246 HydrophobicContact CE1-CD1 4.43Å; Y243-I246 WeakPolarHBondContact O-CB 3.43Å; Y243-I246 PolarHBondContact O-N 3.37Å; Y243-L247 WeakPolarHBondContact O-CG 3.46Å; Y243-L247 PolarHBondContact O-N 3.22Å; Y243-L294 HydrophobicContact CD1-CD1 4.49Å; Y243-L294 HydrophobicContact CD1-CD2 3.58Å; Y243-L294 HydrophobicContact CD1-CG 4.44Å; Y243-L294 HydrophobicContact CE1-CD2 3.45Å; Y243-L294 VanDerWaalsContact CE1-CD2 3.45Å; Y243-I297 HydrophobicContact CE2-CG2 4.05Å; Y243-L298 HydrophobicContact CD2-CD2 4.05Å; Y243-L298 HydrophobicContact CD2-CG 4.46Å; Y243-L298 HydrophobicContact CG-CD2 4.34Å; Y243-L298 HydrophobicContact CG-CG 4.45Å
244	M	91.9	Very high	90.5	Very high	107 Å²	107	58.7 Å²	58.7	53%	0.527	29%	0.286	S	S	.	.	H	α-helix	trans	-62.6	-42.5	173	-70.1	-61.6	-73.9	0	0	111.4	V240 Y241 I246 L247 W248 L298	V240-M244 HydrophobicContact CG1-CG 4.17Å; V240-M244 WeakPolarHBondContact O-CB 3.46Å; V240-M244 WeakPolarHBondContact O-CG 3.01Å; V240-M244 PolarHBondContact O-N 2.96Å; Y241-M244 PolarHBondContact O-N 2.73Å; M244-I246 VanDerWaalsContact C-N 3.35Å; M244-I246 PolarHBondContact O-N 3.46Å; M244-L247 PolarHBondContact O-N 3.41Å; M244-L247 HydrophobicContact SD-CD1 4.42Å; M244-W248 WeakPolarHBondContact O-CB 3.23Å; M244-W248 PolarHBondContact O-N 3.33Å; M244-L298 HydrophobicContact CG-CD1 4.42Å; M244-L298 HydrophobicContact SD-CD1 3.95Å
245	Y	91.3	Very high	89.8	Confident	37 Å²	37	56.6 Å²	56.6	15%	0.145	27%	0.273	C	S	.	.	H	α-helix	trans	-61.2	-43.5	173.6	179.5	-90.5	0	0	0	111.9	Y164 H168 Y241 A242 Y243 W248 K249	Y164-Y245 AromaticContact CD2-CD1 3.71Å; Y164-Y245 HydrophobicContact CD2-CD1 3.71Å; Y164-Y245 HydrophobicContact CD2-CE1 4.24Å; Y164-Y245 HydrophobicContact CD2-CG 4.38Å; Y164-Y245 AromaticContact CE2-CD1 3.34Å; Y164-Y245 HydrophobicContact CE2-CD1 3.34Å; Y164-Y245 AromaticContact CE2-CE1 3.64Å; Y164-Y245 HydrophobicContact CE2-CE1 3.64Å; Y164-Y245 AromaticContact CE2-CG 3.85Å; Y164-Y245 HydrophobicContact CE2-CG 3.85Å; H168-Y245 HydrophobicContact CB-CE1 4.35Å; H168-Y245 PolarHBondContact CE1-OH 3.41Å; H168-Y245 AromaticContact ND1-CE1 3.88Å; H168-Y245 AromaticContact ND1-CZ 3.7Å; H168-Y245 PolarHBondContact ND1-OH 2.95Å; Y241-Y245 WeakPolarHBondContact O-CB 3.45Å; Y241-Y245 PolarHBondContact O-N 3.44Å; A242-Y245 PolarHBondContact O-N 2.83Å; Y243-Y245 VanDerWaalsContact C-N 3.34Å; Y245-W248 HydrophobicContact CD2-CE3 4.11Å; Y245-W248 HydrophobicContact CD2-CZ3 4.37Å; Y245-W248 HydrophobicContact CE2-CE3 4.07Å; Y245-W248 AromaticContact CE2-CZ3 3.96Å; Y245-W248 HydrophobicContact CE2-CZ3 3.96Å; Y245-W248 PolarHBondContact O-N 3.31Å; Y245-K249 HydrophobicContact CE1-CB 4.42Å; Y245-K249 WeakPolarHBondContact O-CB 3.36Å; Y245-K249 PolarHBondContact O-N 2.56Å
246	I	89.4	Confident	89.1	Confident	3 Å²	3	61.7 Å²	61.7	2%	0.015	29%	0.29	C	S	.	.	H	α-helix	trans	-58.9	-48.8	176.4	-74	163.1	0	0	0	110.6	R163 I167 A242 Y243 M244 W248 K249 A250 L294	R163-I246 HydrophobicContact CB-CD1 3.74Å; I167-I246 HydrophobicContact CD1-CB 4.24Å; I167-I246 HydrophobicContact CD1-CG1 4.06Å; I167-I246 HydrophobicContact CD1-CG2 3.33Å; A242-I246 WeakPolarHBondContact O-CB 3.37Å; A242-I246 WeakPolarHBondContact O-CD1 3.48Å; A242-I246 WeakPolarHBondContact O-CG1 3.32Å; A242-I246 PolarHBondContact O-N 2.98Å; Y243-I246 HydrophobicContact CD1-CD1 3.96Å; Y243-I246 HydrophobicContact CE1-CD1 4.43Å; Y243-I246 WeakPolarHBondContact O-CB 3.43Å; Y243-I246 PolarHBondContact O-N 3.37Å; M244-I246 VanDerWaalsContact C-N 3.35Å; M244-I246 PolarHBondContact O-N 3.46Å; I246-W248 PolarHBondContact O-N 3.46Å; I246-K249 PolarHBondContact O-N 2.95Å; I246-A250 WeakPolarHBondContact O-CB 3.33Å; I246-A250 PolarHBondContact O-N 3.26Å; I246-L294 HydrophobicContact CB-CD1 4.4Å; I246-L294 HydrophobicContact CG2-CD1 3.37Å
247	L	88.5	Confident	88.1	Confident	31 Å²	31	65.4 Å²	65.4	16%	0.162	31%	0.308	C	S	.	.	H	α-helix	trans	-60.4	-45.7	178.2	-73	171.6	0	0	0	111.3	Y243 M244 K249 A250 H251 A291 L294 V295 L298	Y243-L247 WeakPolarHBondContact O-CG 3.46Å; Y243-L247 PolarHBondContact O-N 3.22Å; M244-L247 PolarHBondContact O-N 3.41Å; M244-L247 HydrophobicContact SD-CD1 4.42Å; L247-K249 PolarHBondContact O-N 2.86Å; L247-A250 PolarHBondContact O-N 2.72Å; L247-H251 VanDerWaalsContact O-CB 3.31Å; L247-H251 WeakPolarHBondContact O-CB 3.37Å; L247-H251 PolarHBondContact O-N 3.11Å; L247-A291 HydrophobicContact CD2-CB 3.75Å; L247-L294 HydrophobicContact CD2-CB 4.05Å; L247-L294 HydrophobicContact CD2-CD1 4.16Å; L247-L294 HydrophobicContact CG-CB 4.42Å; L247-L294 HydrophobicContact CG-CD1 4.47Å; L247-V295 HydrophobicContact CD1-CG2 3.89Å; L247-V295 HydrophobicContact CD2-CG2 4.36Å; L247-L298 HydrophobicContact CD1-CD1 4.02Å
248	W	88.9	Confident	87.1	Confident	158 Å²	158	64.6 Å²	64.6	60%	0.598	30%	0.303	S	S	*	.	H	α-helix	trans	-61.8	-42.8	177.5	177.3	63.7	0	0	0	112.4	M244 Y245 I246 S252	M244-W248 WeakPolarHBondContact O-CB 3.23Å; M244-W248 PolarHBondContact O-N 3.33Å; Y245-W248 HydrophobicContact CD2-CE3 4.11Å; Y245-W248 HydrophobicContact CD2-CZ3 4.37Å; Y245-W248 HydrophobicContact CE2-CE3 4.07Å; Y245-W248 AromaticContact CE2-CZ3 3.96Å; Y245-W248 HydrophobicContact CE2-CZ3 3.96Å; Y245-W248 PolarHBondContact O-N 3.31Å; I246-W248 PolarHBondContact O-N 3.46Å; W248-S252 VanDerWaalsContact O-CB 3.28Å; W248-S252 WeakPolarHBondContact O-CB 3.32Å; W248-S252 PolarHBondContact O-N 2.99Å; W248-S252 PolarHBondContact O-OG 2.98Å
249	K	86.4	Confident	86.1	Confident	74 Å²	74	67 Å²	67	32%	0.322	32%	0.316	S	S	.	.	H	α-helix	trans	-67.2	-43.5	178.7	-170.5	67.4	173.7	-168.4	0	111.7	I167 Y245 I246 L247 S252 H253	I167-K249 HydrophobicContact CG2-CB 4.2Å; I167-K249 HydrophobicContact CG2-CG 3.96Å; Y245-K249 HydrophobicContact CE1-CB 4.42Å; Y245-K249 WeakPolarHBondContact O-CB 3.36Å; Y245-K249 PolarHBondContact O-N 2.56Å; I246-K249 PolarHBondContact O-N 2.95Å; L247-K249 PolarHBondContact O-N 2.86Å; K249-S252 PolarHBondContact O-N 3.32Å; K249-H253 WeakPolarHBondContact O-CB 3.22Å; K249-H253 PolarHBondContact O-N 3.4Å
250	A	82.8	Confident	85	Confident	30 Å²	30	75.4 Å²	75.4	25%	0.248	35%	0.347	C	S	.	.	H	α-helix	trans	-61.7	-47.3	176.1	0	0	0	0	0	111	I246 L247 S252 H253 A254	I246-A250 WeakPolarHBondContact O-CB 3.33Å; I246-A250 PolarHBondContact O-N 3.26Å; L247-A250 PolarHBondContact O-N 2.72Å; A250-S252 PolarHBondContact O-N 2.91Å; A250-H253 PolarHBondContact O-N 3.49Å; A250-A254 WeakPolarHBondContact O-CB 3.36Å; A250-A254 PolarHBondContact O-N 3.24Å
251	H	84	Confident	83.3	Confident	126 Å²	126	75.2 Å²	75.2	58%	0.583	35%	0.353	S	S	*	.	H	α-helix	trans	-60.7	-47.3	176.1	-177	-94.5	0	0	0	112	L247 H253 A254 V255	L247-H251 VanDerWaalsContact O-CB 3.31Å; L247-H251 WeakPolarHBondContact O-CB 3.37Å; L247-H251 PolarHBondContact O-N 3.11Å; H251-H253 VanDerWaalsContact C-N 3.27Å; H251-H253 PolarHBondContact O-N 3.43Å; H251-A254 PolarHBondContact O-N 2.97Å; H251-V255 WeakPolarHBondContact O-CG2 3.36Å; H251-V255 PolarHBondContact O-N 2.87Å
252	S	84.2	Confident	81.3	Confident	24 Å²	24	73.8 Å²	73.8	17%	0.168	36%	0.358	C	S	.	.	H	α-helix	trans	-60.3	-38.1	177.8	-63.2	0	0	0	0	112.2	W248 K249 A250 R256	W248-S252 VanDerWaalsContact O-CB 3.28Å; W248-S252 WeakPolarHBondContact O-CB 3.32Å; W248-S252 PolarHBondContact O-N 2.99Å; W248-S252 PolarHBondContact O-OG 2.98Å; K249-S252 PolarHBondContact O-N 3.32Å; A250-S252 PolarHBondContact O-N 2.91Å; S252-R256 WeakPolarHBondContact O-CB 3.45Å; S252-R256 WeakPolarHBondContact O-CG 3.36Å; S252-R256 PolarHBondContact O-N 3.31Å; S252-R256 VanDerWaalsContact O-N 3.14Å
253	H	80.8	Confident	79.2	Confident	92 Å²	92	81.7 Å²	81.7	43%	0.426	40%	0.395	S	S	.	.	H	α-helix	trans	-67.9	-45.7	175.2	-175.8	-94.7	0	0	0	111.5	K249 A250 H251 V255 R256 M257	K249-H253 WeakPolarHBondContact O-CB 3.22Å; K249-H253 PolarHBondContact O-N 3.4Å; A250-H253 PolarHBondContact O-N 3.49Å; H251-H253 VanDerWaalsContact C-N 3.27Å; H251-H253 PolarHBondContact O-N 3.43Å; H253-V255 PolarHBondContact O-N 3.44Å; H253-R256 PolarHBondContact O-N 3.07Å; H253-M257 VanDerWaalsContact CE1-CG 3.49Å; H253-M257 WeakPolarHBondContact CE1-CG 3.33Å; H253-M257 WeakPolarHBondContact O-CB 3.46Å; H253-M257 VanDerWaalsContact O-CG 3.29Å; H253-M257 WeakPolarHBondContact O-CG 3.3Å; H253-M257 PolarHBondContact O-N 2.76Å
254	A	80.3	Confident	77	Confident	20 Å²	20	90 Å²	90	17%	0.165	43%	0.431	C	S	.	.	H	α-helix	trans	-58.6	-46	177.4	0	0	0	0	0	111.9	A250 H251 R256 M257 I258	A250-A254 WeakPolarHBondContact O-CB 3.36Å; A250-A254 PolarHBondContact O-N 3.24Å; H251-A254 PolarHBondContact O-N 2.97Å; A254-R256 PolarHBondContact O-N 3Å; A254-M257 PolarHBondContact O-N 2.79Å; A254-I258 WeakPolarHBondContact O-CG1 3.4Å; A254-I258 PolarHBondContact O-N 2.99Å
255	V	81.6	Confident	74.9	Confident	54 Å²	54	89 Å²	89	33%	0.327	44%	0.436	S	S	.	.	H	α-helix	trans	-62	-45.2	176.9	173.2	0	0	0	0	111.4	H251 H253 M257 I258 Q259	H251-V255 WeakPolarHBondContact O-CG2 3.36Å; H251-V255 PolarHBondContact O-N 2.87Å; H253-V255 PolarHBondContact O-N 3.44Å; V255-M257 VanDerWaalsContact C-N 3.3Å; V255-M257 PolarHBondContact O-N 2.88Å; V255-I258 PolarHBondContact O-N 3.44Å; V255-Q259 WeakPolarHBondContact O-CG 3.42Å; V255-Q259 PolarHBondContact O-N 3.23Å
256	R	81.4	Confident	72.7	Confident	142 Å²	142	93.6 Å²	93.6	54%	0.536	46%	0.461	S	S	.	.	H	α-helix	trans	-62.9	-37.1	176.4	-72.7	172.1	-169.5	-175.9	1.5	112.4	S252 H253 A254 Q259 R260	S252-R256 WeakPolarHBondContact O-CB 3.45Å; S252-R256 WeakPolarHBondContact O-CG 3.36Å; S252-R256 PolarHBondContact O-N 3.31Å; S252-R256 VanDerWaalsContact O-N 3.14Å; H253-R256 PolarHBondContact O-N 3.07Å; A254-R256 PolarHBondContact O-N 3Å; R256-Q259 PolarHBondContact O-N 2.67Å; R256-R260 WeakPolarHBondContact O-CB 3.24Å; R256-R260 WeakPolarHBondContact O-CG 3.47Å; R256-R260 PolarHBondContact O-N 2.65Å
257	M	75.6	Confident	70.6	Confident	93 Å²	93	100.6 Å²	100.6	46%	0.458	50%	0.497	S	S	.	.	H	α-helix	trans	-68.6	-38.3	176.8	-74.7	-63.8	-67.3	0	0	111.7	H253 A254 V255 G261	H253-M257 VanDerWaalsContact CE1-CG 3.49Å; H253-M257 WeakPolarHBondContact CE1-CG 3.33Å; H253-M257 WeakPolarHBondContact O-CB 3.46Å; H253-M257 VanDerWaalsContact O-CG 3.29Å; H253-M257 WeakPolarHBondContact O-CG 3.3Å; H253-M257 PolarHBondContact O-N 2.76Å; A254-M257 PolarHBondContact O-N 2.79Å; V255-M257 VanDerWaalsContact C-N 3.3Å; V255-M257 PolarHBondContact O-N 2.88Å; M257-G261 WeakPolarHBondContact O-CA 3.48Å; M257-G261 PolarHBondContact O-N 2.73Å
258	I	75.2	Confident	69	Low	106 Å²	106	105 Å²	105	54%	0.544	52%	0.52	S	S	.	.	H	α-helix	trans	-63.2	-49.1	172.4	-67.7	165.2	0	0	0	109.7	A254 V255 R260 G261 T262	A254-I258 WeakPolarHBondContact O-CG1 3.4Å; A254-I258 PolarHBondContact O-N 2.99Å; V255-I258 PolarHBondContact O-N 3.44Å; I258-R260 VanDerWaalsContact C-N 3.34Å; I258-R260 PolarHBondContact O-N 3.04Å; I258-G261 PolarHBondContact O-N 3.16Å; I258-G261 VanDerWaalsContact O-N 3.13Å; I258-T262 PolarHBondContact O-N 3.07Å; I258-T262 PolarHBondContact O-OG1 2.87Å
259	Q	75.6	Confident	66.9	Low	125 Å²	125	105.9 Å²	105.9	58%	0.584	53%	0.53	S	S	*	.	H	α-helix	trans	-59	-41.7	178.6	-71.6	173.4	-18.6	0	0	113.1	V255 R256 Q263	V255-Q259 WeakPolarHBondContact O-CG 3.42Å; V255-Q259 PolarHBondContact O-N 3.23Å; R256-Q259 PolarHBondContact O-N 2.67Å; Q259-Q263 PolarHBondContact O-N 2.84Å
260	R	70.5	Confident	65.3	Low	179 Å²	179	108.6 Å²	108.6	68%	0.675	55%	0.553	S	S	*	*	H	α-helix	trans	-74.2	-32.9	175.6	-71.6	178.1	176.3	-172.7	-3	112.8	R256 I258 Q263 K264	R256-R260 WeakPolarHBondContact O-CB 3.24Å; R256-R260 WeakPolarHBondContact O-CG 3.47Å; R256-R260 PolarHBondContact O-N 2.65Å; I258-R260 VanDerWaalsContact C-N 3.34Å; I258-R260 PolarHBondContact O-N 3.04Å; R260-Q263 PolarHBondContact O-N 3.06Å; R260-K264 PolarHBondContact O-N 2.86Å; R260-K264 VanDerWaalsContact O-N 3.1Å
261	G	60.2	Low	63.6	Low	37 Å²	37	112.7 Å²	112.7	38%	0.381	58%	0.58	S	S	.	*	H	α-helix	trans	-67.9	-38.6	176	0	0	0	0	0	112	M257 I258 Q263 K264 S265	M257-G261 WeakPolarHBondContact O-CA 3.48Å; M257-G261 PolarHBondContact O-N 2.73Å; I258-G261 PolarHBondContact O-N 3.16Å; I258-G261 VanDerWaalsContact O-N 3.13Å; G261-Q263 VanDerWaalsContact C-N 3.27Å; G261-Q263 PolarHBondContact O-N 3.41Å; G261-K264 CarbonylContact O-C 3.55Å; G261-K264 PolarHBondContact O-N 3.38Å; G261-K264 VanDerWaalsContact O-N 3.16Å; G261-S265 WeakPolarHBondContact O-CB 3.22Å; G261-S265 PolarHBondContact O-N 3.18Å; G261-S265 PolarHBondContact O-OG 3.36Å
262	T	53.2	Low	62	Low	100 Å²	100	116.2 Å²	116.2	61%	0.613	60%	0.596	S	S	*	*	H	α-helix	trans	-66.6	-27.2	172.9	-47.7	0	0	0	0	112.2	I258	I258-T262 PolarHBondContact O-N 3.07Å; I258-T262 PolarHBondContact O-OG1 2.87Å
263	Q	49.3	Very low	60.3	Low	166 Å²	166	122.6 Å²	122.6	78%	0.776	63%	0.629	S	S	*	*	H	α-helix	trans	-80.7	-22.5	171.1	-88.7	-161.7	-8.7	0	0	114.4	Q259 R260 G261	Q259-Q263 PolarHBondContact O-N 2.84Å; R260-Q263 PolarHBondContact O-N 3.06Å; G261-Q263 VanDerWaalsContact C-N 3.27Å; G261-Q263 PolarHBondContact O-N 3.41Å
264	K	46.3	Very low	59.1	Low	185 Å²	185	122 Å²	122	80%	0.804	65%	0.648	S	S	*	*	H	α-helix	trans	-107.2	-2.5	-179.4	-79.3	-169	174.8	-172.9	0	114.8	R260 G261 I266	R260-K264 PolarHBondContact O-N 2.86Å; R260-K264 VanDerWaalsContact O-N 3.1Å; G261-K264 CarbonylContact O-C 3.55Å; G261-K264 PolarHBondContact O-N 3.38Å; G261-K264 VanDerWaalsContact O-N 3.16Å; K264-I266 PolarHBondContact O-N 3.17Å; K264-I266 VanDerWaalsContact O-N 3.11Å
265	S	46.8	Very low	57.2	Low	88 Å²	88	130.3 Å²	130.3	62%	0.615	68%	0.68	S	S	*	*			trans	-83.6	56.2	164.5	66.1	0	0	0	0	110.6	G261	G261-S265 WeakPolarHBondContact O-CB 3.22Å; G261-S265 PolarHBondContact O-N 3.18Å; G261-S265 PolarHBondContact O-OG 3.36Å
266	I	46.1	Very low	55.7	Low	132 Å²	132	134.4 Å²	134.4	68%	0.677	71%	0.705	S	S	*	*			trans	-104.1	89.9	150	-61.2	175.7	0	0	0	104.1	K264 I268	K264-I266 PolarHBondContact O-N 3.17Å; K264-I266 VanDerWaalsContact O-N 3.11Å; I266-I268 HydrophobicContact CG2-CD1 4.36Å; I266-I268 HydrophobicContact CG2-CG1 3.99Å
267	I	45.3	Very low	54	Low	151 Å²	151	135.9 Å²	135.9	77%	0.774	72%	0.718	S	S	*	*			trans	-107.9	98.3	153	-60.3	178.9	0	0	0	104.1	H269	I267-H269 PolarHBondContact O-N 3.41Å
268	I	55.6	Low	52.9	Low	124 Å²	124	137.2 Å²	137.2	64%	0.636	73%	0.731	S	S	*	*			trans	-58.6	124.4	156.8	-65.5	166.2	0	0	0	105.7	I266	I266-I268 HydrophobicContact CG2-CD1 4.36Å; I266-I268 HydrophobicContact CG2-CG1 3.99Å
269	H	43.5	Very low	51.5	Low	175 Å²	175	137.8 Å²	137.8	81%	0.81	74%	0.74	S	S	*	*			trans	-159.6	106.3	133.7	-85.7	-60.5	0	0	0	108.6	I267	I267-H269 PolarHBondContact O-N 3.41Å
270	T	54.2	Low	50.5	Low	131 Å²	131	140.2 Å²	140.2	80%	0.804	74%	0.744	S	S	*	*			trans	-52.8	126.9	155.5	-26	0	0	0	0	108.8
271	S	45.7	Very low	49.7	Very low	117 Å²	117	135.8 Å²	135.8	82%	0.818	74%	0.738	S	S	*	*			trans	-172.5	136.6	146	-89.5	0	0	0	0	109	D273	S271-D273 PolarHBondContact O-N 2.91Å
272	E	50	Low	49.5	Very low	199 Å²	199	140.3 Å²	140.3	93%	0.93	75%	0.753	S	S	*	*	S	Bend	trans	-53.2	99.1	179.6	-64.9	164.4	129.5	0	0	112.4
273	D	48.9	Very low	49.6	Very low	158 Å²	158	139.6 Å²	139.6	85%	0.845	74%	0.743	S	S	*	*			trans	177.8	88.8	130.2	-120.2	-23	0	0	0	111.1	S271 K275	S271-D273 PolarHBondContact O-N 2.91Å; D273-K275 PolarHBondContact O-N 3.46Å
274	G	55.1	Low	49.7	Very low	81 Å²	81	133.2 Å²	133.2	84%	0.835	72%	0.719	S	S	*	*			trans	58	0.9	130.4	0	0	0	0	0	124.1
275	K	42.3	Very low	50.3	Low	193 Å²	193	131.4 Å²	131.4	84%	0.839	71%	0.707	S	S	*	*			trans	-136.3	92.3	176.6	-70.2	-173.2	-177.7	173.7	0	114.2	D273 Q277	D273-K275 PolarHBondContact O-N 3.46Å; K275-Q277 PolarHBondContact O-N 3.17Å; K275-Q277 VanDerWaalsContact O-N 3.13Å
276	V	48.7	Very low	50.9	Low	140 Å²	140	131.6 Å²	131.6	85%	0.848	70%	0.699	S	S	*	*			trans	-73.3	96.6	167	-178.1	0	0	0	0	109	V278	V276-V278 HydrophobicContact CG1-CG2 4.22Å; V276-V278 PolarHBondContact O-N 2.81Å
277	Q	46	Very low	51.8	Low	173 Å²	173	126.6 Å²	126.6	81%	0.808	67%	0.674	S	S	*	*			trans	-81	108.3	165.1	-81.4	-163.2	-1.9	0	0	109.8	K275 T279	K275-Q277 PolarHBondContact O-N 3.17Å; K275-Q277 VanDerWaalsContact O-N 3.13Å; Q277-T279 PolarHBondContact O-N 3.3Å; Q277-T279 VanDerWaalsContact O-N 3.09Å
278	V	52	Low	52.9	Low	122 Å²	122	124.2 Å²	124.2	74%	0.739	66%	0.662	S	S	*	*			trans	-75.6	92.4	168.8	-178.4	0	0	0	0	108.3	V276 R280	V276-V278 HydrophobicContact CG1-CG2 4.22Å; V276-V278 PolarHBondContact O-N 2.81Å; V278-R280 VanDerWaalsContact C-N 3.31Å; V278-R280 PolarHBondContact O-N 3.19Å
279	T	47.4	Very low	53.8	Low	118 Å²	118	127.2 Å²	127.2	72%	0.724	67%	0.665	S	S	*	*			trans	-70.1	89.9	169.9	-49.7	0	0	0	0	108.4	Q277	Q277-T279 PolarHBondContact O-N 3.3Å; Q277-T279 VanDerWaalsContact O-N 3.09Å
280	R	53.1	Low	55.2	Low	176 Å²	176	123.6 Å²	123.6	66%	0.664	65%	0.651	S	S	*	*			trans	-54.3	125.7	168.3	-100.8	-178.7	159.3	120.5	-4.7	107.8	V278 D282	V278-R280 VanDerWaalsContact C-N 3.31Å; V278-R280 PolarHBondContact O-N 3.19Å; R280-D282 PolarHBondContact O-N 3.06Å
281	P	55.1	Low	56.3	Low	86 Å²	86	118.8 Å²	118.8	56%	0.558	63%	0.625	S	S	*	*			trans	-60.5	128	-176.7	23.5	-32	0	0	0	109.3	Q283 A284	P281-Q283 PolarHBondContact O-N 3.33Å; P281-A284 PolarHBondContact O-N 3.27Å
282	D	55.6	Low	58.1	Low	131 Å²	131	120.3 Å²	120.3	70%	0.701	62%	0.616	S	S	*	*	H	α-helix	trans	-50.6	-26.1	-179.8	-72	-42.5	0	0	0	113	R280 A284 R285 M286	R280-D282 PolarHBondContact O-N 3.06Å; D282-A284 PolarHBondContact O-N 3.25Å; D282-R285 PolarHBondContact O-N 3.42Å; D282-M286 PolarHBondContact O-N 2.88Å; D282-M286 VanDerWaalsContact O-N 3.1Å
283	Q	54.6	Low	59.9	Low	85 Å²	85	114.7 Å²	114.7	40%	0.397	60%	0.596	S	S	.	*	H	α-helix	trans	-58.2	-42.1	174.9	-160.3	66.6	30.8	0	0	113.6	P281 R285 M286 D287	P281-Q283 PolarHBondContact O-N 3.33Å; Q283-R285 VanDerWaalsContact C-N 3.32Å; Q283-R285 PolarHBondContact O-N 3.38Å; Q283-M286 PolarHBondContact O-N 3.4Å; Q283-D287 VanDerWaalsContact O-CG 3.3Å; Q283-D287 PolarHBondContact O-N 3.06Å
284	A	52	Low	61.6	Low	32 Å²	32	108.4 Å²	108.4	26%	0.264	56%	0.562	S	S	.	*	H	α-helix	trans	-70.1	-29.5	179.9	0	0	0	0	0	112.3	P281 D282 I288	P281-A284 PolarHBondContact O-N 3.27Å; D282-A284 PolarHBondContact O-N 3.25Å; A284-I288 WeakPolarHBondContact O-CG1 3.01Å; A284-I288 PolarHBondContact O-N 2.96Å
285	R	58.5	Low	63.2	Low	147 Å²	147	107.9 Å²	107.9	56%	0.555	54%	0.543	S	S	*	.	H	α-helix	trans	-72.4	-36.4	173.9	-67	-179.1	-179.2	-116.6	4.2	111.4	D282 Q283 R289	D282-R285 PolarHBondContact O-N 3.42Å; Q283-R285 VanDerWaalsContact C-N 3.32Å; Q283-R285 PolarHBondContact O-N 3.38Å; R285-R289 WeakPolarHBondContact O-CG 3.37Å; R285-R289 PolarHBondContact O-N 2.68Å; R285-R289 VanDerWaalsContact O-N 3.13Å
286	M	59.3	Low	65.6	Low	92 Å²	92	104 Å²	104	45%	0.453	53%	0.531	S	S	.	.	H	α-helix	trans	-67.6	-41.4	176.4	-169.1	169.1	60.1	0	0	111.6	D282 Q283 I288 R289 L290	D282-M286 PolarHBondContact O-N 2.88Å; D282-M286 VanDerWaalsContact O-N 3.1Å; Q283-M286 PolarHBondContact O-N 3.4Å; M286-I288 PolarHBondContact O-N 2.97Å; M286-R289 PolarHBondContact O-N 3.44Å; M286-L290 HydrophobicContact CG-CD1 4.2Å; M286-L290 WeakPolarHBondContact O-CG 3.3Å; M286-L290 PolarHBondContact O-N 2.98Å
287	D	65.4	Low	67.6	Low	28 Å²	28	100.3 Å²	100.3	15%	0.15	51%	0.505	C	S	.	.	H	α-helix	trans	-62.3	-39.4	177.1	-67	-17.3	0	0	0	112.1	Q283 A291	Q283-D287 VanDerWaalsContact O-CG 3.3Å; Q283-D287 PolarHBondContact O-N 3.06Å; D287-A291 WeakPolarHBondContact O-CB 3.47Å; D287-A291 PolarHBondContact O-N 3.3Å
288	I	67.1	Low	69.8	Low	101 Å²	101	92.7 Å²	92.7	52%	0.518	47%	0.47	S	S	.	.	H	α-helix	trans	-68.7	-41.3	176	-67.5	167.9	0	0	0	111.9	A284 M286 A291 K292	A284-I288 WeakPolarHBondContact O-CG1 3.01Å; A284-I288 PolarHBondContact O-N 2.96Å; M286-I288 PolarHBondContact O-N 2.97Å; I288-A291 PolarHBondContact O-N 2.9Å; I288-K292 WeakPolarHBondContact O-CG 3.46Å; I288-K292 PolarHBondContact O-N 3.45Å
289	R	74.8	Confident	71.8	Confident	186 Å²	186	90.1 Å²	90.1	70%	0.702	46%	0.455	S	S	*	.	H	α-helix	trans	-63.7	-44.2	178.3	-76.1	178.9	-178.1	179.3	0.6	111.4	R285 M286 K292 T293	R285-R289 WeakPolarHBondContact O-CG 3.37Å; R285-R289 PolarHBondContact O-N 2.68Å; R285-R289 VanDerWaalsContact O-N 3.13Å; M286-R289 PolarHBondContact O-N 3.44Å; R289-K292 PolarHBondContact O-N 3.2Å; R289-T293 PolarHBondContact O-N 3.25Å; R289-T293 PolarHBondContact O-OG1 3.06Å
290	L	74.2	Confident	74	Confident	99 Å²	99	88.1 Å²	88.1	52%	0.518	44%	0.442	S	S	.	.	H	α-helix	trans	-62.4	-45.4	175.9	-69	171.6	0	0	0	111.1	M286 K292 T293 L294	M286-L290 HydrophobicContact CG-CD1 4.2Å; M286-L290 WeakPolarHBondContact O-CG 3.3Å; M286-L290 PolarHBondContact O-N 2.98Å; L290-K292 VanDerWaalsContact C-N 3.35Å; L290-K292 PolarHBondContact O-N 3Å; L290-T293 PolarHBondContact O-N 2.98Å; L290-L294 VanDerWaalsContact O-CG 3.31Å; L290-L294 WeakPolarHBondContact O-CG 3.27Å; L290-L294 PolarHBondContact O-N 2.99Å
291	A	76.1	Confident	75.9	Confident	30 Å²	30	80.4 Å²	80.4	25%	0.248	41%	0.414	C	S	.	.	H	α-helix	trans	-59.6	-42.7	177.7	0	0	0	0	0	112.7	L247 D287 I288 T293 L294 V295	L247-A291 HydrophobicContact CD2-CB 3.75Å; D287-A291 WeakPolarHBondContact O-CB 3.47Å; D287-A291 PolarHBondContact O-N 3.3Å; I288-A291 PolarHBondContact O-N 2.9Å; A291-T293 PolarHBondContact O-N 3.45Å; A291-L294 PolarHBondContact O-N 3.43Å; A291-V295 VanDerWaalsContact O-CG2 3.32Å; A291-V295 WeakPolarHBondContact O-CG2 3.23Å; A291-V295 PolarHBondContact O-N 3.2Å
292	K	83.6	Confident	77.7	Confident	149 Å²	149	81.2 Å²	81.2	65%	0.648	41%	0.412	S	S	*	.	H	α-helix	trans	-58.5	-46.1	176.9	-76.7	-177.2	176.7	-169.9	0	112.4	I288 R289 L290 L296	I288-K292 WeakPolarHBondContact O-CG 3.46Å; I288-K292 PolarHBondContact O-N 3.45Å; R289-K292 PolarHBondContact O-N 3.2Å; L290-K292 VanDerWaalsContact C-N 3.35Å; L290-K292 PolarHBondContact O-N 3Å; K292-L296 WeakPolarHBondContact O-CB 3.22Å; K292-L296 PolarHBondContact O-N 2.76Å
293	T	87.6	Confident	79.5	Confident	81 Å²	81	80.3 Å²	80.3	50%	0.497	41%	0.407	S	S	.	.	H	α-helix	trans	-64.2	-41.5	178.2	-55.9	0	0	0	0	111.6	R289 L290 A291 L296 I297	R289-T293 PolarHBondContact O-N 3.25Å; R289-T293 PolarHBondContact O-OG1 3.06Å; L290-T293 PolarHBondContact O-N 2.98Å; A291-T293 PolarHBondContact O-N 3.45Å; T293-L296 PolarHBondContact O-N 3.21Å; T293-I297 HydrophobicContact CG2-CD1 4.04Å; T293-I297 VanDerWaalsContact O-CG1 3.26Å; T293-I297 WeakPolarHBondContact O-CG1 3.29Å; T293-I297 PolarHBondContact O-N 3.36Å
294	L	86.1	Confident	81.4	Confident	26 Å²	26	79.6 Å²	79.6	14%	0.136	41%	0.41	C	S	.	.	H	α-helix	trans	-68.1	-39.9	179.5	-65.9	-178.1	0	0	0	113	Y243 I246 L247 L290 A291 L296 I297 L298	Y243-L294 HydrophobicContact CD1-CD1 4.49Å; Y243-L294 HydrophobicContact CD1-CD2 3.58Å; Y243-L294 HydrophobicContact CD1-CG 4.44Å; Y243-L294 HydrophobicContact CE1-CD2 3.45Å; Y243-L294 VanDerWaalsContact CE1-CD2 3.45Å; I246-L294 HydrophobicContact CB-CD1 4.4Å; I246-L294 HydrophobicContact CG2-CD1 3.37Å; L247-L294 HydrophobicContact CD2-CB 4.05Å; L247-L294 HydrophobicContact CD2-CD1 4.16Å; L247-L294 HydrophobicContact CG-CB 4.42Å; L247-L294 HydrophobicContact CG-CD1 4.47Å; L290-L294 VanDerWaalsContact O-CG 3.31Å; L290-L294 WeakPolarHBondContact O-CG 3.27Å; L290-L294 PolarHBondContact O-N 2.99Å; A291-L294 PolarHBondContact O-N 3.43Å; L294-L296 VanDerWaalsContact C-N 3.35Å; L294-I297 HydrophobicContact CD2-CD1 4.42Å; L294-I297 PolarHBondContact O-N 3.04Å; L294-L298 WeakPolarHBondContact O-CG 3.46Å; L294-L298 PolarHBondContact O-N 3.45Å
295	V	88.6	Confident	83.4	Confident	71 Å²	71	79.5 Å²	79.5	43%	0.43	40%	0.403	S	S	.	.	H	α-helix	trans	-63.7	-43.3	174.4	171.1	0	0	0	0	110.4	L247 A291 I297 L298 V299	L247-V295 HydrophobicContact CD1-CG2 3.89Å; L247-V295 HydrophobicContact CD2-CG2 4.36Å; A291-V295 VanDerWaalsContact O-CG2 3.32Å; A291-V295 WeakPolarHBondContact O-CG2 3.23Å; A291-V295 PolarHBondContact O-N 3.2Å; V295-I297 VanDerWaalsContact C-N 3.34Å; V295-I297 PolarHBondContact O-N 3.06Å; V295-L298 PolarHBondContact O-N 2.94Å; V295-V299 HydrophobicContact CG1-CG2 4.28Å; V295-V299 VanDerWaalsContact O-CG2 3.3Å; V295-V299 WeakPolarHBondContact O-CG2 3.35Å; V295-V299 PolarHBondContact O-N 3.26Å
296	L	91.9	Very high	85	Confident	112 Å²	112	74.1 Å²	74.1	59%	0.586	39%	0.393	S	S	*	.	H	α-helix	trans	-58.2	-46.6	175.3	-179.3	65.6	0	0	0	111.5	K292 T293 L294 L298 V299 V300	K292-L296 WeakPolarHBondContact O-CB 3.22Å; K292-L296 PolarHBondContact O-N 2.76Å; T293-L296 PolarHBondContact O-N 3.21Å; L294-L296 VanDerWaalsContact C-N 3.35Å; L296-L298 VanDerWaalsContact C-N 3.35Å; L296-L298 PolarHBondContact O-N 3.13Å; L296-V299 PolarHBondContact O-N 2.76Å; L296-V300 HydrophobicContact CD1-CG2 4.36Å; L296-V300 WeakPolarHBondContact O-CG2 3.32Å; L296-V300 PolarHBondContact O-N 2.11Å
297	I	91	Very high	86.6	Confident	61 Å²	61	72.8 Å²	72.8	31%	0.313	39%	0.391	S	S	.	.	H	α-helix	trans	-58.8	-46	177.2	-69.3	164.1	0	0	0	111	Y243 T293 L294 V295 V300 L301	Y243-I297 HydrophobicContact CE2-CG2 4.05Å; T293-I297 HydrophobicContact CG2-CD1 4.04Å; T293-I297 VanDerWaalsContact O-CG1 3.26Å; T293-I297 WeakPolarHBondContact O-CG1 3.29Å; T293-I297 PolarHBondContact O-N 3.36Å; L294-I297 HydrophobicContact CD2-CD1 4.42Å; L294-I297 PolarHBondContact O-N 3.04Å; V295-I297 VanDerWaalsContact C-N 3.34Å; V295-I297 PolarHBondContact O-N 3.06Å; I297-V300 PolarHBondContact O-N 2.95Å; I297-L301 WeakPolarHBondContact O-CB 3.21Å; I297-L301 PolarHBondContact O-N 3.31Å
298	L	91.5	Very high	87.8	Confident	13 Å²	13	72.9 Å²	72.9	7%	0.068	39%	0.391	C	S	.	.	H	α-helix	trans	-61.8	-44.1	178.3	-79.7	174.5	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 4.05Å; Y243-L298 HydrophobicContact CD2-CG 4.46Å; Y243-L298 HydrophobicContact CG-CD2 4.34Å; Y243-L298 HydrophobicContact CG-CG 4.45Å; M244-L298 HydrophobicContact CG-CD1 4.42Å; M244-L298 HydrophobicContact SD-CD1 3.95Å; L247-L298 HydrophobicContact CD1-CD1 4.02Å; L294-L298 WeakPolarHBondContact O-CG 3.46Å; L294-L298 PolarHBondContact O-N 3.45Å; V295-L298 PolarHBondContact O-N 2.94Å; L296-L298 VanDerWaalsContact C-N 3.35Å; L296-L298 PolarHBondContact O-N 3.13Å; L298-L301 PolarHBondContact O-N 3.16Å; L298-I302 WeakPolarHBondContact O-CG1 3.43Å; L298-I302 PolarHBondContact O-N 3.37Å; L298-I302 VanDerWaalsContact O-N 3.08Å
299	V	94.1	Very high	89.1	Confident	69 Å²	69	69 Å²	69	42%	0.418	37%	0.372	S	S	.	.	H	α-helix	trans	-63.7	-47	179.8	169.6	0	0	0	0	110.3	V295 L296 L301 I302 I303	V295-V299 HydrophobicContact CG1-CG2 4.28Å; V295-V299 VanDerWaalsContact O-CG2 3.3Å; V295-V299 WeakPolarHBondContact O-CG2 3.35Å; V295-V299 PolarHBondContact O-N 3.26Å; L296-V299 PolarHBondContact O-N 2.76Å; V299-L301 VanDerWaalsContact C-N 3.32Å; V299-L301 PolarHBondContact O-N 3.26Å; V299-I302 PolarHBondContact O-N 3.37Å; V299-I303 HydrophobicContact CG1-CD1 3.57Å; V299-I303 HydrophobicContact CG1-CG1 4.34Å; V299-I303 WeakPolarHBondContact O-CB 3.4Å; V299-I303 VanDerWaalsContact O-CG1 3.31Å; V299-I303 WeakPolarHBondContact O-CG1 3.25Å; V299-I303 PolarHBondContact O-N 3.38Å
300	V	94.3	Very high	89.9	Confident	75 Å²	75	63 Å²	63	46%	0.455	36%	0.362	S	S	.	.	H	α-helix	trans	-60	-43.7	176.9	172.7	0	0	0	0	110.8	L296 I297 I302 I303 C304	L296-V300 HydrophobicContact CD1-CG2 4.36Å; L296-V300 WeakPolarHBondContact O-CG2 3.32Å; L296-V300 PolarHBondContact O-N 2.11Å; I297-V300 PolarHBondContact O-N 2.95Å; V300-I302 VanDerWaalsContact C-N 3.35Å; V300-I302 PolarHBondContact O-N 3.01Å; V300-I303 PolarHBondContact O-N 2.97Å; V300-C304 WeakPolarHBondContact O-CB 3.36Å; V300-C304 PolarHBondContact O-N 3.13Å; V300-C304 PolarHBondContact O-SG 2.91Å
301	L	92.8	Very high	90.8	Very high	14 Å²	14	59.4 Å²	59.4	7%	0.073	34%	0.343	C	S	.	.	H	α-helix	trans	-58.3	-45.6	178.6	-167.8	73.5	0	0	0	112.2	L156 L236 I239 V240 I297 L298 V299 W305	L156-L301 HydrophobicContact CD1-CD1 4.05Å; L236-L301 HydrophobicContact CD2-CD1 3.64Å; L236-L301 HydrophobicContact CD2-CD2 3.98Å; L236-L301 HydrophobicContact CD2-CG 3.92Å; I239-L301 HydrophobicContact CB-CD2 4.25Å; I239-L301 HydrophobicContact CG2-CD2 3.65Å; V240-L301 HydrophobicContact CG2-CD2 4.21Å; I297-L301 WeakPolarHBondContact O-CB 3.21Å; I297-L301 PolarHBondContact O-N 3.31Å; L298-L301 PolarHBondContact O-N 3.16Å; V299-L301 VanDerWaalsContact C-N 3.32Å; V299-L301 PolarHBondContact O-N 3.26Å; L301-W305 WeakPolarHBondContact O-CB 3.34Å; L301-W305 PolarHBondContact O-N 2.99Å
302	I	92.8	Very high	91.5	Very high	103 Å²	103	58.7 Å²	58.7	53%	0.528	34%	0.335	S	S	.	.	H	α-helix	trans	-69.2	-42.4	-179.5	-66.6	168.1	0	0	0	111.2	L298 V299 V300 G306	L298-I302 WeakPolarHBondContact O-CG1 3.43Å; L298-I302 PolarHBondContact O-N 3.37Å; L298-I302 VanDerWaalsContact O-N 3.08Å; V299-I302 PolarHBondContact O-N 3.37Å; V300-I302 VanDerWaalsContact C-N 3.35Å; V300-I302 PolarHBondContact O-N 3.01Å; I302-G306 VanDerWaalsContact O-CA 3.3Å; I302-G306 WeakPolarHBondContact O-CA 3.29Å; I302-G306 PolarHBondContact O-N 3.02Å
303	I	94.4	Very high	92	Very high	113 Å²	113	54.2 Å²	54.2	58%	0.579	32%	0.32	S	S	*	.	H	α-helix	trans	-66.3	-41.2	-179.7	-69.3	173.9	0	0	0	111.1	V299 V300 P307	V299-I303 HydrophobicContact CG1-CD1 3.57Å; V299-I303 HydrophobicContact CG1-CG1 4.34Å; V299-I303 WeakPolarHBondContact O-CB 3.4Å; V299-I303 VanDerWaalsContact O-CG1 3.31Å; V299-I303 WeakPolarHBondContact O-CG1 3.25Å; V299-I303 PolarHBondContact O-N 3.38Å; V300-I303 PolarHBondContact O-N 2.97Å; I303-P307 WeakPolarHBondContact O-CD 3.41Å; I303-P307 WeakPolarHBondContact O-CG 3.5Å
304	C	92.6	Very high	92.2	Very high	69 Å²	69	55.3 Å²	55.3	47%	0.466	32%	0.316	S	S	.	.	H	α-helix	trans	-75.8	-45.7	-178.8	-65.1	0	0	0	0	112.4	V300 L308	V300-C304 WeakPolarHBondContact O-CB 3.36Å; V300-C304 PolarHBondContact O-N 3.13Å; V300-C304 PolarHBondContact O-SG 2.91Å; C304-L308 WeakPolarHBondContact O-CD1 3.44Å
305	W	94.2	Very high	92.3	Very high	31 Å²	31	54.2 Å²	54.2	12%	0.117	31%	0.31	C	S	.	.	H	α-helix	trans	-90.8	-28.5	-173.2	-73	88.5	0	0	0	114.3	F149 V153 W228 T232 L236 L301 L308 L309	F149-W305 HydrophobicContact CB-CH2 4.27Å; F149-W305 AromaticContact CD1-CH2 3.84Å; F149-W305 HydrophobicContact CD1-CH2 3.84Å; F149-W305 HydrophobicContact CD1-CZ2 4.06Å; F149-W305 HydrophobicContact CG-CH2 4.44Å; V153-W305 HydrophobicContact CG2-CD2 4.48Å; V153-W305 HydrophobicContact CG2-CH2 3.3Å; V153-W305 HydrophobicContact CG2-CZ2 3.11Å; V153-W305 HydrophobicContact CG2-CZ3 4.07Å; W228-W305 HydrophobicContact CH2-CZ3 4.09Å; T232-W305 HydrophobicContact CG2-CE3 4.02Å; T232-W305 HydrophobicContact CG2-CH2 4.44Å; T232-W305 HydrophobicContact CG2-CZ3 3.72Å; L236-W305 HydrophobicContact CD1-CB 3.76Å; L236-W305 HydrophobicContact CD1-CD2 3.92Å; L236-W305 HydrophobicContact CD1-CE3 4Å; L236-W305 HydrophobicContact CD1-CG 3.83Å; L236-W305 HydrophobicContact CD2-CD2 4.42Å; L236-W305 HydrophobicContact CD2-CG 4.18Å; L301-W305 WeakPolarHBondContact O-CB 3.34Å; L301-W305 PolarHBondContact O-N 2.99Å; W305-L308 PolarHBondContact O-N 3.22Å; W305-L309 HydrophobicContact CB-CD1 4.44Å; W305-L309 HydrophobicContact CE3-CD1 4.46Å; W305-L309 HydrophobicContact CE3-CG 4.43Å; W305-L309 WeakPolarHBondContact O-CB 3.25Å; W305-L309 WeakPolarHBondContact O-CG 3.48Å; W305-L309 PolarHBondContact O-N 2.86Å
306	G	92.8	Very high	92.3	Very high	34 Å²	34	51.8 Å²	51.8	35%	0.351	30%	0.295	S	S	.	.	H	α-helix	trans	-58.7	-56.1	-174.9	0	0	0	0	0	113.3	I302 L308 L309 A310	I302-G306 VanDerWaalsContact O-CA 3.3Å; I302-G306 WeakPolarHBondContact O-CA 3.29Å; I302-G306 PolarHBondContact O-N 3.02Å; G306-L308 PolarHBondContact O-N 3.48Å; G306-L309 PolarHBondContact O-N 3.06Å; G306-A310 VanDerWaalsContact O-CB 3.28Å; G306-A310 WeakPolarHBondContact O-CB 3.38Å; G306-A310 PolarHBondContact O-N 3.44Å
307	P	92.7	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	-60.4	-43.9	179.1	-23.6	34.5	0	0	0	112.6	I303 A310 I311	I303-P307 WeakPolarHBondContact O-CD 3.41Å; I303-P307 WeakPolarHBondContact O-CG 3.5Å; P307-A310 PolarHBondContact O-N 3.36Å; P307-I311 VanDerWaalsContact O-CG1 3.28Å; P307-I311 WeakPolarHBondContact O-CG1 3.48Å; P307-I311 PolarHBondContact O-N 3.43Å
308	L	91.4	Very high	91.8	Very high	29 Å²	29	52.6 Å²	52.6	15%	0.152	30%	0.3	C	S	.	.	H	α-helix	trans	-58.4	-53.3	179.1	-74.8	174.3	0	0	0	111.7	C304 W305 G306 A310 I311 M312 F328 C331	C304-L308 WeakPolarHBondContact O-CD1 3.44Å; W305-L308 PolarHBondContact O-N 3.22Å; G306-L308 PolarHBondContact O-N 3.48Å; L308-A310 VanDerWaalsContact C-N 3.35Å; L308-A310 PolarHBondContact O-N 3.22Å; L308-I311 PolarHBondContact O-N 2.94Å; L308-M312 VanDerWaalsContact O-CG 3.27Å; L308-M312 WeakPolarHBondContact O-CG 3.48Å; L308-M312 PolarHBondContact O-N 3.13Å; L308-F328 HydrophobicContact CD2-CD2 4.49Å; L308-F328 HydrophobicContact CD2-CE2 4.03Å; L308-C331 HydrophobicContact CD2-CB 3.43Å; L308-C331 VanDerWaalsContact CD2-CB 3.43Å; L308-C331 HydrophobicContact CG-CB 4.23Å
309	L	93.8	Very high	91.3	Very high	20 Å²	20	60.4 Å²	60.4	11%	0.105	33%	0.333	C	S	.	.	H	α-helix	trans	-66.7	-37	-179.4	-68.3	175.1	0	0	0	112	W228 I229 T232 L236 W305 G306 M312 V313	W228-L309 HydrophobicContact CZ3-CD2 4.34Å; I229-L309 HydrophobicContact CG2-CD2 4.42Å; T232-L309 HydrophobicContact CG2-CD2 4.33Å; L236-L309 HydrophobicContact CD1-CD1 3.51Å; W305-L309 HydrophobicContact CB-CD1 4.44Å; W305-L309 HydrophobicContact CE3-CD1 4.46Å; W305-L309 HydrophobicContact CE3-CG 4.43Å; W305-L309 WeakPolarHBondContact O-CB 3.25Å; W305-L309 WeakPolarHBondContact O-CG 3.48Å; W305-L309 PolarHBondContact O-N 2.86Å; G306-L309 PolarHBondContact O-N 3.06Å; L309-M312 PolarHBondContact O-N 2.92Å; L309-V313 WeakPolarHBondContact O-CB 3.27Å; L309-V313 WeakPolarHBondContact O-CG2 3.41Å; L309-V313 PolarHBondContact O-N 3.08Å
310	A	92.6	Very high	90.6	Very high	61 Å²	61	57.9 Å²	57.9	50%	0.504	32%	0.317	S	S	.	.	H	α-helix	trans	-62.6	-43.7	177	0	0	0	0	0	111.9	G306 P307 L308 V313 Y314	G306-A310 VanDerWaalsContact O-CB 3.28Å; G306-A310 WeakPolarHBondContact O-CB 3.38Å; G306-A310 PolarHBondContact O-N 3.44Å; P307-A310 PolarHBondContact O-N 3.36Å; L308-A310 VanDerWaalsContact C-N 3.35Å; L308-A310 PolarHBondContact O-N 3.22Å; A310-V313 PolarHBondContact O-N 3.27Å; A310-Y314 WeakPolarHBondContact O-CB 3.11Å; A310-Y314 PolarHBondContact O-N 3.46Å
311	I	91.6	Very high	90.1	Very high	22 Å²	22	59.2 Å²	59.2	11%	0.113	32%	0.321	C	S	.	.	H	α-helix	trans	-67	-44.6	177.3	-65.7	165.9	0	0	0	110.6	I216 P307 L308 V313 Y314 D315 M320 I324 V327 F328	I216-I311 HydrophobicContact CD1-CG2 3.84Å; P307-I311 VanDerWaalsContact O-CG1 3.28Å; P307-I311 WeakPolarHBondContact O-CG1 3.48Å; P307-I311 PolarHBondContact O-N 3.43Å; L308-I311 PolarHBondContact O-N 2.94Å; I311-V313 VanDerWaalsContact C-N 3.3Å; I311-V313 PolarHBondContact O-N 2.88Å; I311-Y314 WeakPolarHBondContact O-CB 3.48Å; I311-Y314 PolarHBondContact O-N 3.4Å; I311-Y314 VanDerWaalsContact O-N 3.11Å; I311-D315 PolarHBondContact O-N 3.49Å; I311-M320 HydrophobicContact CG2-CE 4.06Å; I311-I324 HydrophobicContact CG1-CG2 4.47Å; I311-I324 HydrophobicContact CG2-CG2 3.94Å; I311-V327 HydrophobicContact CD1-CG1 4.21Å; I311-F328 HydrophobicContact CB-CD2 4.29Å; I311-F328 HydrophobicContact CG2-CB 4.19Å; I311-F328 HydrophobicContact CG2-CD2 3.75Å; I311-F328 HydrophobicContact CG2-CG 4.34Å
312	M	91.7	Very high	89.4	Confident	16 Å²	16	64.9 Å²	64.9	8%	0.079	35%	0.345	C	S	.	.	H	α-helix	trans	-64.1	-34.2	177.8	-68.2	179.7	-173.1	0	0	112.7	F217 W228 I229 L308 L309 D315 F328	F217-M312 HydrophobicContact CE2-CE 4.06Å; F217-M312 HydrophobicContact CE2-CG 4.47Å; F217-M312 HydrophobicContact CE2-SD 4.48Å; F217-M312 HydrophobicContact CZ-CE 3.94Å; W228-M312 HydrophobicContact CE3-SD 4.42Å; W228-M312 HydrophobicContact CZ3-CE 4.36Å; W228-M312 HydrophobicContact CZ3-SD 3.73Å; I229-M312 HydrophobicContact CD1-CB 3.69Å; I229-M312 HydrophobicContact CG1-CB 4.11Å; L308-M312 VanDerWaalsContact O-CG 3.27Å; L308-M312 WeakPolarHBondContact O-CG 3.48Å; L308-M312 PolarHBondContact O-N 3.13Å; L309-M312 PolarHBondContact O-N 2.92Å; M312-D315 WeakPolarHBondContact O-CB 3.43Å; M312-F328 HydrophobicContact CE-CE2 3.78Å; M312-F328 HydrophobicContact CE-CZ 3.84Å; M312-F328 HydrophobicContact CG-CE2 4.1Å
313	V	93.3	Very high	88.9	Confident	55 Å²	55	66.1 Å²	66.1	33%	0.333	35%	0.352	S	S	.	.	H	α-helix	trans	-66.6	-42.8	171.9	165.8	0	0	0	0	110.4	I229 L309 A310 I311 D315 V316 F317	I229-V313 HydrophobicContact CD1-CG2 4.36Å; I229-V313 HydrophobicContact CG2-CG2 3.67Å; L309-V313 WeakPolarHBondContact O-CB 3.27Å; L309-V313 WeakPolarHBondContact O-CG2 3.41Å; L309-V313 PolarHBondContact O-N 3.08Å; A310-V313 PolarHBondContact O-N 3.27Å; I311-V313 VanDerWaalsContact C-N 3.3Å; I311-V313 PolarHBondContact O-N 2.88Å; V313-D315 VanDerWaalsContact C-N 3.28Å; V313-D315 PolarHBondContact O-N 2.84Å; V313-V316 PolarHBondContact O-N 3.24Å; V313-V316 VanDerWaalsContact O-N 3.16Å; V313-F317 HydrophobicContact CG1-CD2 3.72Å; V313-F317 HydrophobicContact CG1-CE2 3.83Å; V313-F317 WeakPolarHBondContact O-CD2 3.14Å; V313-F317 PolarHBondContact O-N 2.94Å
314	Y	92.1	Very high	88.2	Confident	104 Å²	104	62.7 Å²	62.7	41%	0.408	34%	0.335	S	S	.	.	H	α-helix	trans	-62.7	-35.9	178.6	-175.8	-97.1	0	0	0	112.3	A310 I311 V316 F317 G318 M320 I324	A310-Y314 WeakPolarHBondContact O-CB 3.11Å; A310-Y314 PolarHBondContact O-N 3.46Å; I311-Y314 WeakPolarHBondContact O-CB 3.48Å; I311-Y314 PolarHBondContact O-N 3.4Å; I311-Y314 VanDerWaalsContact O-N 3.11Å; Y314-V316 VanDerWaalsContact C-N 3.27Å; Y314-V316 PolarHBondContact O-N 2.9Å; Y314-F317 PolarHBondContact O-N 3.45Å; Y314-G318 WeakPolarHBondContact O-CA 3.42Å; Y314-G318 PolarHBondContact O-N 3.01Å; Y314-M320 HydrophobicContact CD1-SD 3.48Å; Y314-M320 WeakPolarHBondContact CD1-SD 3.28Å; Y314-M320 HydrophobicContact CE1-SD 3.92Å; Y314-I324 HydrophobicContact CD1-CD1 4.07Å; Y314-I324 HydrophobicContact CE1-CD1 3.51Å
315	D	88.7	Confident	87.6	Confident	3 Å²	3	61.2 Å²	61.2	2%	0.016	32%	0.32	C	S	.	.	H	α-helix	trans	-56.3	-37.8	172.7	-173.3	65.1	0	0	0	113	S214 D215 I216 L225 I311 M312 V313 M320	S214-D315 WeakPolarHBondContact CB-OD2 3.45Å; S214-D315 PolarHBondContact OG-OD2 3.32Å; D215-D315 WeakPolarHBondContact CB-OD1 3.42Å; D215-D315 PolarHBondContact N-OD1 2.88Å; I216-D315 HydrophobicContact CD1-CB 3.69Å; I216-D315 HydrophobicContact CG1-CB 4.25Å; I216-D315 WeakPolarHBondContact CG1-OD1 3.36Å; I216-D315 PolarHBondContact N-OD1 3Å; L225-D315 WeakPolarHBondContact CD2-OD2 3.45Å; I311-D315 PolarHBondContact O-N 3.49Å; M312-D315 WeakPolarHBondContact O-CB 3.43Å; V313-D315 VanDerWaalsContact C-N 3.28Å; V313-D315 PolarHBondContact O-N 2.84Å; D315-M320 HydrophobicContact CB-CG 4.24Å; D315-M320 HydrophobicContact CB-SD 4.42Å; D315-M320 WeakPolarHBondContact OD1-CG 3.35Å
316	V	88.1	Confident	86.9	Confident	20 Å²	20	60.7 Å²	60.7	12%	0.121	32%	0.321	C	S	.	.	H	α-helix	trans	-78.5	-28.5	-178.1	175.7	0	0	0	0	112.7	L225 M226 I229 V313 Y314	L225-V316 HydrophobicContact CD2-CG2 3.89Å; L225-V316 HydrophobicContact CG-CG2 4.14Å; M226-V316 HydrophobicContact CE-CG1 3.45Å; M226-V316 VanDerWaalsContact CE-CG1 3.45Å; I229-V316 HydrophobicContact CD1-CG2 4.37Å; V313-V316 PolarHBondContact O-N 3.24Å; V313-V316 VanDerWaalsContact O-N 3.16Å; Y314-V316 VanDerWaalsContact C-N 3.27Å; Y314-V316 PolarHBondContact O-N 2.9Å
317	F	88.3	Confident	86.4	Confident	162 Å²	162	62.4 Å²	62.4	71%	0.711	32%	0.324	S	S	*	.	H	α-helix	trans	-106.7	-15.3	-173.6	-68.1	-66.3	0	0	0	114.3	M226 V313 Y314	M226-F317 HydrophobicContact CE-CZ 4.36Å; V313-F317 HydrophobicContact CG1-CD2 3.72Å; V313-F317 HydrophobicContact CG1-CE2 3.83Å; V313-F317 WeakPolarHBondContact O-CD2 3.14Å; V313-F317 PolarHBondContact O-N 2.94Å; Y314-F317 PolarHBondContact O-N 3.45Å
318	G	84.4	Confident	85.9	Confident	27 Å²	27	60.8 Å²	60.8	28%	0.278	31%	0.311	S	S	.	.	S	Bend	trans	-140	168.6	-172.5	0	0	0	0	0	112.4	Y314	Y314-G318 WeakPolarHBondContact O-CA 3.42Å; Y314-G318 PolarHBondContact O-N 3.01Å
319	K	80.1	Confident	85.2	Confident	178 Å²	178	61.2 Å²	61.2	77%	0.774	32%	0.318	S	S	*	.	P	Polyproline II helix	trans	-85.5	131.5	173.6	-70	-170.2	176.6	-173.4	0	110.3
320	M	79.6	Confident	84.4	Confident	16 Å²	16	64.8 Å²	64.8	8%	0.079	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-82.9	120.6	-176.5	-75.1	-70.1	-69.8	0	0	112.1	D215 I216 I311 Y314 D315 I324 K325	D215-M320 HydrophobicContact CB-CB 4.06Å; D215-M320 HydrophobicContact CB-CG 4.01Å; I216-M320 HydrophobicContact CD1-CE 3.73Å; I216-M320 HydrophobicContact CD1-SD 4.48Å; I216-M320 HydrophobicContact CG1-CE 3.84Å; I311-M320 HydrophobicContact CG2-CE 4.06Å; Y314-M320 HydrophobicContact CD1-SD 3.48Å; Y314-M320 WeakPolarHBondContact CD1-SD 3.28Å; Y314-M320 HydrophobicContact CE1-SD 3.92Å; D315-M320 HydrophobicContact CB-CG 4.24Å; D315-M320 HydrophobicContact CB-SD 4.42Å; D315-M320 WeakPolarHBondContact OD1-CG 3.35Å; M320-I324 HydrophobicContact CE-CB 3.63Å; M320-I324 HydrophobicContact CE-CG2 3.29Å; M320-I324 HydrophobicContact SD-CB 4.21Å; M320-I324 HydrophobicContact SD-CG2 3.82Å; M320-K325 HydrophobicContact CB-CD 4.29Å; M320-K325 HydrophobicContact CB-CG 4.01Å; M320-K325 HydrophobicContact CE-CG 3.92Å
321	N	83.4	Confident	83.5	Confident	102 Å²	102	66.4 Å²	66.4	55%	0.545	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-76.5	152.1	171.6	-66.6	-24.4	0	0	0	111.1	L323 I324 K325	N321-L323 PolarHBondContact O-N 3.04Å; N321-L323 VanDerWaalsContact O-N 3.13Å; N321-I324 HydrophobicContact CB-CD1 4.46Å; N321-I324 HydrophobicContact CB-CG1 4.44Å; N321-I324 PolarHBondContact O-N 2.82Å; N321-K325 PolarHBondContact O-N 2.94Å
322	K	78.8	Confident	83.1	Confident	133 Å²	133	68.7 Å²	68.7	58%	0.578	35%	0.352	S	S	*	.	H	α-helix	trans	-49	-42.6	177.1	-72.9	-171.2	178.9	-172.9	0	112.6	I59 I324 K325 T326	I59-K322 HydrophobicContact CG2-CB 3.91Å; I59-K322 HydrophobicContact CG2-CD 4.26Å; I59-K322 HydrophobicContact CG2-CG 4.03Å; K322-I324 PolarHBondContact O-N 3.49Å; K322-K325 PolarHBondContact O-N 2.81Å; K322-T326 PolarHBondContact O-N 2.79Å; K322-T326 PolarHBondContact O-OG1 2.85Å; K322-T326 VanDerWaalsContact O-OG1 3.06Å
323	L	81.5	Confident	82.6	Confident	129 Å²	129	71.4 Å²	71.4	68%	0.675	37%	0.366	S	S	*	.	H	α-helix	trans	-57.3	-44.3	177.8	179.4	65.4	0	0	0	112.9	N321 T326 V327	N321-L323 PolarHBondContact O-N 3.04Å; N321-L323 VanDerWaalsContact O-N 3.13Å; L323-T326 WeakPolarHBondContact O-CB 3.16Å; L323-T326 PolarHBondContact O-N 3.43Å; L323-V327 WeakPolarHBondContact O-CG2 3.41Å; L323-V327 PolarHBondContact O-N 3.35Å
324	I	81.5	Confident	82.1	Confident	41 Å²	41	72.3 Å²	72.3	21%	0.21	37%	0.368	C	S	.	.	H	α-helix	trans	-71.8	-38.5	-176.4	-52	175.4	0	0	0	109.6	I311 Y314 M320 N321 K322 T326 V327 F328	I311-I324 HydrophobicContact CG1-CG2 4.47Å; I311-I324 HydrophobicContact CG2-CG2 3.94Å; Y314-I324 HydrophobicContact CD1-CD1 4.07Å; Y314-I324 HydrophobicContact CE1-CD1 3.51Å; M320-I324 HydrophobicContact CE-CB 3.63Å; M320-I324 HydrophobicContact CE-CG2 3.29Å; M320-I324 HydrophobicContact SD-CB 4.21Å; M320-I324 HydrophobicContact SD-CG2 3.82Å; N321-I324 HydrophobicContact CB-CD1 4.46Å; N321-I324 HydrophobicContact CB-CG1 4.44Å; N321-I324 PolarHBondContact O-N 2.82Å; K322-I324 PolarHBondContact O-N 3.49Å; I324-T326 VanDerWaalsContact C-N 3.31Å; I324-T326 PolarHBondContact O-N 2.79Å; I324-V327 PolarHBondContact O-N 3.22Å; I324-F328 WeakPolarHBondContact O-CB 3.21Å; I324-F328 PolarHBondContact O-N 3.41Å
325	K	79.4	Confident	81.5	Confident	38 Å²	38	70.5 Å²	70.5	17%	0.165	37%	0.365	C	S	.	.	H	α-helix	trans	-60.8	-40.4	172.6	-61.9	-171.1	179.1	-161.8	0	111.4	I59 D215 M320 N321 K322 F328 A329	I59-K325 HydrophobicContact CD1-CB 3.68Å; I59-K325 HydrophobicContact CD1-CD 3.34Å; I59-K325 HydrophobicContact CD1-CG 4.08Å; D215-K325 WeakPolarHBondContact O-CE 3.21Å; D215-K325 PolarHBondContact O-NZ 3.03Å; D215-K325 IonicContact OD1-NZ 2.79Å; D215-K325 PolarHBondContact OD1-NZ 3.25Å; M320-K325 HydrophobicContact CB-CD 4.29Å; M320-K325 HydrophobicContact CB-CG 4.01Å; M320-K325 HydrophobicContact CE-CG 3.92Å; N321-K325 PolarHBondContact O-N 2.94Å; K322-K325 PolarHBondContact O-N 2.81Å; K325-F328 PolarHBondContact O-N 2.76Å; K325-A329 PolarHBondContact O-N 3.49Å
326	T	78.8	Confident	81	Confident	21 Å²	21	74.7 Å²	74.7	13%	0.129	39%	0.387	C	S	.	.	H	α-helix	trans	-63.7	-46.6	173.5	-53.9	0	0	0	0	112	K322 L323 I324 F328 A329 F330	K322-T326 PolarHBondContact O-N 2.79Å; K322-T326 PolarHBondContact O-OG1 2.85Å; K322-T326 VanDerWaalsContact O-OG1 3.06Å; L323-T326 WeakPolarHBondContact O-CB 3.16Å; L323-T326 PolarHBondContact O-N 3.43Å; I324-T326 VanDerWaalsContact C-N 3.31Å; I324-T326 PolarHBondContact O-N 2.79Å; T326-F328 VanDerWaalsContact C-N 3.3Å; T326-F328 PolarHBondContact O-N 3.23Å; T326-A329 WeakPolarHBondContact O-CB 3.3Å; T326-A329 PolarHBondContact O-N 3.1Å; T326-F330 HydrophobicContact CG2-CD2 4.34Å; T326-F330 HydrophobicContact CG2-CE2 3.98Å; T326-F330 VanDerWaalsContact O-CD2 3.29Å; T326-F330 WeakPolarHBondContact O-CD2 3.35Å
327	V	82.8	Confident	80.5	Confident	69 Å²	69	78.3 Å²	78.3	42%	0.418	41%	0.405	S	S	.	.	H	α-helix	trans	-59.9	-42.1	178	170.4	0	0	0	0	111.2	I311 L323 I324 A329 F330 C331	I311-V327 HydrophobicContact CD1-CG1 4.21Å; L323-V327 WeakPolarHBondContact O-CG2 3.41Å; L323-V327 PolarHBondContact O-N 3.35Å; I324-V327 PolarHBondContact O-N 3.22Å; V327-A329 VanDerWaalsContact C-N 3.29Å; V327-A329 PolarHBondContact O-N 3.05Å; V327-F330 PolarHBondContact O-N 3.05Å; V327-F330 VanDerWaalsContact O-N 3.13Å; V327-C331 PolarHBondContact O-N 2.79Å; V327-C331 PolarHBondContact O-SG 2.84Å
328	F	81.9	Confident	80	Confident	30 Å²	30	72.4 Å²	72.4	13%	0.132	38%	0.383	C	S	.	.	H	α-helix	trans	-59	-39.9	176.6	-176.8	-95.5	0	0	0	112.3	I216 F217 L308 I311 M312 I324 K325 T326 F330 C331	I216-F328 HydrophobicContact CD1-CD2 4.22Å; I216-F328 HydrophobicContact CD1-CG 4.29Å; I216-F328 HydrophobicContact CG2-CD1 3.51Å; I216-F328 HydrophobicContact CG2-CE1 3.27Å; I216-F328 HydrophobicContact CG2-CE2 4.32Å; I216-F328 HydrophobicContact CG2-CG 4.15Å; I216-F328 HydrophobicContact CG2-CZ 3.73Å; F217-F328 HydrophobicContact CE1-CE1 4.25Å; F217-F328 HydrophobicContact CE1-CZ 4.24Å; F217-F328 HydrophobicContact CE2-CZ 4.09Å; F217-F328 AromaticContact CZ-CE1 3.97Å; F217-F328 HydrophobicContact CZ-CE1 3.97Å; F217-F328 AromaticContact CZ-CZ 3.54Å; F217-F328 HydrophobicContact CZ-CZ 3.54Å; L308-F328 HydrophobicContact CD2-CD2 4.49Å; L308-F328 HydrophobicContact CD2-CE2 4.03Å; I311-F328 HydrophobicContact CB-CD2 4.29Å; I311-F328 HydrophobicContact CG2-CB 4.19Å; I311-F328 HydrophobicContact CG2-CD2 3.75Å; I311-F328 HydrophobicContact CG2-CG 4.34Å; M312-F328 HydrophobicContact CE-CE2 3.78Å; M312-F328 HydrophobicContact CE-CZ 3.84Å; M312-F328 HydrophobicContact CG-CE2 4.1Å; I324-F328 WeakPolarHBondContact O-CB 3.21Å; I324-F328 PolarHBondContact O-N 3.41Å; K325-F328 PolarHBondContact O-N 2.76Å; T326-F328 VanDerWaalsContact C-N 3.3Å; T326-F328 PolarHBondContact O-N 3.23Å; F328-F330 PolarHBondContact O-N 3.46Å; F328-C331 PolarHBondContact O-N 3.42Å
329	A	77.6	Confident	79.6	Confident	38 Å²	38	75.8 Å²	75.8	31%	0.314	39%	0.391	S	S	.	.	H	α-helix	trans	-63.2	-23.2	178.6	0	0	0	0	0	113.9	L60 I68 K325 T326 V327	L60-A329 HydrophobicContact CD1-CB 3.82Å; L60-A329 HydrophobicContact CD2-CB 4.05Å; L60-A329 HydrophobicContact CG-CB 4.49Å; I68-A329 HydrophobicContact CD1-CB 4.17Å; K325-A329 PolarHBondContact O-N 3.49Å; T326-A329 WeakPolarHBondContact O-CB 3.3Å; T326-A329 PolarHBondContact O-N 3.1Å; V327-A329 VanDerWaalsContact C-N 3.29Å; V327-A329 PolarHBondContact O-N 3.05Å
330	F	76.1	Confident	79.6	Confident	95 Å²	95	67.3 Å²	67.3	42%	0.417	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-9.2	175.8	-76.9	-82.2	0	0	0	113.9	Q64 I68 T326 V327 F328	Q64-F330 HydrophobicContact CB-CE2 4.48Å; Q64-F330 HydrophobicContact CB-CZ 4.01Å; Q64-F330 HydrophobicContact CG-CZ 4.2Å; I68-F330 HydrophobicContact CD1-CD1 3.77Å; I68-F330 HydrophobicContact CD1-CD2 4.01Å; I68-F330 HydrophobicContact CD1-CE1 3.68Å; I68-F330 HydrophobicContact CD1-CE2 3.91Å; I68-F330 HydrophobicContact CD1-CG 3.93Å; I68-F330 HydrophobicContact CD1-CZ 3.74Å; I68-F330 HydrophobicContact CG1-CD1 3.51Å; I68-F330 HydrophobicContact CG1-CE1 3.25Å; I68-F330 HydrophobicContact CG1-CE2 4.38Å; I68-F330 HydrophobicContact CG1-CG 4.2Å; I68-F330 HydrophobicContact CG1-CZ 3.73Å; T326-F330 HydrophobicContact CG2-CD2 4.34Å; T326-F330 HydrophobicContact CG2-CE2 3.98Å; T326-F330 VanDerWaalsContact O-CD2 3.29Å; T326-F330 WeakPolarHBondContact O-CD2 3.35Å; V327-F330 PolarHBondContact O-N 3.05Å; V327-F330 VanDerWaalsContact O-N 3.13Å; F328-F330 PolarHBondContact O-N 3.46Å
331	C	74.1	Confident	79.6	Confident	96 Å²	96	72 Å²	72	65%	0.649	39%	0.385	S	S	*	.			trans	-88.6	0	179.9	-62.9	0	0	0	0	110.8	L308 V327 F328	L308-C331 HydrophobicContact CD2-CB 3.43Å; L308-C331 VanDerWaalsContact CD2-CB 3.43Å; L308-C331 HydrophobicContact CG-CB 4.23Å; V327-C331 PolarHBondContact O-N 2.79Å; V327-C331 PolarHBondContact O-SG 2.84Å; F328-C331 PolarHBondContact O-N 3.42Å

Retrieved 331 of 331 residues in 382.3 ms (Link to these results)

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