A0A096NYS7_PAPAN Loading...

Regulator of G protein signaling 17

AlphaFold DB (Q9UGC6), UniProt , Accession A0A096NYS7, Species PAPAN (Papio anubis, Olive baboon), Gene RGS17, Length 210 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	52.3	Low	45.8	Very low	236 Å²	236	174.8 Å²	174.8	100%	1.163	85%	0.852	S	S	*	*				0	100.2	0	-71.5	171.5	167.1	0	0	107.1
2	R	47.9	Very low	45.4	Very low	238 Å²	238	171.9 Å²	171.9	90%	0.898	85%	0.853	S	S	*	*				57.1	123.9	102.1	-80.6	-176.4	179.5	169.7	0.4	112
3	K	43.4	Very low	45.6	Very low	187 Å²	187	167.9 Å²	167.9	81%	0.813	85%	0.847	S	S	*	*			cis	-165.8	137.2	21	-87.2	160.5	166.9	-177	0	105.5
4	R	43.9	Very low	45.7	Very low	210 Å²	210	163.6 Å²	163.6	79%	0.792	85%	0.85	S	S	*	*				53.1	116.7	62.7	-126	-173.7	-171.5	-176.3	2.5	116.1
5	Q	51.3	Low	45.3	Very low	201 Å²	201	161 Å²	161	94%	0.939	84%	0.843	S	S	*	*			trans	-160.3	131.7	136.5	-113.3	169.4	26.7	0	0	113.4
6	Q	46.6	Very low	45.3	Very low	150 Å²	150	158.9 Å²	158.9	70%	0.701	85%	0.846	S	S	*	*			trans	-98.8	169.6	176.5	-75.5	166.2	-50.9	0	0	110
7	S	47.2	Very low	45	Very low	103 Å²	103	159.8 Å²	159.8	72%	0.72	84%	0.844	S	S	*	*			trans	158.4	145.4	134.6	-72.1	0	0	0	0	108.9
8	Q	45.3	Very low	44.7	Very low	187 Å²	187	156.2 Å²	156.2	87%	0.874	84%	0.841	S	S	*	*			cis	-167	173.4	6.8	-114.7	166.6	-10.1	0	0	109.4
9	N	39.8	Very low	44.5	Very low	149 Å²	149	154.6 Å²	154.6	80%	0.797	84%	0.84	S	S	*	*			trans	-108.4	177.5	-159.3	-173.2	31.6	0	0	0	112.6
10	E	40.3	Very low	43.9	Very low	182 Å²	182	150.7 Å²	150.7	85%	0.85	84%	0.837	S	S	*	*			trans	113	125	146.9	-58.7	-166.1	112.4	0	0	120.2
11	G	45.2	Very low	43.8	Very low	80 Å²	80	151.5 Å²	151.5	83%	0.825	84%	0.84	S	S	*	*			trans	152	74.6	156.2	0	0	0	0	0	117.8
12	T	40.9	Very low	43.1	Very low	140 Å²	140	149 Å²	149	86%	0.859	83%	0.826	S	S	*	*			trans	-96.3	-178.7	158	42.1	0	0	0	0	110.2
13	P	48.4	Very low	42.9	Very low	120 Å²	120	149.3 Å²	149.3	78%	0.779	83%	0.826	S	S	*	*			cis	-137.5	177	-0.2	35.1	-13.8	0	0	0	115.3
14	A	46.8	Very low	43.1	Very low	107 Å²	107	145.3 Å²	145.3	88%	0.884	82%	0.82	S	S	*	*			trans	-169.5	133.5	142	0	0	0	0	0	112.2
15	V	39.9	Very low	43.1	Very low	125 Å²	125	142.5 Å²	142.5	76%	0.758	82%	0.82	S	S	*	*			trans	-98.1	141.8	-175	165.3	0	0	0	0	110.5
16	S	45	Very low	43	Very low	127 Å²	127	140.2 Å²	140.2	89%	0.888	82%	0.815	S	S	*	*			trans	-166.6	147.6	142.6	-84.2	0	0	0	0	112.1
17	Q	40	Very low	43.2	Very low	174 Å²	174	140 Å²	140	81%	0.813	82%	0.824	S	S	*	*			trans	-98.5	146.5	-153	-64.8	164.1	-20.5	0	0	114.5
18	A	40.9	Very low	43.3	Very low	95 Å²	95	140 Å²	140	79%	0.785	82%	0.823	S	S	*	*			trans	40.1	152.7	134	0	0	0	0	0	121.6
19	P	40.8	Very low	43.9	Very low	127 Å²	127	136.3 Å²	136.3	83%	0.825	82%	0.816	S	S	*	*			cis	-143.4	158.9	35.1	37.6	-16	0	0	0	118.8
20	G	32.5	Very low	44.3	Very low	75 Å²	75	140 Å²	140	77%	0.773	83%	0.825	S	S	*	*			trans	66.1	104.1	136.5	0	0	0	0	0	119.8
21	N	40.4	Very low	44.6	Very low	168 Å²	168	136.4 Å²	136.4	90%	0.898	82%	0.819	S	S	*	*				-154.8	118.7	122.2	-139.3	2	0	0	0	111.7
22	Q	37.5	Very low	44.5	Very low	185 Å²	185	145.1 Å²	145.1	86%	0.864	83%	0.828	S	S	*	*			trans	-76.3	128.8	177.5	-63.7	165.3	-6.2	0	0	108.5
23	R	45.1	Very low	44.8	Very low	243 Å²	243	143.2 Å²	143.2	92%	0.917	82%	0.819	S	S	*	*			trans	-116.1	110.7	162.8	-138.3	177.2	-168.5	-175.6	2.4	107.3
24	P	47.1	Very low	44.4	Very low	104 Å²	104	142.8 Å²	142.8	68%	0.675	82%	0.817	S	S	*	*			trans	-76.7	144.4	-171.5	30.3	-32	0	0	0	111	N26	P24-N26 PolarHBondContact O-N 2.9Å
25	N	43.8	Very low	44.1	Very low	150 Å²	150	143.2 Å²	143.2	80%	0.802	81%	0.813	S	S	*	*			trans	-53.4	111.3	167.6	-65.3	-35.2	0	0	0	110.6
26	N	49.7	Very low	44.1	Very low	154 Å²	154	142.7 Å²	142.7	82%	0.824	81%	0.813	S	S	*	*			trans	-111.9	58.4	164.9	-81.5	5.4	0	0	0	109.9	P24	P24-N26 PolarHBondContact O-N 2.9Å
27	T	51.1	Low	44	Very low	144 Å²	144	142.6 Å²	142.6	88%	0.883	81%	0.813	S	S	*	*			trans	-98.9	75.3	163.3	-41.6	0	0	0	0	106.9
28	C	49.3	Very low	44	Very low	104 Å²	104	138.7 Å²	138.7	70%	0.703	80%	0.803	S	S	*	*			trans	-116.7	141.2	169	113.7	0	0	0	0	109.6
29	C	57.7	Low	44.3	Very low	109 Å²	109	139.4 Å²	139.4	74%	0.736	80%	0.803	S	S	*	*			trans	93.5	54.8	151.6	-47.4	0	0	0	0	116.3	C31	C29-C31 PolarHBondContact O-N 3.38Å
30	F	47.6	Very low	44.3	Very low	226 Å²	226	138.4 Å²	138.4	99%	0.991	80%	0.798	S	S	*	*			trans	-69.6	93	138.6	-95.3	-96.3	0	0	0	107.9
31	C	47.1	Very low	45	Very low	107 Å²	107	143.2 Å²	143.2	72%	0.723	81%	0.805	S	S	*	*			trans	-147.2	119.2	166.8	-157.2	0	0	0	0	110.2	C29 C33	C29-C31 PolarHBondContact O-N 3.38Å; C31-C33 PolarHBondContact O-N 3.48Å; C31-C33 VanDerWaalsContact O-N 3.16Å
32	W	43.8	Very low	44.9	Very low	264 Å²	264	141.1 Å²	141.1	100%	1	80%	0.798	S	S	*	*			trans	-84.8	37.3	-175.1	-152.2	-48.8	0	0	0	112
33	C	47.2	Very low	45.3	Very low	99 Å²	99	138.7 Å²	138.7	67%	0.669	80%	0.795	S	S	*	*	S	Bend	trans	-153.3	124.4	-179.5	-153.6	0	0	0	0	112.4	C31	C31-C33 PolarHBondContact O-N 3.48Å; C31-C33 VanDerWaalsContact O-N 3.16Å
34	C	39.4	Very low	45.5	Very low	111 Å²	111	138.3 Å²	138.3	75%	0.75	79%	0.794	S	S	*	*			trans	32.2	131.1	147.6	-97.3	0	0	0	0	120.8
35	C	40.1	Very low	44.9	Very low	117 Å²	117	140.4 Å²	140.4	79%	0.791	80%	0.8	S	S	*	*			trans	70.5	85.6	145	-58.7	0	0	0	0	116.6
36	C	41	Very low	45	Very low	113 Å²	113	141.3 Å²	141.3	76%	0.764	80%	0.799	S	S	*	*			trans	-151.5	104.8	151.3	-117.2	0	0	0	0	111.9	C38	C36-C38 PolarHBondContact O-N 3.16Å
37	S	42.3	Very low	44.7	Very low	126 Å²	126	141.9 Å²	141.9	88%	0.881	80%	0.797	S	S	*	*			trans	-64.4	85.5	157.1	-62.3	0	0	0	0	108.7	S39	S37-S39 PolarHBondContact O-N 3.33Å
38	C	40.1	Very low	44.2	Very low	91 Å²	91	146.9 Å²	146.9	62%	0.615	80%	0.799	S	S	*	*			trans	-89.1	103.7	176.5	-86	0	0	0	0	111	C36 C40	C36-C38 PolarHBondContact O-N 3.16Å; C38-C40 PolarHBondContact O-N 3.34Å
39	S	46.1	Very low	43.7	Very low	110 Å²	110	145.3 Å²	145.3	77%	0.769	80%	0.801	S	S	*	*			trans	-72.1	37.5	174.1	-54.2	0	0	0	0	114.4	S37 L41	S37-S39 PolarHBondContact O-N 3.33Å; S39-L41 PolarHBondContact O-N 3.49Å
40	C	41.9	Very low	42.8	Very low	107 Å²	107	148.7 Å²	148.7	72%	0.723	81%	0.806	S	S	*	*			trans	-90.7	15.1	-163.5	-58.9	0	0	0	0	116.4	C38	C38-C40 PolarHBondContact O-N 3.34Å
41	L	46.2	Very low	42.5	Very low	175 Å²	175	145.3 Å²	145.3	92%	0.916	80%	0.799	S	S	*	*			trans	-134.6	65.2	177.2	-84.6	157.2	0	0	0	111.3	S39	S39-L41 PolarHBondContact O-N 3.49Å
42	T	39.1	Very low	42.3	Very low	124 Å²	124	145 Å²	145	76%	0.761	80%	0.803	S	S	*	*			trans	-112.5	113.6	156.9	52.7	0	0	0	0	107.3
43	V	45.9	Very low	41.8	Very low	134 Å²	134	136.3 Å²	136.3	81%	0.812	80%	0.796	S	S	*	*			trans	175.6	128.6	148.6	149	0	0	0	0	109.4
44	R	48.2	Very low	41.3	Very low	236 Å²	236	143 Å²	143	89%	0.891	81%	0.807	S	S	*	*			trans	86.2	76.9	167	-78.4	166.7	174.8	-179.9	-2.4	118.8
45	N	35.9	Very low	41.5	Very low	148 Å²	148	143.2 Å²	143.2	79%	0.791	81%	0.807	S	S	*	*			trans	-52.3	129.6	136.1	-171.8	24.3	0	0	0	110.5
46	E	44.6	Very low	41.7	Very low	168 Å²	168	143.2 Å²	143.2	79%	0.785	80%	0.804	S	S	*	*				179.9	123.2	126.6	-100.1	178.9	153.5	0	0	111.9
47	E	43.3	Very low	42	Very low	167 Å²	167	146.4 Å²	146.4	78%	0.78	81%	0.807	S	S	*	*			trans	77.1	123.7	153.3	-54.3	-162.3	159.7	0	0	121.2
48	R	41.3	Very low	42.1	Very low	248 Å²	248	145.1 Å²	145.1	94%	0.936	79%	0.794	S	S	*	*			trans	101.1	115.7	139.5	-140.7	177.9	-124.9	-113.9	1.5	116.3
49	G	39	Very low	42.5	Very low	72 Å²	72	145 Å²	145	74%	0.742	79%	0.791	S	S	*	*			trans	128.1	93.6	150.6	0	0	0	0	0	115
50	E	39.4	Very low	42.6	Very low	180 Å²	180	148.7 Å²	148.7	84%	0.841	79%	0.793	S	S	*	*			trans	-25.5	148.8	158.1	-67	154.7	107.7	0	0	117.4
51	N	40.4	Very low	43.1	Very low	155 Å²	155	144.9 Å²	144.9	83%	0.829	77%	0.765	S	S	*	*			trans	101.1	120.1	150.5	-67.7	-26.2	0	0	0	120.4
52	A	43.1	Very low	43	Very low	100 Å²	100	143.3 Å²	143.3	83%	0.826	75%	0.753	S	S	*	*			trans	81.5	113.3	145.5	0	0	0	0	0	117.6
53	G	33.9	Very low	43.2	Very low	82 Å²	82	141.6 Å²	141.6	85%	0.845	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-56.1	133.8	-178.4	0	0	0	0	0	113.3
54	R	35.6	Very low	43.6	Very low	240 Å²	240	136.7 Å²	136.7	91%	0.906	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-87.2	116.7	173.3	-171.1	171.3	-175.5	-177.2	0.5	108.5	T56	R54-T56 PolarHBondContact O-N 3.12Å
55	P	43.4	Very low	43.6	Very low	115 Å²	115	130.5 Å²	130.5	75%	0.747	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-72.1	131	172.8	17.3	-9.1	0	0	0	108.9	H57	P55-H57 PolarHBondContact O-N 2.76Å
56	T	45.5	Very low	44.5	Very low	117 Å²	117	128.1 Å²	128.1	72%	0.718	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-52.2	130.3	166.9	38.7	0	0	0	0	109.8	R54 T58	R54-T56 PolarHBondContact O-N 3.12Å; T56-T58 PolarHBondContact O-N 3.35Å
57	H	46.4	Very low	45.2	Very low	179 Å²	179	125 Å²	125	83%	0.829	68%	0.675	S	S	*	*			trans	-69.8	75.1	179.3	-161.1	-88.9	0	0	0	110	P55 T59	P55-H57 PolarHBondContact O-N 2.76Å; H57-T59 PolarHBondContact O-N 3.1Å
58	T	44.2	Very low	46.1	Very low	100 Å²	100	120.1 Å²	120.1	61%	0.613	65%	0.652	S	S	*	*			trans	-76.5	112	164.9	51.6	0	0	0	0	106.9	T56 K60	T56-T58 PolarHBondContact O-N 3.35Å; T58-K60 PolarHBondContact O-N 3.47Å; T58-K60 VanDerWaalsContact O-N 3.12Å
59	T	48.1	Very low	47	Very low	88 Å²	88	117.4 Å²	117.4	54%	0.54	65%	0.65	S	S	.	*			trans	-56.9	114	174.8	22	0	0	0	0	109.2	H57 M61	H57-T59 PolarHBondContact O-N 3.1Å; T59-M61 PolarHBondContact O-N 3.15Å
60	K	49.6	Very low	48.3	Very low	187 Å²	187	116.3 Å²	116.3	81%	0.813	63%	0.63	S	S	*	*	S	Bend	trans	-72	24.8	-173.1	-75.1	-179.2	174.2	177	0	114.8	T58	T58-K60 PolarHBondContact O-N 3.47Å; T58-K60 VanDerWaalsContact O-N 3.12Å
61	M	51.1	Low	49.9	Very low	28 Å²	28	116.3 Å²	116.3	14%	0.138	63%	0.63	C	S	.	*			trans	-113.7	44	175.3	-159.3	102.4	95.3	0	0	111.3	T59 S63 I64 M135	T59-M61 PolarHBondContact O-N 3.15Å; M61-S63 PolarHBondContact O-N 2.95Å; M61-I64 HydrophobicContact CE-CD1 3.8Å; M61-I64 HydrophobicContact CG-CB 4.36Å; M61-I64 HydrophobicContact CG-CD1 3.88Å; M61-I64 HydrophobicContact CG-CG1 3.97Å; M61-I64 HydrophobicContact SD-CD1 3.57Å; M61-I64 VanDerWaalsContact SD-CD1 3.57Å; M61-I64 HydrophobicContact SD-CG1 4.06Å; M61-M135 HydrophobicContact CB-CE 3.79Å; M61-M135 HydrophobicContact CE-CB 3.75Å; M61-M135 HydrophobicContact CE-CE 3.92Å; M61-M135 HydrophobicContact CG-CE 4.19Å; M61-M135 HydrophobicContact SD-CE 3.36Å; M61-M135 WeakPolarHBondContact SD-CE 3.45Å; M61-M135 HydrophobicContact SD-SD 4.33Å
62	E	44.6	Very low	51.8	Low	142 Å²	142	116.6 Å²	116.6	66%	0.664	63%	0.632	S	S	*	*	G	3₁₀ helix	trans	-70.5	-13.3	162.7	-78.5	177.1	141	0	0	111.8	I64 Q65	E62-I64 PolarHBondContact O-N 3.39Å; E62-Q65 WeakPolarHBondContact O-CB 3.41Å; E62-Q65 PolarHBondContact O-N 3.23Å; E62-Q65 VanDerWaalsContact O-N 3.13Å
63	S	44.6	Very low	53.9	Low	87 Å²	87	112.5 Å²	112.5	61%	0.608	60%	0.596	S	S	*	*	G	3₁₀ helix	trans	-70.2	-20.6	-178.1	23.6	0	0	0	0	115.1	M61	M61-S63 PolarHBondContact O-N 2.95Å
64	I	54.3	Low	56.5	Low	31 Å²	31	112.4 Å²	112.4	16%	0.159	58%	0.579	C	S	.	*	G	3₁₀ helix	trans	-91.6	-2.5	173.7	-56.2	179	0	0	0	111.4	M61 E62 V66 A116	M61-I64 HydrophobicContact CE-CD1 3.8Å; M61-I64 HydrophobicContact CG-CB 4.36Å; M61-I64 HydrophobicContact CG-CD1 3.88Å; M61-I64 HydrophobicContact CG-CG1 3.97Å; M61-I64 HydrophobicContact SD-CD1 3.57Å; M61-I64 VanDerWaalsContact SD-CD1 3.57Å; M61-I64 HydrophobicContact SD-CG1 4.06Å; E62-I64 PolarHBondContact O-N 3.39Å; I64-V66 PolarHBondContact O-N 3.01Å; I64-A116 HydrophobicContact CD1-CB 3.9Å
65	Q	48.3	Very low	59.1	Low	107 Å²	107	101.7 Å²	101.7	50%	0.5	54%	0.542	S	S	.	.			trans	-73.9	-12.3	176.9	-61.8	-170.3	11.8	0	0	113.6	E62 L67 R99	E62-Q65 WeakPolarHBondContact O-CB 3.41Å; E62-Q65 PolarHBondContact O-N 3.23Å; E62-Q65 VanDerWaalsContact O-N 3.13Å; Q65-L67 PolarHBondContact O-N 3.01Å; Q65-L67 VanDerWaalsContact O-N 3.1Å; Q65-R99 PolarHBondContact O-NH1 3.01Å
66	V	53.2	Low	61.3	Low	98 Å²	98	103.9 Å²	103.9	59%	0.594	54%	0.543	S	S	*	.			trans	-59.9	112.6	-177	-175.4	0	0	0	0	109.5	I64 E68	I64-V66 PolarHBondContact O-N 3.01Å; V66-E68 PolarHBondContact O-N 3.23Å; V66-E68 VanDerWaalsContact O-N 3.11Å
67	L	59.6	Low	63.6	Low	103 Å²	103	101.4 Å²	101.4	54%	0.539	52%	0.523	S	S	.	.	P	Polyproline II helix	trans	-51.8	116.6	159.4	-76.1	160.2	0	0	0	106	Q65 E69 N96	Q65-L67 PolarHBondContact O-N 3.01Å; Q65-L67 VanDerWaalsContact O-N 3.1Å; L67-E69 PolarHBondContact O-N 3.41Å; L67-N96 HydrophobicContact CD2-CB 3.97Å; L67-N96 WeakPolarHBondContact CD2-OD1 3.29Å
68	E	62.2	Low	65.7	Low	63 Å²	63	92.9 Å²	92.9	29%	0.294	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-58.4	131.6	-179.8	-69.6	175.4	110.9	0	0	108.2	V66 C70 P92 R95 N96	V66-E68 PolarHBondContact O-N 3.23Å; V66-E68 VanDerWaalsContact O-N 3.11Å; E68-C70 PolarHBondContact O-N 2.93Å; E68-C70 PolarHBondContact O-SG 3.15Å; E68-P92 HydrophobicContact CB-CB 3.95Å; E68-R95 IonicContact OE1-CZ 3.89Å; E68-R95 IonicContact OE1-NE 2.94Å; E68-R95 IonicContact OE1-NH2 3.91Å; E68-R95 PolarHBondContact OE1-NH2 3Å; E68-R95 IonicContact OE2-CZ 3.73Å; E68-R95 IonicContact OE2-NE 3.9Å; E68-R95 PolarHBondContact OE2-NE 3.08Å; E68-R95 IonicContact OE2-NH2 2.79Å; E68-R95 PolarHBondContact OE2-NH2 3.42Å; E68-N96 PolarHBondContact N-OD1 3.37Å; E68-N96 PolarHBondContact O-ND2 3.06Å
69	E	60	Low	68	Low	192 Å²	192	92.5 Å²	92.5	90%	0.897	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-62	120	178.6	-69.6	178.8	174.5	0	0	109	L67	L67-E69 PolarHBondContact O-N 3.41Å
70	C	66	Low	70.2	Confident	48 Å²	48	89.7 Å²	89.7	32%	0.324	46%	0.461	S	S	.	.			trans	-112.8	143.9	-171.9	-62.9	0	0	0	0	111.8	E68 P92 A93 N96	E68-C70 PolarHBondContact O-N 2.93Å; E68-C70 PolarHBondContact O-SG 3.15Å; C70-P92 WeakPolarHBondContact SG-CB 3.35Å; C70-A93 HydrophobicContact CB-CB 4.11Å; C70-A93 VanDerWaalsContact SG-CA 3.5Å; C70-A93 PolarHBondContact SG-N 3.01Å; C70-N96 PolarHBondContact SG-ND2 3.18Å
71	Q	74	Confident	72.4	Confident	181 Å²	181	80.8 Å²	80.8	85%	0.846	42%	0.422	S	S	*	.	P	Polyproline II helix	trans	-70.2	144.7	151.9	-67.8	179.1	-10.4	0	0	108.8	P73	Q71-P73 WeakPolarHBondContact O-CD 3.41Å
72	N	79.3	Confident	74.4	Confident	161 Å²	161	81.2 Å²	81.2	86%	0.861	43%	0.428	S	S	*	.	P	Polyproline II helix	trans	-67.4	118.3	176.2	-69.5	-25.6	0	0	0	109.1
73	P	87.4	Confident	76.7	Confident	13 Å²	13	82.6 Å²	82.6	8%	0.084	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-68.8	148.4	-179.8	30.5	-36	0	0	0	110.4	Q71 E77 V78 W81 A93 F199	Q71-P73 WeakPolarHBondContact O-CD 3.41Å; P73-E77 HydrophobicContact CB-CB 4.29Å; P73-E77 HydrophobicContact CB-CG 4.3Å; P73-E77 WeakPolarHBondContact CB-OE2 3.28Å; P73-V78 HydrophobicContact CB-CG2 3.96Å; P73-V78 HydrophobicContact CG-CG2 3.8Å; P73-W81 HydrophobicContact CB-CH2 4.15Å; P73-W81 HydrophobicContact CB-CZ2 4.09Å; P73-W81 HydrophobicContact CG-CH2 3.94Å; P73-W81 HydrophobicContact CG-CZ2 4.39Å; P73-A93 HydrophobicContact CB-CB 4.47Å; P73-A93 HydrophobicContact CG-CB 3.87Å; P73-F199 HydrophobicContact CG-CE1 3.79Å; P73-F199 HydrophobicContact CG-CZ 3.85Å
74	T	89.4	Confident	79.1	Confident	80 Å²	80	81.9 Å²	81.9	49%	0.491	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-74.2	158	173.1	65	0	0	0	0	110.8	E76 E77 V78	T74-E76 PolarHBondContact O-N 2.97Å; T74-E77 WeakPolarHBondContact O-CB 3.43Å; T74-E77 PolarHBondContact O-N 3.46Å; T74-E77 PolarHBondContact OG1-N 3.01Å; T74-V78 WeakPolarHBondContact O-CG2 3.43Å; T74-V78 PolarHBondContact O-N 3.25Å
75	A	89.4	Confident	81.1	Confident	16 Å²	16	80.5 Å²	80.5	13%	0.132	42%	0.417	C	S	.	.	H	α-helix	trans	-56.2	-37.7	176.3	0	0	0	0	0	112.4	V78 L79 A204	A75-V78 PolarHBondContact O-N 3.01Å; A75-L79 WeakPolarHBondContact O-CB 3.39Å; A75-L79 VanDerWaalsContact O-CG 3.28Å; A75-L79 WeakPolarHBondContact O-CG 3.42Å; A75-L79 PolarHBondContact O-N 3.19Å; A75-A204 HydrophobicContact CB-CB 4.48Å
76	E	90.6	Very high	83.4	Confident	161 Å²	161	79 Å²	79	75%	0.752	41%	0.412	S	S	*	.	H	α-helix	trans	-64.1	-40.1	175.1	-64.6	-176.6	174.7	0	0	112.5	T74 S80	T74-E76 PolarHBondContact O-N 2.97Å; E76-S80 WeakPolarHBondContact O-CB 3.49Å; E76-S80 PolarHBondContact O-N 2.91Å
77	E	92.4	Very high	85.4	Confident	65 Å²	65	78.8 Å²	78.8	30%	0.304	40%	0.403	S	S	.	.	H	α-helix	trans	-62.7	-49.1	175.4	-174.8	-176.9	167.8	0	0	110.7	P73 T74 L79 S80 W81	P73-E77 HydrophobicContact CB-CB 4.29Å; P73-E77 HydrophobicContact CB-CG 4.3Å; P73-E77 WeakPolarHBondContact CB-OE2 3.28Å; T74-E77 WeakPolarHBondContact O-CB 3.43Å; T74-E77 PolarHBondContact O-N 3.46Å; T74-E77 PolarHBondContact OG1-N 3.01Å; E77-L79 PolarHBondContact O-N 2.98Å; E77-S80 WeakPolarHBondContact O-CB 3.41Å; E77-S80 PolarHBondContact O-N 2.86Å; E77-S80 VanDerWaalsContact O-N 3.15Å; E77-S80 PolarHBondContact O-OG 2.59Å; E77-W81 HydrophobicContact CG-CZ2 4.26Å; E77-W81 PolarHBondContact O-N 3.24Å; E77-W81 PolarHBondContact O-NE1 2.68Å
78	V	92.4	Very high	87.2	Confident	0 Å²	0	73.9 Å²	73.9	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-59.4	-48.8	179.1	-177.8	0	0	0	0	110.7	P73 T74 A75 S80 W81 Y196 F199 V200 T203	P73-V78 HydrophobicContact CB-CG2 3.96Å; P73-V78 HydrophobicContact CG-CG2 3.8Å; T74-V78 WeakPolarHBondContact O-CG2 3.43Å; T74-V78 PolarHBondContact O-N 3.25Å; A75-V78 PolarHBondContact O-N 3.01Å; V78-S80 PolarHBondContact O-N 2.91Å; V78-W81 HydrophobicContact CB-CE3 4.41Å; V78-W81 HydrophobicContact CB-CZ3 4.41Å; V78-W81 HydrophobicContact CG1-CE3 4.03Å; V78-W81 HydrophobicContact CG1-CZ3 4.08Å; V78-W81 HydrophobicContact CG2-CH2 4.15Å; V78-W81 HydrophobicContact CG2-CZ3 4.11Å; V78-W81 VanDerWaalsContact O-CB 3.27Å; V78-W81 WeakPolarHBondContact O-CB 3.27Å; V78-W81 PolarHBondContact O-N 3.15Å; V78-Y196 HydrophobicContact CG1-CE2 3.92Å; V78-Y196 PolarHBondContact O-OH 3.23Å; V78-F199 HydrophobicContact CG1-CD1 3.77Å; V78-F199 HydrophobicContact CG1-CE1 4.22Å; V78-F199 HydrophobicContact CG2-CD1 3.9Å; V78-F199 HydrophobicContact CG2-CE1 3.55Å; V78-V200 HydrophobicContact CG1-CG2 3.54Å; V78-T203 HydrophobicContact CG2-CG2 4.14Å
79	L	92.4	Very high	88.8	Confident	91 Å²	91	71 Å²	71	48%	0.476	36%	0.364	S	S	.	.	H	α-helix	trans	-59	-36.2	178.4	-75.1	172.6	0	0	0	112.3	A75 E77 W81 S82 V200	A75-L79 WeakPolarHBondContact O-CB 3.39Å; A75-L79 VanDerWaalsContact O-CG 3.28Å; A75-L79 WeakPolarHBondContact O-CG 3.42Å; A75-L79 PolarHBondContact O-N 3.19Å; E77-L79 PolarHBondContact O-N 2.98Å; L79-W81 PolarHBondContact O-N 3.37Å; L79-S82 WeakPolarHBondContact O-CB 3.39Å; L79-S82 PolarHBondContact O-N 3.27Å; L79-S82 PolarHBondContact O-OG 3.11Å; L79-V200 HydrophobicContact CD2-CG1 3.71Å; L79-V200 HydrophobicContact CD2-CG2 4.39Å; L79-V200 HydrophobicContact CG-CG1 4.24Å
80	S	94.3	Very high	90.5	Very high	29 Å²	29	69.7 Å²	69.7	20%	0.203	36%	0.356	C	S	.	.	H	α-helix	trans	-67.8	-21.3	179.4	78.2	0	0	0	0	113.9	E76 E77 V78 S82 Q83 K87	E76-S80 WeakPolarHBondContact O-CB 3.49Å; E76-S80 PolarHBondContact O-N 2.91Å; E77-S80 WeakPolarHBondContact O-CB 3.41Å; E77-S80 PolarHBondContact O-N 2.86Å; E77-S80 VanDerWaalsContact O-N 3.15Å; E77-S80 PolarHBondContact O-OG 2.59Å; V78-S80 PolarHBondContact O-N 2.91Å; S80-S82 VanDerWaalsContact C-N 3.26Å; S80-S82 PolarHBondContact O-N 2.65Å; S80-Q83 PolarHBondContact O-N 2.75Å; S80-K87 WeakPolarHBondContact OG-CD 3.5Å; S80-K87 WeakPolarHBondContact OG-CE 3.4Å; S80-K87 PolarHBondContact OG-NZ 2.92Å
81	W	95.1	Very high	91.8	Very high	0 Å²	0	67.9 Å²	67.9	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-62.2	-36.2	174.3	-63.4	-15.6	0	0	0	111.4	P73 E77 V78 L79 Q83 N84 M88 A91 A93 G94 L97 F187 Y196 F199	P73-W81 HydrophobicContact CB-CH2 4.15Å; P73-W81 HydrophobicContact CB-CZ2 4.09Å; P73-W81 HydrophobicContact CG-CH2 3.94Å; P73-W81 HydrophobicContact CG-CZ2 4.39Å; E77-W81 HydrophobicContact CG-CZ2 4.26Å; E77-W81 PolarHBondContact O-N 3.24Å; E77-W81 PolarHBondContact O-NE1 2.68Å; V78-W81 HydrophobicContact CB-CE3 4.41Å; V78-W81 HydrophobicContact CB-CZ3 4.41Å; V78-W81 HydrophobicContact CG1-CE3 4.03Å; V78-W81 HydrophobicContact CG1-CZ3 4.08Å; V78-W81 HydrophobicContact CG2-CH2 4.15Å; V78-W81 HydrophobicContact CG2-CZ3 4.11Å; V78-W81 VanDerWaalsContact O-CB 3.27Å; V78-W81 WeakPolarHBondContact O-CB 3.27Å; V78-W81 PolarHBondContact O-N 3.15Å; L79-W81 PolarHBondContact O-N 3.37Å; W81-Q83 PolarHBondContact O-N 3.24Å; W81-N84 CarbonylContact O-C 3.46Å; W81-N84 PolarHBondContact O-N 3.31Å; W81-M88 HydrophobicContact CB-CB 3.8Å; W81-M88 HydrophobicContact CB-CG 4.02Å; W81-M88 HydrophobicContact CD2-CB 4.22Å; W81-M88 HydrophobicContact CD2-CG 3.83Å; W81-M88 HydrophobicContact CE3-CG 4.03Å; W81-M88 HydrophobicContact CG-CB 3.71Å; W81-M88 HydrophobicContact CG-CG 3.83Å; W81-A91 HydrophobicContact CZ2-CB 3.83Å; W81-A93 HydrophobicContact CH2-CB 4.01Å; W81-A93 HydrophobicContact CZ2-CB 4.44Å; W81-G94 VanDerWaalsContact CH2-CA 3.46Å; W81-G94 VanDerWaalsContact CH2-N 3.33Å; W81-L97 HydrophobicContact CZ3-CD2 4.14Å; W81-F187 WeakPolarHBondContact O-CZ 3.49Å; W81-Y196 HydrophobicContact CE3-CE2 4.46Å; W81-F199 HydrophobicContact CH2-CE1 4.32Å; W81-F199 HydrophobicContact CZ3-CE1 4.15Å
82	S	93.2	Very high	92.7	Very high	37 Å²	37	61.5 Å²	61.5	26%	0.259	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-24.4	179.5	69.9	0	0	0	0	115	L79 S80 L191	L79-S82 WeakPolarHBondContact O-CB 3.39Å; L79-S82 PolarHBondContact O-N 3.27Å; L79-S82 PolarHBondContact O-OG 3.11Å; S80-S82 VanDerWaalsContact C-N 3.26Å; S80-S82 PolarHBondContact O-N 2.65Å; S82-L191 WeakPolarHBondContact O-CD1 3.35Å
83	Q	92.5	Very high	93.4	Very high	171 Å²	171	54.4 Å²	54.4	80%	0.799	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.3	-10.8	-179.1	-57.4	-56	-46.9	0	0	112.8	S80 W81	S80-Q83 PolarHBondContact O-N 2.75Å; W81-Q83 PolarHBondContact O-N 3.24Å
84	N	94.6	Very high	93.8	Very high	72 Å²	72	53.8 Å²	53.8	39%	0.385	28%	0.278	S	S	.	.			trans	-153.2	97.7	-171	-168.3	-33.3	0	0	0	111.5	W81 D86 K87 M88	W81-N84 CarbonylContact O-C 3.46Å; W81-N84 PolarHBondContact O-N 3.31Å; N84-D86 VanDerWaalsContact C-N 3.28Å; N84-D86 PolarHBondContact O-N 3.07Å; N84-D86 WeakPolarHBondContact OD1-CA 3.18Å; N84-D86 WeakPolarHBondContact OD1-CB 3.33Å; N84-D86 PolarHBondContact OD1-N 3.48Å; N84-K87 HydrophobicContact CB-CB 3.88Å; N84-K87 WeakPolarHBondContact O-CB 3.27Å; N84-K87 PolarHBondContact O-N 3.46Å; N84-K87 VanDerWaalsContact O-N 3.11Å; N84-K87 PolarHBondContact OD1-N 2.95Å; N84-M88 PolarHBondContact O-N 3.32Å
85	F	97.2	Very high	94.2	Very high	3 Å²	3	51.2 Å²	51.2	1%	0.013	26%	0.259	C	S	.	.	H	α-helix	trans	-58.4	-39.5	176.4	-175.3	-117.9	0	0	0	112.4	K87 M88 M89 F98 Y179 M182 H183 F187	F85-K87 PolarHBondContact O-N 3.4Å; F85-M88 HydrophobicContact CD2-CE 3.64Å; F85-M88 HydrophobicContact CE2-CE 3.4Å; F85-M88 VanDerWaalsContact CE2-CE 3.4Å; F85-M88 WeakPolarHBondContact O-CB 3.5Å; F85-M88 PolarHBondContact O-N 3.45Å; F85-M88 VanDerWaalsContact O-N 3.14Å; F85-M89 HydrophobicContact CD1-CG 4Å; F85-M89 HydrophobicContact CD2-CG 4.08Å; F85-M89 HydrophobicContact CE1-CG 3.61Å; F85-M89 HydrophobicContact CE1-SD 4.35Å; F85-M89 HydrophobicContact CE2-CG 3.73Å; F85-M89 HydrophobicContact CE2-SD 4.04Å; F85-M89 HydrophobicContact CG-CG 4.23Å; F85-M89 HydrophobicContact CZ-CG 3.47Å; F85-M89 VanDerWaalsContact CZ-CG 3.47Å; F85-M89 HydrophobicContact CZ-SD 3.72Å; F85-M89 WeakPolarHBondContact O-CB 3.41Å; F85-M89 WeakPolarHBondContact O-CG 3.45Å; F85-M89 PolarHBondContact O-N 3.05Å; F85-F98 HydrophobicContact CE2-CD1 4.39Å; F85-F98 AromaticContact CE2-CE1 3.83Å; F85-F98 HydrophobicContact CE2-CE1 3.83Å; F85-F98 HydrophobicContact CE2-CZ 4.04Å; F85-F98 HydrophobicContact CZ-CE1 4.01Å; F85-F98 HydrophobicContact CZ-CZ 4.44Å; F85-Y179 HydrophobicContact CD1-CD1 4.49Å; F85-Y179 AromaticContact CD1-CE1 3.73Å; F85-Y179 HydrophobicContact CD1-CE1 3.73Å; F85-Y179 AromaticContact CD1-CE2 4Å; F85-Y179 HydrophobicContact CD1-CE2 4Å; F85-Y179 AromaticContact CD1-CZ 3.44Å; F85-Y179 VanDerWaalsContact CD1-CZ 3.44Å; F85-Y179 WeakPolarHBondContact CD1-OH 3.45Å; F85-Y179 HydrophobicContact CE1-CD1 4.23Å; F85-Y179 AromaticContact CE1-CD2 3.93Å; F85-Y179 HydrophobicContact CE1-CD2 3.93Å; F85-Y179 AromaticContact CE1-CE1 3.84Å; F85-Y179 HydrophobicContact CE1-CE1 3.84Å; F85-Y179 AromaticContact CE1-CE2 3.53Å; F85-Y179 HydrophobicContact CE1-CE2 3.53Å; F85-Y179 HydrophobicContact CE1-CG 4.28Å; F85-Y179 AromaticContact CE1-CZ 3.46Å; F85-Y179 VanDerWaalsContact CE1-CZ 3.46Å; F85-Y179 HydrophobicContact CZ-CE2 4.45Å; F85-M182 HydrophobicContact CZ-CB 3.97Å; F85-H183 VanDerWaalsContact CB-CD2 3.49Å; F85-H183 WeakPolarHBondContact CB-CD2 3.47Å; F85-H183 HydrophobicContact CD1-CB 3.52Å; F85-H183 AromaticContact CD1-CD2 3.92Å; F85-H183 AromaticContact CD1-CG 3.56Å; F85-H183 HydrophobicContact CE1-CB 3.66Å; F85-H183 HydrophobicContact CG-CB 4.13Å; F85-H183 AromaticContact CG-CD2 3.73Å; F85-H183 AromaticContact CG-CG 3.87Å; F85-H183 HydrophobicContact CZ-CB 4.37Å; F85-F187 HydrophobicContact CB-CD1 4.01Å; F85-F187 HydrophobicContact CB-CE1 3.83Å; F85-F187 HydrophobicContact CB-CG 4.48Å; F85-F187 HydrophobicContact CB-CZ 4.18Å; F85-F187 HydrophobicContact CD2-CB 3.86Å; F85-F187 AromaticContact CD2-CD1 3.77Å; F85-F187 HydrophobicContact CD2-CD1 3.77Å; F85-F187 AromaticContact CD2-CD2 3.36Å; F85-F187 HydrophobicContact CD2-CD2 3.36Å; F85-F187 HydrophobicContact CD2-CE1 4.09Å; F85-F187 AromaticContact CD2-CE2 3.74Å; F85-F187 HydrophobicContact CD2-CE2 3.74Å; F85-F187 AromaticContact CD2-CG 3.36Å; F85-F187 HydrophobicContact CD2-CG 3.36Å; F85-F187 HydrophobicContact CD2-CZ 4.07Å; F85-F187 HydrophobicContact CE2-CB 3.86Å; F85-F187 AromaticContact CE2-CD2 3.78Å; F85-F187 HydrophobicContact CE2-CD2 3.78Å; F85-F187 HydrophobicContact CE2-CE2 4.48Å; F85-F187 AromaticContact CE2-CG 3.84Å; F85-F187 HydrophobicContact CE2-CG 3.84Å; F85-F187 HydrophobicContact CG-CD1 4.17Å; F85-F187 HydrophobicContact CG-CD2 4.47Å; F85-F187 HydrophobicContact CG-CE1 4.39Å; F85-F187 HydrophobicContact CG-CG 4.2Å
86	D	96.8	Very high	94.4	Very high	74 Å²	74	51.9 Å²	51.9	40%	0.396	26%	0.26	S	S	.	.	H	α-helix	trans	-61.7	-35.2	177.7	-54.7	-22.2	0	0	0	112	N84 K90 Y179	N84-D86 VanDerWaalsContact C-N 3.28Å; N84-D86 PolarHBondContact O-N 3.07Å; N84-D86 WeakPolarHBondContact OD1-CA 3.18Å; N84-D86 WeakPolarHBondContact OD1-CB 3.33Å; N84-D86 PolarHBondContact OD1-N 3.48Å; D86-K90 VanDerWaalsContact O-CG 3.25Å; D86-K90 WeakPolarHBondContact O-CG 3.44Å; D86-K90 PolarHBondContact O-N 3.34Å; D86-K90 VanDerWaalsContact O-N 3.1Å; D86-Y179 VanDerWaalsContact CA-OH 3.24Å; D86-Y179 WeakPolarHBondContact CA-OH 3.44Å; D86-Y179 WeakPolarHBondContact OD1-CE1 3.44Å; D86-Y179 PolarHBondContact OD1-OH 3.06Å
87	K	95.1	Very high	94.7	Very high	95 Å²	95	44.6 Å²	44.6	41%	0.413	23%	0.227	S	C	.	.	H	α-helix	trans	-66.6	-44.7	175.8	-168.9	176.4	-179.7	-174.7	0	110.9	S80 N84 F85 K90 A91	S80-K87 WeakPolarHBondContact OG-CD 3.5Å; S80-K87 WeakPolarHBondContact OG-CE 3.4Å; S80-K87 PolarHBondContact OG-NZ 2.92Å; N84-K87 HydrophobicContact CB-CB 3.88Å; N84-K87 WeakPolarHBondContact O-CB 3.27Å; N84-K87 PolarHBondContact O-N 3.46Å; N84-K87 VanDerWaalsContact O-N 3.11Å; N84-K87 PolarHBondContact OD1-N 2.95Å; F85-K87 PolarHBondContact O-N 3.4Å; K87-K90 PolarHBondContact O-N 2.98Å; K87-A91 PolarHBondContact O-N 3.28Å
88	M	96.4	Very high	94.9	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-61.5	-46.6	175.5	-169.9	-170.4	74.5	0	0	111.7	W81 N84 F85 K90 A91 F98 F187 F190	W81-M88 HydrophobicContact CB-CB 3.8Å; W81-M88 HydrophobicContact CB-CG 4.02Å; W81-M88 HydrophobicContact CD2-CB 4.22Å; W81-M88 HydrophobicContact CD2-CG 3.83Å; W81-M88 HydrophobicContact CE3-CG 4.03Å; W81-M88 HydrophobicContact CG-CB 3.71Å; W81-M88 HydrophobicContact CG-CG 3.83Å; N84-M88 PolarHBondContact O-N 3.32Å; F85-M88 HydrophobicContact CD2-CE 3.64Å; F85-M88 HydrophobicContact CE2-CE 3.4Å; F85-M88 VanDerWaalsContact CE2-CE 3.4Å; F85-M88 WeakPolarHBondContact O-CB 3.5Å; F85-M88 PolarHBondContact O-N 3.45Å; F85-M88 VanDerWaalsContact O-N 3.14Å; M88-K90 PolarHBondContact O-N 3.27Å; M88-A91 PolarHBondContact O-N 3.48Å; M88-A91 VanDerWaalsContact O-O 3.08Å; M88-F98 HydrophobicContact CE-CB 3.73Å; M88-F98 HydrophobicContact CE-CD1 3.7Å; M88-F98 HydrophobicContact CE-CD2 3.97Å; M88-F98 HydrophobicContact CE-CE1 4.25Å; M88-F98 HydrophobicContact CE-CE2 4.5Å; M88-F98 HydrophobicContact CE-CG 3.54Å; M88-F98 HydrophobicContact SD-CB 4.29Å; M88-F187 HydrophobicContact CE-CD2 3.87Å; M88-F187 HydrophobicContact CE-CE2 3.92Å; M88-F187 HydrophobicContact SD-CD2 4.08Å; M88-F187 HydrophobicContact SD-CE2 3.61Å; M88-F190 HydrophobicContact SD-CD1 3.97Å; M88-F190 HydrophobicContact SD-CE1 3.41Å; M88-F190 WeakPolarHBondContact SD-CE1 3.48Å; M88-F190 HydrophobicContact SD-CZ 4.26Å
89	M	96.9	Very high	95.1	Very high	2 Å²	2	42 Å²	42	1%	0.01	21%	0.214	C	C	.	.	H	α-helix	trans	-68.7	-21.2	-177.1	-74.8	-65.2	-64.2	0	0	113.2	F85 R95 F98 L111 W114 Y179 M182	F85-M89 HydrophobicContact CD1-CG 4Å; F85-M89 HydrophobicContact CD2-CG 4.08Å; F85-M89 HydrophobicContact CE1-CG 3.61Å; F85-M89 HydrophobicContact CE1-SD 4.35Å; F85-M89 HydrophobicContact CE2-CG 3.73Å; F85-M89 HydrophobicContact CE2-SD 4.04Å; F85-M89 HydrophobicContact CG-CG 4.23Å; F85-M89 HydrophobicContact CZ-CG 3.47Å; F85-M89 VanDerWaalsContact CZ-CG 3.47Å; F85-M89 HydrophobicContact CZ-SD 3.72Å; F85-M89 WeakPolarHBondContact O-CB 3.41Å; F85-M89 WeakPolarHBondContact O-CG 3.45Å; F85-M89 PolarHBondContact O-N 3.05Å; M89-R95 VanDerWaalsContact O-CD 3.29Å; M89-R95 WeakPolarHBondContact O-CD 3.24Å; M89-R95 WeakPolarHBondContact O-CG 3.4Å; M89-R95 PolarHBondContact O-NH1 3.33Å; M89-R95 HydrophobicContact SD-CG 4.37Å; M89-F98 HydrophobicContact SD-CD1 4.24Å; M89-L111 HydrophobicContact CE-CD1 3.64Å; M89-L111 HydrophobicContact SD-CD1 4.11Å; M89-W114 HydrophobicContact CE-CD2 3.67Å; M89-W114 HydrophobicContact CE-CE3 3.62Å; M89-W114 HydrophobicContact CE-CG 4.3Å; M89-W114 HydrophobicContact CE-CH2 4.04Å; M89-W114 HydrophobicContact CE-CZ2 4.09Å; M89-W114 HydrophobicContact CE-CZ3 3.81Å; M89-Y179 HydrophobicContact CB-CE2 3.95Å; M89-Y179 HydrophobicContact CE-CD2 4.23Å; M89-Y179 HydrophobicContact CE-CE2 4Å; M89-Y179 HydrophobicContact CG-CE2 3.72Å; M89-M182 HydrophobicContact CE-CE 4.2Å
90	K	94.2	Very high	95.3	Very high	165 Å²	165	42.6 Å²	42.6	72%	0.717	21%	0.214	S	C	*	.	H	α-helix	trans	-78.8	-29.9	170.5	-75.1	170.1	-175.6	174.2	0	112.8	D86 K87 M88 P92 R95	D86-K90 VanDerWaalsContact O-CG 3.25Å; D86-K90 WeakPolarHBondContact O-CG 3.44Å; D86-K90 PolarHBondContact O-N 3.34Å; D86-K90 VanDerWaalsContact O-N 3.1Å; K87-K90 PolarHBondContact O-N 2.98Å; M88-K90 PolarHBondContact O-N 3.27Å; K90-P92 WeakPolarHBondContact O-CD 3.4Å; K90-R95 VanDerWaalsContact C-NH1 3.25Å; K90-R95 PolarHBondContact O-NH1 3.25Å
91	A	94.1	Very high	95.5	Very high	9 Å²	9	41.8 Å²	41.8	7%	0.074	21%	0.207	C	C	.	.	S	Bend	trans	-79.2	121.7	179.5	0	0	0	0	0	111.2	W81 K87 M88 A93 G94 R95	W81-A91 HydrophobicContact CZ2-CB 3.83Å; K87-A91 PolarHBondContact O-N 3.28Å; M88-A91 PolarHBondContact O-N 3.48Å; M88-A91 VanDerWaalsContact O-O 3.08Å; A91-A93 PolarHBondContact O-N 3.21Å; A91-G94 WeakPolarHBondContact O-CA 3.41Å; A91-G94 PolarHBondContact O-N 3.43Å; A91-R95 PolarHBondContact O-N 2.97Å
92	P	93.8	Very high	95.7	Very high	47 Å²	47	41.8 Å²	41.8	31%	0.305	21%	0.207	S	C	.	.	H	α-helix	trans	-54.3	-40.3	174.3	-27.6	36.7	0	0	0	112.8	E68 C70 K90 G94 R95 N96	E68-P92 HydrophobicContact CB-CB 3.95Å; C70-P92 WeakPolarHBondContact SG-CB 3.35Å; K90-P92 WeakPolarHBondContact O-CD 3.4Å; P92-G94 VanDerWaalsContact C-N 3.33Å; P92-G94 PolarHBondContact O-N 2.94Å; P92-R95 PolarHBondContact O-N 3.46Å; P92-N96 WeakPolarHBondContact O-CB 3.49Å; P92-N96 PolarHBondContact O-N 3.3Å; P92-N96 PolarHBondContact O-ND2 3.25Å
93	A	93.2	Very high	95.9	Very high	13 Å²	13	45.5 Å²	45.5	11%	0.107	22%	0.216	C	C	.	.	H	α-helix	trans	-64.1	-39.9	177.3	0	0	0	0	0	111.8	C70 P73 W81 A91 N96 L97	C70-A93 HydrophobicContact CB-CB 4.11Å; C70-A93 VanDerWaalsContact SG-CA 3.5Å; C70-A93 PolarHBondContact SG-N 3.01Å; P73-A93 HydrophobicContact CB-CB 4.47Å; P73-A93 HydrophobicContact CG-CB 3.87Å; W81-A93 HydrophobicContact CH2-CB 4.01Å; W81-A93 HydrophobicContact CZ2-CB 4.44Å; A91-A93 PolarHBondContact O-N 3.21Å; A93-N96 PolarHBondContact O-N 2.97Å; A93-L97 WeakPolarHBondContact O-CB 3.25Å; A93-L97 PolarHBondContact O-N 3.47Å
94	G	95.7	Very high	96.1	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-62.7	-45	175.1	0	0	0	0	0	111.9	W81 A91 P92 F98	W81-G94 VanDerWaalsContact CH2-CA 3.46Å; W81-G94 VanDerWaalsContact CH2-N 3.33Å; A91-G94 WeakPolarHBondContact O-CA 3.41Å; A91-G94 PolarHBondContact O-N 3.43Å; P92-G94 VanDerWaalsContact C-N 3.33Å; P92-G94 PolarHBondContact O-N 2.94Å; G94-F98 VanDerWaalsContact O-CB 3.22Å; G94-F98 WeakPolarHBondContact O-CB 3.34Å; G94-F98 PolarHBondContact O-N 3.11Å
95	R	97	Very high	96.2	Very high	26 Å²	26	39.7 Å²	39.7	10%	0.098	19%	0.192	C	C	.	.	H	α-helix	trans	-62.7	-43.7	175.1	-66.8	-166.3	-65.3	-87.6	4.9	112.3	E68 M89 K90 A91 P92 F98 R99 L111	E68-R95 IonicContact OE1-CZ 3.89Å; E68-R95 IonicContact OE1-NE 2.94Å; E68-R95 IonicContact OE1-NH2 3.91Å; E68-R95 PolarHBondContact OE1-NH2 3Å; E68-R95 IonicContact OE2-CZ 3.73Å; E68-R95 IonicContact OE2-NE 3.9Å; E68-R95 PolarHBondContact OE2-NE 3.08Å; E68-R95 IonicContact OE2-NH2 2.79Å; E68-R95 PolarHBondContact OE2-NH2 3.42Å; M89-R95 VanDerWaalsContact O-CD 3.29Å; M89-R95 WeakPolarHBondContact O-CD 3.24Å; M89-R95 WeakPolarHBondContact O-CG 3.4Å; M89-R95 PolarHBondContact O-NH1 3.33Å; M89-R95 HydrophobicContact SD-CG 4.37Å; K90-R95 VanDerWaalsContact C-NH1 3.25Å; K90-R95 PolarHBondContact O-NH1 3.25Å; A91-R95 PolarHBondContact O-N 2.97Å; P92-R95 PolarHBondContact O-N 3.46Å; R95-F98 PolarHBondContact O-N 3.1Å; R95-R99 VanDerWaalsContact O-CB 3.29Å; R95-R99 WeakPolarHBondContact O-CB 3.44Å; R95-R99 PolarHBondContact O-N 2.97Å; R95-L111 WeakPolarHBondContact O-CD2 3.48Å
96	N	95.2	Very high	96.1	Very high	29 Å²	29	49.2 Å²	49.2	16%	0.155	23%	0.229	C	C	.	.	H	α-helix	trans	-63.1	-45.9	178.9	-76	-24.1	0	0	0	112.1	L67 E68 C70 P92 A93 R99 E100	L67-N96 HydrophobicContact CD2-CB 3.97Å; L67-N96 WeakPolarHBondContact CD2-OD1 3.29Å; E68-N96 PolarHBondContact N-OD1 3.37Å; E68-N96 PolarHBondContact O-ND2 3.06Å; C70-N96 PolarHBondContact SG-ND2 3.18Å; P92-N96 WeakPolarHBondContact O-CB 3.49Å; P92-N96 PolarHBondContact O-N 3.3Å; P92-N96 PolarHBondContact O-ND2 3.25Å; A93-N96 PolarHBondContact O-N 2.97Å; N96-R99 WeakPolarHBondContact O-CB 3.47Å; N96-R99 PolarHBondContact O-N 3.11Å; N96-E100 PolarHBondContact O-N 3.1Å; N96-E100 VanDerWaalsContact O-N 3.08Å
97	L	95.4	Very high	96.1	Very high	9 Å²	9	46.3 Å²	46.3	5%	0.047	22%	0.215	C	C	.	.	H	α-helix	trans	-66.1	-41.8	177.8	-173.7	65.7	0	0	0	111.8	W81 A93 R99 E100 F101 F190 I195 Y196 F199	W81-L97 HydrophobicContact CZ3-CD2 4.14Å; A93-L97 WeakPolarHBondContact O-CB 3.25Å; A93-L97 PolarHBondContact O-N 3.47Å; L97-R99 VanDerWaalsContact C-N 3.33Å; L97-R99 PolarHBondContact O-N 3.42Å; L97-E100 WeakPolarHBondContact O-CB 3.43Å; L97-E100 PolarHBondContact O-N 2.94Å; L97-F101 PolarHBondContact O-N 3.41Å; L97-F101 VanDerWaalsContact O-N 3.17Å; L97-F190 HydrophobicContact CB-CZ 4.46Å; L97-F190 HydrophobicContact CD2-CE2 4.27Å; L97-F190 HydrophobicContact CD2-CZ 3.8Å; L97-F190 HydrophobicContact CG-CE2 3.94Å; L97-F190 HydrophobicContact CG-CZ 3.85Å; L97-I195 HydrophobicContact CD1-CG2 3.6Å; L97-I195 HydrophobicContact CG-CG2 4.3Å; L97-Y196 HydrophobicContact CD2-CD2 4.39Å; L97-F199 HydrophobicContact CD1-CB 4.08Å; L97-F199 HydrophobicContact CD1-CD2 3.83Å; L97-F199 HydrophobicContact CD1-CE2 4.44Å; L97-F199 HydrophobicContact CD1-CG 3.95Å; L97-F199 HydrophobicContact CD2-CB 3.76Å; L97-F199 HydrophobicContact CD2-CD1 3.42Å; L97-F199 VanDerWaalsContact CD2-CD1 3.42Å; L97-F199 HydrophobicContact CD2-CD2 4.07Å; L97-F199 HydrophobicContact CD2-CE1 3.96Å; L97-F199 HydrophobicContact CD2-CG 3.48Å; L97-F199 VanDerWaalsContact CD2-CG 3.48Å; L97-F199 HydrophobicContact CG-CG 4.36Å
98	F	97.6	Very high	96.3	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-64.2	-40.2	175.8	-171	-132.8	0	0	0	111.2	F85 M88 M89 G94 R95 E100 F101 L102 L111 M182 F187 F190	F85-F98 HydrophobicContact CE2-CD1 4.39Å; F85-F98 AromaticContact CE2-CE1 3.83Å; F85-F98 HydrophobicContact CE2-CE1 3.83Å; F85-F98 HydrophobicContact CE2-CZ 4.04Å; F85-F98 HydrophobicContact CZ-CE1 4.01Å; F85-F98 HydrophobicContact CZ-CZ 4.44Å; M88-F98 HydrophobicContact CE-CB 3.73Å; M88-F98 HydrophobicContact CE-CD1 3.7Å; M88-F98 HydrophobicContact CE-CD2 3.97Å; M88-F98 HydrophobicContact CE-CE1 4.25Å; M88-F98 HydrophobicContact CE-CE2 4.5Å; M88-F98 HydrophobicContact CE-CG 3.54Å; M88-F98 HydrophobicContact SD-CB 4.29Å; M89-F98 HydrophobicContact SD-CD1 4.24Å; G94-F98 VanDerWaalsContact O-CB 3.22Å; G94-F98 WeakPolarHBondContact O-CB 3.34Å; G94-F98 PolarHBondContact O-N 3.11Å; R95-F98 PolarHBondContact O-N 3.1Å; F98-E100 VanDerWaalsContact C-N 3.3Å; F98-E100 PolarHBondContact O-N 2.72Å; F98-F101 HydrophobicContact CD2-CD1 4.11Å; F98-F101 HydrophobicContact CE2-CD1 4.01Å; F98-F101 HydrophobicContact CE2-CE1 4.41Å; F98-F101 WeakPolarHBondContact O-CB 3.47Å; F98-F101 PolarHBondContact O-N 2.85Å; F98-F101 VanDerWaalsContact O-N 3.13Å; F98-L102 HydrophobicContact CD1-CD1 3.87Å; F98-L102 HydrophobicContact CD1-CG 4.31Å; F98-L102 HydrophobicContact CD2-CG 4.36Å; F98-L102 HydrophobicContact CE1-CD1 3.77Å; F98-L102 HydrophobicContact CE1-CD2 4.14Å; F98-L102 HydrophobicContact CE1-CG 4.19Å; F98-L102 HydrophobicContact CE2-CD2 3.91Å; F98-L102 HydrophobicContact CE2-CG 4.24Å; F98-L102 HydrophobicContact CG-CD1 4.39Å; F98-L102 HydrophobicContact CG-CG 4.4Å; F98-L102 HydrophobicContact CZ-CD1 4.21Å; F98-L102 HydrophobicContact CZ-CD2 3.71Å; F98-L102 HydrophobicContact CZ-CG 4.16Å; F98-L102 VanDerWaalsContact O-CG 3.3Å; F98-L102 WeakPolarHBondContact O-CG 3.34Å; F98-L102 PolarHBondContact O-N 3.23Å; F98-L111 HydrophobicContact CD1-CD2 4.28Å; F98-M182 HydrophobicContact CE1-CB 4.11Å; F98-M182 HydrophobicContact CE1-CG 4.41Å; F98-M182 HydrophobicContact CE1-SD 3.98Å; F98-M182 HydrophobicContact CZ-CB 4.24Å; F98-F187 HydrophobicContact CE2-CB 4.41Å; F98-F187 HydrophobicContact CZ-CB 4.31Å; F98-F190 HydrophobicContact CD2-CB 3.88Å; F98-F190 AromaticContact CD2-CD1 3.86Å; F98-F190 HydrophobicContact CD2-CD1 3.86Å; F98-F190 HydrophobicContact CD2-CD2 4.03Å; F98-F190 HydrophobicContact CD2-CE1 4.39Å; F98-F190 AromaticContact CD2-CG 3.64Å; F98-F190 HydrophobicContact CD2-CG 3.64Å; F98-F190 HydrophobicContact CE2-CB 3.77Å; F98-F190 HydrophobicContact CE2-CD1 4.36Å; F98-F190 HydrophobicContact CE2-CG 4.06Å
99	R	97.3	Very high	96.4	Very high	10 Å²	10	45.8 Å²	45.8	4%	0.038	21%	0.214	C	C	.	.	H	α-helix	trans	-58	-41.1	173.9	-169	178	174.6	-160.9	-2.2	112.4	Q65 R95 N96 L97 F101 L102 R103 L111	Q65-R99 PolarHBondContact O-NH1 3.01Å; R95-R99 VanDerWaalsContact O-CB 3.29Å; R95-R99 WeakPolarHBondContact O-CB 3.44Å; R95-R99 PolarHBondContact O-N 2.97Å; N96-R99 WeakPolarHBondContact O-CB 3.47Å; N96-R99 PolarHBondContact O-N 3.11Å; L97-R99 VanDerWaalsContact C-N 3.33Å; L97-R99 PolarHBondContact O-N 3.42Å; R99-F101 VanDerWaalsContact C-N 3.33Å; R99-L102 PolarHBondContact O-N 3.14Å; R99-R103 VanDerWaalsContact NH2-NH2 3.12Å; R99-R103 WeakPolarHBondContact O-CG 3.41Å; R99-R103 PolarHBondContact O-N 3.35Å; R99-R103 VanDerWaalsContact O-N 3.09Å; R99-L111 HydrophobicContact CB-CD2 3.58Å; R99-L111 HydrophobicContact CG-CD2 4.16Å
100	E	96.5	Very high	96.4	Very high	103 Å²	103	46.1 Å²	46.1	48%	0.481	22%	0.216	S	C	.	.	H	α-helix	trans	-60.2	-46	175.7	-172.5	180	163.1	0	0	110.9	N96 L97 F98 R103 T104 I195	N96-E100 PolarHBondContact O-N 3.1Å; N96-E100 VanDerWaalsContact O-N 3.08Å; L97-E100 WeakPolarHBondContact O-CB 3.43Å; L97-E100 PolarHBondContact O-N 2.94Å; F98-E100 VanDerWaalsContact C-N 3.3Å; F98-E100 PolarHBondContact O-N 2.72Å; E100-R103 PolarHBondContact O-N 3.29Å; E100-T104 WeakPolarHBondContact O-CG2 3.48Å; E100-I195 HydrophobicContact CG-CD1 4.47Å
101	F	98.1	Very high	96.6	Very high	13 Å²	13	38.2 Å²	38.2	6%	0.057	18%	0.182	C	C	.	.	H	α-helix	trans	-61.4	-48.6	174.4	168.2	-96.8	0	0	0	112.8	L97 F98 R99 R103 T104 E105 S186 R189 F190 I195	L97-F101 PolarHBondContact O-N 3.41Å; L97-F101 VanDerWaalsContact O-N 3.17Å; F98-F101 HydrophobicContact CD2-CD1 4.11Å; F98-F101 HydrophobicContact CE2-CD1 4.01Å; F98-F101 HydrophobicContact CE2-CE1 4.41Å; F98-F101 WeakPolarHBondContact O-CB 3.47Å; F98-F101 PolarHBondContact O-N 2.85Å; F98-F101 VanDerWaalsContact O-N 3.13Å; R99-F101 VanDerWaalsContact C-N 3.33Å; F101-R103 PolarHBondContact O-N 2.71Å; F101-T104 WeakPolarHBondContact O-CB 3.24Å; F101-T104 PolarHBondContact O-N 2.74Å; F101-T104 PolarHBondContact O-OG1 3.07Å; F101-E105 VanDerWaalsContact CE1-CD 3.48Å; F101-E105 HydrophobicContact CE1-CG 4.29Å; F101-E105 VanDerWaalsContact CE1-OE2 3.25Å; F101-E105 WeakPolarHBondContact CE1-OE2 3.29Å; F101-E105 WeakPolarHBondContact CZ-OE2 3.41Å; F101-S186 VanDerWaalsContact CE1-O 3.32Å; F101-S186 WeakPolarHBondContact CE1-O 3.5Å; F101-R189 HydrophobicContact CE1-CB 4.48Å; F101-R189 HydrophobicContact CZ-CB 3.71Å; F101-F190 HydrophobicContact CB-CD2 3.48Å; F101-F190 VanDerWaalsContact CB-CD2 3.48Å; F101-F190 HydrophobicContact CB-CE2 4.02Å; F101-F190 HydrophobicContact CB-CG 4.46Å; F101-F190 HydrophobicContact CD1-CB 3.57Å; F101-F190 AromaticContact CD1-CD2 3.97Å; F101-F190 HydrophobicContact CD1-CD2 3.97Å; F101-F190 HydrophobicContact CD1-CG 4.17Å; F101-F190 HydrophobicContact CD2-CB 4.34Å; F101-F190 HydrophobicContact CD2-CD2 4.13Å; F101-F190 HydrophobicContact CE1-CB 3.68Å; F101-F190 HydrophobicContact CE2-CB 4.43Å; F101-F190 HydrophobicContact CG-CB 3.92Å; F101-F190 AromaticContact CG-CD2 3.57Å; F101-F190 HydrophobicContact CG-CD2 3.57Å; F101-F190 HydrophobicContact CG-CG 4.21Å; F101-F190 HydrophobicContact CZ-CB 4.13Å; F101-F190 VanDerWaalsContact CZ-N 3.33Å; F101-I195 HydrophobicContact CB-CD1 4.25Å
102	L	98.2	Very high	96.8	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-59.4	-34.6	-178.7	-65.2	175.5	0	0	0	112.4	F98 R99 T104 E105 Y106 S107 E108 L111 M182 S186	F98-L102 HydrophobicContact CD1-CD1 3.87Å; F98-L102 HydrophobicContact CD1-CG 4.31Å; F98-L102 HydrophobicContact CD2-CG 4.36Å; F98-L102 HydrophobicContact CE1-CD1 3.77Å; F98-L102 HydrophobicContact CE1-CD2 4.14Å; F98-L102 HydrophobicContact CE1-CG 4.19Å; F98-L102 HydrophobicContact CE2-CD2 3.91Å; F98-L102 HydrophobicContact CE2-CG 4.24Å; F98-L102 HydrophobicContact CG-CD1 4.39Å; F98-L102 HydrophobicContact CG-CG 4.4Å; F98-L102 HydrophobicContact CZ-CD1 4.21Å; F98-L102 HydrophobicContact CZ-CD2 3.71Å; F98-L102 HydrophobicContact CZ-CG 4.16Å; F98-L102 VanDerWaalsContact O-CG 3.3Å; F98-L102 WeakPolarHBondContact O-CG 3.34Å; F98-L102 PolarHBondContact O-N 3.23Å; R99-L102 PolarHBondContact O-N 3.14Å; L102-T104 VanDerWaalsContact C-N 3.26Å; L102-T104 PolarHBondContact O-N 2.91Å; L102-E105 WeakPolarHBondContact CD2-OE1 3.47Å; L102-E105 CarbonylContact O-C 3.55Å; L102-E105 VanDerWaalsContact O-CG 3.24Å; L102-E105 WeakPolarHBondContact O-CG 3.35Å; L102-E105 PolarHBondContact O-N 2.65Å; L102-E105 VanDerWaalsContact O-N 3.14Å; L102-Y106 PolarHBondContact O-N 2.84Å; L102-S107 WeakPolarHBondContact CD2-OG 3.22Å; L102-S107 PolarHBondContact O-N 2.79Å; L102-E108 HydrophobicContact CB-CB 3.94Å; L102-L111 HydrophobicContact CD1-CB 3.52Å; L102-L111 HydrophobicContact CD1-CD2 4.04Å; L102-L111 HydrophobicContact CD1-CG 4.42Å; L102-M182 HydrophobicContact CD1-SD 4.2Å; L102-S186 VanDerWaalsContact CD2-CB 3.46Å
103	R	97.2	Very high	97	Very high	114 Å²	114	36.1 Å²	36.1	43%	0.43	17%	0.166	S	C	.	.	H	α-helix	trans	-62.1	-32.7	173.4	-76.1	173.8	176.6	154.8	-5.3	112.9	R99 E100 F101 E105 Y106 E108	R99-R103 VanDerWaalsContact NH2-NH2 3.12Å; R99-R103 WeakPolarHBondContact O-CG 3.41Å; R99-R103 PolarHBondContact O-N 3.35Å; R99-R103 VanDerWaalsContact O-N 3.09Å; E100-R103 PolarHBondContact O-N 3.29Å; F101-R103 PolarHBondContact O-N 2.71Å; R103-E105 PolarHBondContact O-N 2.99Å; R103-Y106 PolarHBondContact O-N 3.49Å; R103-E108 HydrophobicContact CG-CB 3.82Å; R103-E108 HydrophobicContact CG-CG 3.79Å
104	T	97	Very high	97.3	Very high	86 Å²	86	36.9 Å²	36.9	53%	0.528	17%	0.166	S	C	.	.	H	α-helix	trans	-70.8	-20.8	178.2	72.4	0	0	0	0	112.9	E100 F101 L102 I195	E100-T104 WeakPolarHBondContact O-CG2 3.48Å; F101-T104 WeakPolarHBondContact O-CB 3.24Å; F101-T104 PolarHBondContact O-N 2.74Å; F101-T104 PolarHBondContact O-OG1 3.07Å; L102-T104 VanDerWaalsContact C-N 3.26Å; L102-T104 PolarHBondContact O-N 2.91Å; T104-I195 HydrophobicContact CG2-CD1 3.78Å
105	E	96.5	Very high	97.4	Very high	36 Å²	36	38.2 Å²	38.2	17%	0.168	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.2	11	178.5	59.9	168.9	-139.1	0	0	113.3	F101 L102 R103 S107 S186 R189	F101-E105 VanDerWaalsContact CE1-CD 3.48Å; F101-E105 HydrophobicContact CE1-CG 4.29Å; F101-E105 VanDerWaalsContact CE1-OE2 3.25Å; F101-E105 WeakPolarHBondContact CE1-OE2 3.29Å; F101-E105 WeakPolarHBondContact CZ-OE2 3.41Å; L102-E105 WeakPolarHBondContact CD2-OE1 3.47Å; L102-E105 CarbonylContact O-C 3.55Å; L102-E105 VanDerWaalsContact O-CG 3.24Å; L102-E105 WeakPolarHBondContact O-CG 3.35Å; L102-E105 PolarHBondContact O-N 2.65Å; L102-E105 VanDerWaalsContact O-N 3.14Å; R103-E105 PolarHBondContact O-N 2.99Å; E105-S107 VanDerWaalsContact C-N 3.31Å; E105-S107 VanDerWaalsContact CG-OG 3.27Å; E105-S107 WeakPolarHBondContact CG-OG 3.42Å; E105-S107 PolarHBondContact O-N 3.44Å; E105-S107 PolarHBondContact OE1-OG 3.15Å; E105-S186 VanDerWaalsContact OE1-CB 3.23Å; E105-S186 WeakPolarHBondContact OE1-CB 3.42Å; E105-S186 PolarHBondContact OE1-OG 3.2Å; E105-R189 IonicContact OE1-NH2 3.56Å; E105-R189 PolarHBondContact OE1-NH2 3.08Å; E105-R189 IonicContact OE2-CZ 3.79Å; E105-R189 IonicContact OE2-NE 3.36Å; E105-R189 IonicContact OE2-NH1 3.12Å; E105-R189 PolarHBondContact OE2-NH1 3.37Å; E105-R189 IonicContact OE2-NH2 3.08Å; E105-R189 PolarHBondContact OE2-NH2 3.27Å; E105-R189 VanDerWaalsContact OE2-NH2 3.08Å
106	Y	96.1	Very high	97.5	Very high	202 Å²	202	37 Å²	37	79%	0.792	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.9	44.5	178.8	-52	-87.3	0	0	0	113.1	L102 R103	L102-Y106 PolarHBondContact O-N 2.84Å; R103-Y106 PolarHBondContact O-N 3.49Å
107	S	97.7	Very high	97.6	Very high	13 Å²	13	35.8 Å²	35.8	9%	0.091	16%	0.163	C	C	.	.			trans	-131	13.3	-178.4	75.2	0	0	0	0	113	L102 E105 E109 N110	L102-S107 WeakPolarHBondContact CD2-OG 3.22Å; L102-S107 PolarHBondContact O-N 2.79Å; E105-S107 VanDerWaalsContact C-N 3.31Å; E105-S107 VanDerWaalsContact CG-OG 3.27Å; E105-S107 WeakPolarHBondContact CG-OG 3.42Å; E105-S107 PolarHBondContact O-N 3.44Å; E105-S107 PolarHBondContact OE1-OG 3.15Å; S107-E109 WeakPolarHBondContact CA-OE1 3.43Å; S107-E109 VanDerWaalsContact CA-OE2 3.25Å; S107-E109 WeakPolarHBondContact CA-OE2 3.39Å; S107-E109 PolarHBondContact O-N 3.13Å; S107-N110 WeakPolarHBondContact O-CB 3.4Å; S107-N110 PolarHBondContact O-N 2.85Å; S107-N110 PolarHBondContact O-ND2 3.07Å
108	E	97.9	Very high	97.7	Very high	47 Å²	47	38 Å²	38	22%	0.22	17%	0.173	C	C	.	.	H	α-helix	trans	-67.4	-19.9	-174.9	75.9	-78.6	-173	0	0	113.7	L102 R103 N110 L111 L112	L102-E108 HydrophobicContact CB-CB 3.94Å; R103-E108 HydrophobicContact CG-CB 3.82Å; R103-E108 HydrophobicContact CG-CG 3.79Å; E108-N110 PolarHBondContact O-N 3.17Å; E108-L111 PolarHBondContact O-N 3.44Å; E108-L111 VanDerWaalsContact O-N 3.15Å; E108-L112 HydrophobicContact CG-CD1 4.22Å; E108-L112 WeakPolarHBondContact O-CG 3.3Å; E108-L112 PolarHBondContact O-N 3.3Å
109	E	98.3	Very high	97.7	Very high	37 Å²	37	40.5 Å²	40.5	17%	0.173	19%	0.186	C	C	.	.	H	α-helix	trans	-55.7	-31.6	173.6	70.4	-69.5	162.3	0	0	112.1	S107 L112 F113 K147 V149	S107-E109 WeakPolarHBondContact CA-OE1 3.43Å; S107-E109 VanDerWaalsContact CA-OE2 3.25Å; S107-E109 WeakPolarHBondContact CA-OE2 3.39Å; S107-E109 PolarHBondContact O-N 3.13Å; E109-L112 PolarHBondContact O-N 3.13Å; E109-F113 VanDerWaalsContact O-CB 3.26Å; E109-F113 WeakPolarHBondContact O-CB 3.4Å; E109-F113 PolarHBondContact O-N 3.37Å; E109-K147 HydrophobicContact CB-CB 3.93Å; E109-K147 HydrophobicContact CB-CG 4.46Å; E109-V149 HydrophobicContact CG-CG1 4.1Å
110	N	98.4	Very high	97.7	Very high	9 Å²	9	40.1 Å²	40.1	5%	0.048	19%	0.185	C	C	.	.	H	α-helix	trans	-62.4	-45.5	177.3	-64.9	-63.1	0	0	0	112	S107 E108 W114 I178 M182	S107-N110 WeakPolarHBondContact O-CB 3.4Å; S107-N110 PolarHBondContact O-N 2.85Å; S107-N110 PolarHBondContact O-ND2 3.07Å; E108-N110 PolarHBondContact O-N 3.17Å; N110-W114 WeakPolarHBondContact O-CB 3.46Å; N110-W114 PolarHBondContact O-N 3.02Å; N110-W114 VanDerWaalsContact O-N 3.11Å; N110-I178 HydrophobicContact CB-CG2 3.59Å; N110-I178 WeakPolarHBondContact O-CG2 3.25Å; N110-M182 HydrophobicContact CB-CG 3.72Å; N110-M182 HydrophobicContact CB-SD 3.78Å
111	L	98.3	Very high	97.8	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-74.1	-37.7	178.2	179.3	60.8	0	0	0	111.6	M89 R95 F98 R99 L102 E108 W114 L115 M182	M89-L111 HydrophobicContact CE-CD1 3.64Å; M89-L111 HydrophobicContact SD-CD1 4.11Å; R95-L111 WeakPolarHBondContact O-CD2 3.48Å; F98-L111 HydrophobicContact CD1-CD2 4.28Å; R99-L111 HydrophobicContact CB-CD2 3.58Å; R99-L111 HydrophobicContact CG-CD2 4.16Å; L102-L111 HydrophobicContact CD1-CB 3.52Å; L102-L111 HydrophobicContact CD1-CD2 4.04Å; L102-L111 HydrophobicContact CD1-CG 4.42Å; E108-L111 PolarHBondContact O-N 3.44Å; E108-L111 VanDerWaalsContact O-N 3.15Å; L111-W114 HydrophobicContact CD1-CE3 4.38Å; L111-W114 PolarHBondContact O-N 3.09Å; L111-L115 HydrophobicContact CD1-CD1 4.49Å; L111-L115 HydrophobicContact CD1-CG 4.37Å; L111-L115 HydrophobicContact CG-CD1 4.18Å; L111-L115 WeakPolarHBondContact O-CB 3.43Å; L111-L115 WeakPolarHBondContact O-CG 3.5Å; L111-L115 PolarHBondContact O-N 2.65Å; L111-M182 HydrophobicContact CB-SD 3.89Å; L111-M182 HydrophobicContact CD1-SD 4.49Å
112	L	97.9	Very high	97.7	Very high	11 Å²	11	43.6 Å²	43.6	6%	0.058	20%	0.199	C	C	.	.	H	α-helix	trans	-63	-44.5	176.8	-68.8	176.8	0	0	0	111.9	E108 E109 W114 L115 A116 Y140	E108-L112 HydrophobicContact CG-CD1 4.22Å; E108-L112 WeakPolarHBondContact O-CG 3.3Å; E108-L112 PolarHBondContact O-N 3.3Å; E109-L112 PolarHBondContact O-N 3.13Å; L112-W114 VanDerWaalsContact C-N 3.34Å; L112-L115 PolarHBondContact O-N 2.52Å; L112-A116 WeakPolarHBondContact O-CB 3.48Å; L112-A116 PolarHBondContact O-N 3.03Å; L112-Y140 HydrophobicContact CB-CE1 3.83Å
113	F	98.6	Very high	97.7	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-59.4	-46.1	172.9	168.3	-109.4	0	0	0	111.4	E109 L115 A116 C117 I136 Y140 I141 V149 Y171 A174 I178	E109-F113 VanDerWaalsContact O-CB 3.26Å; E109-F113 WeakPolarHBondContact O-CB 3.4Å; E109-F113 PolarHBondContact O-N 3.37Å; F113-L115 VanDerWaalsContact C-N 3.34Å; F113-L115 PolarHBondContact O-N 3.3Å; F113-A116 PolarHBondContact O-N 3.13Å; F113-C117 WeakPolarHBondContact CE2-SG 3.39Å; F113-C117 WeakPolarHBondContact CZ-SG 3.42Å; F113-C117 PolarHBondContact O-N 3.22Å; F113-C117 PolarHBondContact O-SG 2.63Å; F113-I136 HydrophobicContact CD2-CG2 4.02Å; F113-I136 HydrophobicContact CE2-CG2 3.83Å; F113-Y140 HydrophobicContact CB-CD1 3.87Å; F113-Y140 HydrophobicContact CB-CD2 4.3Å; F113-Y140 HydrophobicContact CB-CE1 4.41Å; F113-Y140 HydrophobicContact CB-CG 3.8Å; F113-Y140 HydrophobicContact CD2-CD2 4.1Å; F113-Y140 AromaticContact CD2-CG 3.93Å; F113-Y140 HydrophobicContact CD2-CG 3.93Å; F113-Y140 HydrophobicContact CG-CG 4.32Å; F113-I141 HydrophobicContact CD2-CD1 4.37Å; F113-I141 HydrophobicContact CE2-CD1 3.71Å; F113-I141 HydrophobicContact CZ-CD1 4.11Å; F113-V149 HydrophobicContact CB-CG1 3.75Å; F113-V149 HydrophobicContact CD1-CG1 4.32Å; F113-V149 HydrophobicContact CD1-CG2 4.12Å; F113-V149 HydrophobicContact CD2-CG2 4.45Å; F113-V149 HydrophobicContact CE1-CG2 4.37Å; F113-V149 HydrophobicContact CG-CG1 4.08Å; F113-V149 HydrophobicContact CG-CG2 4.15Å; F113-Y171 HydrophobicContact CE2-CD1 4.33Å; F113-Y171 HydrophobicContact CZ-CD1 4.48Å; F113-A174 HydrophobicContact CE1-CB 4.21Å; F113-A174 HydrophobicContact CZ-CB 3.8Å; F113-I178 HydrophobicContact CD1-CB 3.99Å; F113-I178 HydrophobicContact CD1-CG1 3.69Å; F113-I178 HydrophobicContact CD1-CG2 4.11Å; F113-I178 HydrophobicContact CE1-CB 4.16Å; F113-I178 HydrophobicContact CE1-CG1 3.7Å
114	W	98.5	Very high	97.6	Very high	29 Å²	29	47.9 Å²	47.9	11%	0.11	22%	0.223	C	C	.	.	H	α-helix	trans	-59.8	-44	178.6	-175.8	92.3	0	0	0	112	M89 N110 L111 L112 C117 E118 Q175 Y179 M182	M89-W114 HydrophobicContact CE-CD2 3.67Å; M89-W114 HydrophobicContact CE-CE3 3.62Å; M89-W114 HydrophobicContact CE-CG 4.3Å; M89-W114 HydrophobicContact CE-CH2 4.04Å; M89-W114 HydrophobicContact CE-CZ2 4.09Å; M89-W114 HydrophobicContact CE-CZ3 3.81Å; N110-W114 WeakPolarHBondContact O-CB 3.46Å; N110-W114 PolarHBondContact O-N 3.02Å; N110-W114 VanDerWaalsContact O-N 3.11Å; L111-W114 HydrophobicContact CD1-CE3 4.38Å; L111-W114 PolarHBondContact O-N 3.09Å; L112-W114 VanDerWaalsContact C-N 3.34Å; W114-C117 WeakPolarHBondContact O-CB 3.24Å; W114-C117 PolarHBondContact O-N 3.45Å; W114-E118 HydrophobicContact CD2-CG 4.17Å; W114-E118 HydrophobicContact CE3-CG 3.88Å; W114-E118 HydrophobicContact CH2-CG 3.48Å; W114-E118 VanDerWaalsContact CH2-CG 3.48Å; W114-E118 HydrophobicContact CZ2-CG 3.79Å; W114-E118 HydrophobicContact CZ3-CG 3.53Å; W114-E118 PolarHBondContact O-N 2.75Å; W114-Q175 HydrophobicContact CG-CG 4.16Å; W114-Q175 PolarHBondContact O-NE2 3.31Å; W114-Q175 VanDerWaalsContact O-NE2 3.15Å; W114-Y179 AromaticContact CD1-CD2 3.82Å; W114-Y179 AromaticContact CE2-CD2 3.97Å; W114-Y179 HydrophobicContact CZ2-CD2 4.48Å; W114-Y179 HydrophobicContact CZ2-CE2 4.41Å; W114-Y179 AromaticContact NE1-CD2 3.34Å; W114-Y179 VanDerWaalsContact NE1-CD2 3.34Å; W114-M182 HydrophobicContact CB-CE 4.01Å; W114-M182 HydrophobicContact CG-CE 4.2Å
115	L	97.8	Very high	97.6	Very high	29 Å²	29	48.2 Å²	48.2	15%	0.152	22%	0.222	C	C	.	.	H	α-helix	trans	-63.3	-41.5	175.9	-75.6	169.1	0	0	0	112.1	L111 L112 F113 C117 E118 D119	L111-L115 HydrophobicContact CD1-CD1 4.49Å; L111-L115 HydrophobicContact CD1-CG 4.37Å; L111-L115 HydrophobicContact CG-CD1 4.18Å; L111-L115 WeakPolarHBondContact O-CB 3.43Å; L111-L115 WeakPolarHBondContact O-CG 3.5Å; L111-L115 PolarHBondContact O-N 2.65Å; L112-L115 PolarHBondContact O-N 2.52Å; F113-L115 VanDerWaalsContact C-N 3.34Å; F113-L115 PolarHBondContact O-N 3.3Å; L115-C117 VanDerWaalsContact C-N 3.29Å; L115-C117 PolarHBondContact O-N 2.74Å; L115-E118 WeakPolarHBondContact O-CB 3.44Å; L115-E118 PolarHBondContact O-N 2.6Å; L115-D119 WeakPolarHBondContact O-CB 3.35Å; L115-D119 PolarHBondContact O-N 3.29Å
116	A	98.1	Very high	97.6	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.008	24%	0.238	C	C	.	.	H	α-helix	trans	-64.1	-35.6	177.1	0	0	0	0	0	111.9	I64 L112 F113 D119 L120 I136 Y140	I64-A116 HydrophobicContact CD1-CB 3.9Å; L112-A116 WeakPolarHBondContact O-CB 3.48Å; L112-A116 PolarHBondContact O-N 3.03Å; F113-A116 PolarHBondContact O-N 3.13Å; A116-D119 PolarHBondContact O-N 2.95Å; A116-L120 WeakPolarHBondContact O-CB 3.4Å; A116-L120 PolarHBondContact O-N 3.23Å; A116-I136 HydrophobicContact CB-CD1 3.98Å; A116-I136 HydrophobicContact CB-CG1 3.81Å; A116-I136 WeakPolarHBondContact O-CD1 3.12Å; A116-Y140 HydrophobicContact CB-CE2 4.13Å
117	C	98.3	Very high	97.6	Very high	3 Å²	3	49.9 Å²	49.9	2%	0.02	23%	0.233	C	C	.	.	H	α-helix	trans	-67	-42.2	172.7	-64.7	0	0	0	0	112.3	F113 W114 L115 D119 L120 K121 Y171 Q175	F113-C117 WeakPolarHBondContact CE2-SG 3.39Å; F113-C117 WeakPolarHBondContact CZ-SG 3.42Å; F113-C117 PolarHBondContact O-N 3.22Å; F113-C117 PolarHBondContact O-SG 2.63Å; W114-C117 WeakPolarHBondContact O-CB 3.24Å; W114-C117 PolarHBondContact O-N 3.45Å; L115-C117 VanDerWaalsContact C-N 3.29Å; L115-C117 PolarHBondContact O-N 2.74Å; C117-D119 VanDerWaalsContact C-N 3.27Å; C117-D119 PolarHBondContact O-N 3.42Å; C117-L120 PolarHBondContact O-N 3.05Å; C117-K121 WeakPolarHBondContact O-CG 3.49Å; C117-K121 PolarHBondContact O-N 3.42Å; C117-K121 VanDerWaalsContact O-N 3.08Å; C117-Y171 VanDerWaalsContact SG-CB 3.59Å; C117-Q175 HydrophobicContact CB-CB 4.13Å; C117-Q175 VanDerWaalsContact CB-CD 3.44Å; C117-Q175 HydrophobicContact CB-CG 3.8Å
118	E	97.7	Very high	97.6	Very high	56 Å²	56	51.4 Å²	51.4	26%	0.262	24%	0.241	S	C	.	.	H	α-helix	trans	-59.5	-39.8	173.3	-73.5	-58.7	108.7	0	0	112	W114 L115 K121 K122 Q175	W114-E118 HydrophobicContact CD2-CG 4.17Å; W114-E118 HydrophobicContact CE3-CG 3.88Å; W114-E118 HydrophobicContact CH2-CG 3.48Å; W114-E118 VanDerWaalsContact CH2-CG 3.48Å; W114-E118 HydrophobicContact CZ2-CG 3.79Å; W114-E118 HydrophobicContact CZ3-CG 3.53Å; W114-E118 PolarHBondContact O-N 2.75Å; L115-E118 WeakPolarHBondContact O-CB 3.44Å; L115-E118 PolarHBondContact O-N 2.6Å; E118-K121 WeakPolarHBondContact OE1-CE 3.49Å; E118-K121 IonicContact OE1-NZ 3.64Å; E118-K121 PolarHBondContact OE1-NZ 3.35Å; E118-K122 WeakPolarHBondContact O-CE 3.47Å; E118-K122 WeakPolarHBondContact O-CG 3.34Å; E118-Q175 PolarHBondContact OE1-NE2 2.91Å
119	D	96.9	Very high	97.6	Very high	52 Å²	52	49.7 Å²	49.7	28%	0.278	23%	0.234	S	C	.	.	H	α-helix	trans	-69.1	-41.9	177.7	-175	51.6	0	0	0	112.1	L115 A116 C117 K121 K122 K132	L115-D119 WeakPolarHBondContact O-CB 3.35Å; L115-D119 PolarHBondContact O-N 3.29Å; A116-D119 PolarHBondContact O-N 2.95Å; C117-D119 VanDerWaalsContact C-N 3.27Å; C117-D119 PolarHBondContact O-N 3.42Å; D119-K121 VanDerWaalsContact C-N 3.35Å; D119-K121 PolarHBondContact O-N 3.42Å; D119-K122 WeakPolarHBondContact O-CB 3.48Å; D119-K122 PolarHBondContact O-N 3.37Å; D119-K132 IonicContact OD1-NZ 3.52Å; D119-K132 PolarHBondContact OD1-NZ 3.4Å; D119-K132 WeakPolarHBondContact OD2-CE 3.41Å; D119-K132 IonicContact OD2-NZ 3.09Å; D119-K132 PolarHBondContact OD2-NZ 3.03Å
120	L	98	Very high	97.6	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-60.3	-42.1	175.3	-179.5	68.5	0	0	0	112.3	A116 C117 K122 E123 I129 K132 I136 M170 Y171	A116-L120 WeakPolarHBondContact O-CB 3.4Å; A116-L120 PolarHBondContact O-N 3.23Å; C117-L120 PolarHBondContact O-N 3.05Å; L120-K122 PolarHBondContact O-N 2.9Å; L120-K122 VanDerWaalsContact O-N 3.13Å; L120-E123 WeakPolarHBondContact O-CB 3.3Å; L120-E123 PolarHBondContact O-N 3.3Å; L120-I129 HydrophobicContact CD1-CG2 4.3Å; L120-K132 HydrophobicContact CD1-CB 3.72Å; L120-I136 HydrophobicContact CB-CD1 3.95Å; L120-I136 HydrophobicContact CD2-CD1 4.12Å; L120-M170 HydrophobicContact CD2-CG 4.47Å; L120-Y171 HydrophobicContact CD2-CD2 3.54Å; L120-Y171 HydrophobicContact CD2-CE2 3.77Å
121	K	98	Very high	97.6	Very high	61 Å²	61	55.4 Å²	55.4	27%	0.265	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-19.6	-179.8	-75.3	-176.3	-59.2	-172.2	0	113.7	C117 E118 D119 E123 P168 E172	C117-K121 WeakPolarHBondContact O-CG 3.49Å; C117-K121 PolarHBondContact O-N 3.42Å; C117-K121 VanDerWaalsContact O-N 3.08Å; E118-K121 WeakPolarHBondContact OE1-CE 3.49Å; E118-K121 IonicContact OE1-NZ 3.64Å; E118-K121 PolarHBondContact OE1-NZ 3.35Å; D119-K121 VanDerWaalsContact C-N 3.35Å; D119-K121 PolarHBondContact O-N 3.42Å; K121-E123 VanDerWaalsContact C-N 3.32Å; K121-P168 WeakPolarHBondContact CG-O 3.11Å; K121-E172 HydrophobicContact CD-CG 4.43Å
122	K	97.1	Very high	97.5	Very high	129 Å²	129	57.2 Å²	57.2	56%	0.561	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-8	177.2	-63.5	167.2	-167.7	168.1	0	113	E118 D119 L120 Q124	E118-K122 WeakPolarHBondContact O-CE 3.47Å; E118-K122 WeakPolarHBondContact O-CG 3.34Å; D119-K122 WeakPolarHBondContact O-CB 3.48Å; D119-K122 PolarHBondContact O-N 3.37Å; L120-K122 PolarHBondContact O-N 2.9Å; L120-K122 VanDerWaalsContact O-N 3.13Å; K122-Q124 PolarHBondContact O-NE2 3.31Å; K122-Q124 PolarHBondContact O-OE1 3.16Å
123	E	97.1	Very high	97.6	Very high	46 Å²	46	56.7 Å²	56.7	22%	0.215	27%	0.265	C	S	.	.			trans	-88.8	140	-176.4	-63.6	-61.1	162.3	0	0	112.6	L120 K121 V128 I129 K132 P168	L120-E123 WeakPolarHBondContact O-CB 3.3Å; L120-E123 PolarHBondContact O-N 3.3Å; K121-E123 VanDerWaalsContact C-N 3.32Å; E123-V128 HydrophobicContact CG-CG1 3.96Å; E123-I129 HydrophobicContact CB-CG1 3.71Å; E123-K132 HydrophobicContact CG-CD 4.01Å; E123-K132 WeakPolarHBondContact OE1-CE 3.45Å; E123-K132 IonicContact OE1-NZ 3.38Å; E123-K132 PolarHBondContact OE1-NZ 3.2Å; E123-P168 WeakPolarHBondContact O-CG 3.49Å
124	Q	96	Very high	97.5	Very high	158 Å²	158	61.8 Å²	61.8	74%	0.738	28%	0.284	S	S	*	.			trans	-118.2	-14.4	172.7	-61.3	76.7	37.8	0	0	112.6	K122 K126	K122-Q124 PolarHBondContact O-NE2 3.31Å; K122-Q124 PolarHBondContact O-OE1 3.16Å; Q124-K126 PolarHBondContact O-N 2.82Å
125	N	96.9	Very high	97.5	Very high	93 Å²	93	62.4 Å²	62.4	50%	0.497	29%	0.289	S	S	.	.			trans	-80.3	115.9	-179.8	-175.2	-45.1	0	0	0	110.2	K127 V128 I129	N125-K127 PolarHBondContact O-N 2.95Å; N125-K127 VanDerWaalsContact O-N 3.13Å; N125-K127 WeakPolarHBondContact OD1-CB 3.39Å; N125-K127 PolarHBondContact OD1-N 3.39Å; N125-V128 HydrophobicContact CB-CB 4.11Å; N125-V128 HydrophobicContact CB-CG2 3.85Å; N125-V128 PolarHBondContact O-N 2.85Å; N125-I129 WeakPolarHBondContact O-CG1 3.32Å; N125-I129 PolarHBondContact O-N 2.84Å
126	K	96.5	Very high	97.5	Very high	118 Å²	118	61.1 Å²	61.1	51%	0.513	28%	0.282	S	S	.	.	H	α-helix	trans	-50.7	-41.4	-178.4	-176.4	167.5	-177.7	156.8	0	113.3	Q124 I129 E130 D165	Q124-K126 PolarHBondContact O-N 2.82Å; K126-I129 PolarHBondContact O-N 2.63Å; K126-E130 WeakPolarHBondContact CE-OE1 3.36Å; K126-E130 WeakPolarHBondContact O-CB 3.47Å; K126-E130 WeakPolarHBondContact O-CG 3.45Å; K126-E130 PolarHBondContact O-N 3.23Å; K126-D165 IonicContact NZ-OD1 2.67Å; K126-D165 PolarHBondContact NZ-OD1 2.94Å; K126-D165 VanDerWaalsContact NZ-OD1 3.12Å
127	K	96.8	Very high	97.5	Very high	155 Å²	155	63.4 Å²	63.4	67%	0.674	29%	0.291	S	S	*	.	H	α-helix	trans	-66.5	-41.1	-179.9	-172.8	179.2	176.8	-176.2	0	111.8	N125 E131	N125-K127 PolarHBondContact O-N 2.95Å; N125-K127 VanDerWaalsContact O-N 3.13Å; N125-K127 WeakPolarHBondContact OD1-CB 3.39Å; N125-K127 PolarHBondContact OD1-N 3.39Å; K127-E131 WeakPolarHBondContact O-CB 3.23Å; K127-E131 PolarHBondContact O-N 3.01Å
128	V	97.2	Very high	97.5	Very high	45 Å²	45	69.2 Å²	69.2	27%	0.273	32%	0.318	S	S	.	.	H	α-helix	trans	-69.7	-40.3	178.3	-178.4	0	0	0	0	110.7	E123 N125 E131 K132	E123-V128 HydrophobicContact CG-CG1 3.96Å; N125-V128 HydrophobicContact CB-CB 4.11Å; N125-V128 HydrophobicContact CB-CG2 3.85Å; N125-V128 PolarHBondContact O-N 2.85Å; V128-E131 PolarHBondContact O-N 2.65Å; V128-K132 HydrophobicContact CG1-CD 4.29Å; V128-K132 HydrophobicContact CG1-CG 4.23Å; V128-K132 WeakPolarHBondContact O-CB 3.35Å; V128-K132 WeakPolarHBondContact O-CG 3.2Å; V128-K132 PolarHBondContact O-N 3.08Å
129	I	97.9	Very high	97.5	Very high	11 Å²	11	68.1 Å²	68.1	6%	0.056	31%	0.314	C	S	.	.	H	α-helix	trans	-58.6	-49.4	174.9	-67.6	160	0	0	0	110.2	L120 E123 N125 K126 E131 A133 P166 P168	L120-I129 HydrophobicContact CD1-CG2 4.3Å; E123-I129 HydrophobicContact CB-CG1 3.71Å; N125-I129 WeakPolarHBondContact O-CG1 3.32Å; N125-I129 PolarHBondContact O-N 2.84Å; K126-I129 PolarHBondContact O-N 2.63Å; I129-E131 VanDerWaalsContact C-N 3.35Å; I129-E131 PolarHBondContact O-N 3.47Å; I129-A133 WeakPolarHBondContact O-CB 3.12Å; I129-A133 PolarHBondContact O-N 3.15Å; I129-P166 HydrophobicContact CG2-CB 4.37Å; I129-P168 HydrophobicContact CD1-CG 3.54Å; I129-P168 HydrophobicContact CG1-CG 3.99Å; I129-P168 HydrophobicContact CG2-CG 4.4Å
130	E	97.6	Very high	97.6	Very high	52 Å²	52	66 Å²	66	24%	0.243	30%	0.302	C	S	.	.	H	α-helix	trans	-60.8	-41.9	178.3	-81.5	-172.8	-147.9	0	0	113	K126 R134 P166	K126-E130 WeakPolarHBondContact CE-OE1 3.36Å; K126-E130 WeakPolarHBondContact O-CB 3.47Å; K126-E130 WeakPolarHBondContact O-CG 3.45Å; K126-E130 PolarHBondContact O-N 3.23Å; E130-R134 WeakPolarHBondContact O-CB 3.25Å; E130-R134 VanDerWaalsContact O-CG 3.3Å; E130-R134 WeakPolarHBondContact O-CG 3.36Å; E130-R134 PolarHBondContact O-N 3.22Å; E130-R134 IonicContact OE2-CZ 3.56Å; E130-R134 IonicContact OE2-NH1 3.46Å; E130-R134 PolarHBondContact OE2-NH1 2.66Å; E130-R134 VanDerWaalsContact OE2-NH1 3.08Å; E130-R134 IonicContact OE2-NH2 2.7Å; E130-P166 HydrophobicContact CG-CB 4.37Å; E130-P166 HydrophobicContact CG-CG 4.16Å
131	E	97.6	Very high	97.6	Very high	114 Å²	114	66 Å²	66	53%	0.533	30%	0.302	S	S	.	.	H	α-helix	trans	-66.1	-54.1	177.9	-176.2	168.7	-174.2	0	0	111.1	K127 V128 I129 A133 R134 M135	K127-E131 WeakPolarHBondContact O-CB 3.23Å; K127-E131 PolarHBondContact O-N 3.01Å; V128-E131 PolarHBondContact O-N 2.65Å; I129-E131 VanDerWaalsContact C-N 3.35Å; I129-E131 PolarHBondContact O-N 3.47Å; E131-A133 PolarHBondContact O-N 3.44Å; E131-R134 PolarHBondContact O-N 3.35Å; E131-M135 HydrophobicContact CG-SD 4.11Å; E131-M135 VanDerWaalsContact O-CG 3.3Å; E131-M135 WeakPolarHBondContact O-CG 3.24Å; E131-M135 PolarHBondContact O-N 3.41Å
132	K	98.1	Very high	97.5	Very high	38 Å²	38	64.2 Å²	64.2	17%	0.165	30%	0.297	C	S	.	.	H	α-helix	trans	-61.5	-41.2	179.2	-72.8	-164.4	-171.8	-178	0	112.4	D119 L120 E123 V128 M135 I136	D119-K132 IonicContact OD1-NZ 3.52Å; D119-K132 PolarHBondContact OD1-NZ 3.4Å; D119-K132 WeakPolarHBondContact OD2-CE 3.41Å; D119-K132 IonicContact OD2-NZ 3.09Å; D119-K132 PolarHBondContact OD2-NZ 3.03Å; L120-K132 HydrophobicContact CD1-CB 3.72Å; E123-K132 HydrophobicContact CG-CD 4.01Å; E123-K132 WeakPolarHBondContact OE1-CE 3.45Å; E123-K132 IonicContact OE1-NZ 3.38Å; E123-K132 PolarHBondContact OE1-NZ 3.2Å; V128-K132 HydrophobicContact CG1-CD 4.29Å; V128-K132 HydrophobicContact CG1-CG 4.23Å; V128-K132 WeakPolarHBondContact O-CB 3.35Å; V128-K132 WeakPolarHBondContact O-CG 3.2Å; V128-K132 PolarHBondContact O-N 3.08Å; K132-M135 PolarHBondContact O-N 2.64Å; K132-I136 WeakPolarHBondContact O-CB 3.49Å; K132-I136 VanDerWaalsContact O-CG1 3.25Å; K132-I136 WeakPolarHBondContact O-CG1 3.36Å; K132-I136 PolarHBondContact O-N 2.89Å
133	A	98.1	Very high	97.5	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-61.2	-46.5	177.6	0	0	0	0	0	111.6	I129 E131 M135 I136 Y137 P166 M170 Y171	I129-A133 WeakPolarHBondContact O-CB 3.12Å; I129-A133 PolarHBondContact O-N 3.15Å; E131-A133 PolarHBondContact O-N 3.44Å; A133-M135 VanDerWaalsContact C-N 3.34Å; A133-M135 PolarHBondContact O-N 3.14Å; A133-I136 PolarHBondContact O-N 3.12Å; A133-Y137 PolarHBondContact O-N 3.4Å; A133-P166 HydrophobicContact CB-CB 3.73Å; A133-P166 HydrophobicContact CB-CG 4.32Å; A133-M170 HydrophobicContact CB-SD 3.63Å; A133-Y171 HydrophobicContact CB-CE2 4.26Å; A133-Y171 PolarHBondContact O-OH 3.19Å
134	R	97.6	Very high	97.4	Very high	107 Å²	107	69 Å²	69	40%	0.404	33%	0.328	S	S	.	.	H	α-helix	trans	-62.6	-41.3	176.4	-71.9	178.4	-176.3	116.5	4	111.9	E130 E131 Y137 E138 L163	E130-R134 WeakPolarHBondContact O-CB 3.25Å; E130-R134 VanDerWaalsContact O-CG 3.3Å; E130-R134 WeakPolarHBondContact O-CG 3.36Å; E130-R134 PolarHBondContact O-N 3.22Å; E130-R134 IonicContact OE2-CZ 3.56Å; E130-R134 IonicContact OE2-NH1 3.46Å; E130-R134 PolarHBondContact OE2-NH1 2.66Å; E130-R134 VanDerWaalsContact OE2-NH1 3.08Å; E130-R134 IonicContact OE2-NH2 2.7Å; E131-R134 PolarHBondContact O-N 3.35Å; R134-Y137 WeakPolarHBondContact O-CB 3.34Å; R134-Y137 PolarHBondContact O-N 3.47Å; R134-E138 WeakPolarHBondContact O-CG 3.37Å; R134-E138 PolarHBondContact O-N 2.91Å; R134-L163 HydrophobicContact CG-CD1 4.21Å
135	M	97.8	Very high	97.5	Very high	41 Å²	41	62.2 Å²	62.2	20%	0.202	30%	0.299	C	S	.	.	H	α-helix	trans	-61.8	-46	175.5	-68.4	175.6	74.6	0	0	112.3	M61 E131 K132 A133 Y137 E138 D139	M61-M135 HydrophobicContact CB-CE 3.79Å; M61-M135 HydrophobicContact CE-CB 3.75Å; M61-M135 HydrophobicContact CE-CE 3.92Å; M61-M135 HydrophobicContact CG-CE 4.19Å; M61-M135 HydrophobicContact SD-CE 3.36Å; M61-M135 WeakPolarHBondContact SD-CE 3.45Å; M61-M135 HydrophobicContact SD-SD 4.33Å; E131-M135 HydrophobicContact CG-SD 4.11Å; E131-M135 VanDerWaalsContact O-CG 3.3Å; E131-M135 WeakPolarHBondContact O-CG 3.24Å; E131-M135 PolarHBondContact O-N 3.41Å; K132-M135 PolarHBondContact O-N 2.64Å; A133-M135 VanDerWaalsContact C-N 3.34Å; A133-M135 PolarHBondContact O-N 3.14Å; M135-Y137 VanDerWaalsContact C-N 3.27Å; M135-Y137 PolarHBondContact O-N 2.81Å; M135-E138 PolarHBondContact O-N 3.24Å; M135-D139 WeakPolarHBondContact O-CB 3.35Å; M135-D139 PolarHBondContact O-N 3.01Å
136	I	98.5	Very high	97.5	Very high	2 Å²	2	64.2 Å²	64.2	1%	0.01	32%	0.316	C	S	.	.	H	α-helix	trans	-59.6	-41.5	175.8	-70.3	166	0	0	0	110.7	F113 A116 L120 K132 A133 Y140 Y171	F113-I136 HydrophobicContact CD2-CG2 4.02Å; F113-I136 HydrophobicContact CE2-CG2 3.83Å; A116-I136 HydrophobicContact CB-CD1 3.98Å; A116-I136 HydrophobicContact CB-CG1 3.81Å; A116-I136 WeakPolarHBondContact O-CD1 3.12Å; L120-I136 HydrophobicContact CB-CD1 3.95Å; L120-I136 HydrophobicContact CD2-CD1 4.12Å; K132-I136 WeakPolarHBondContact O-CB 3.49Å; K132-I136 VanDerWaalsContact O-CG1 3.25Å; K132-I136 WeakPolarHBondContact O-CG1 3.36Å; K132-I136 PolarHBondContact O-N 2.89Å; A133-I136 PolarHBondContact O-N 3.12Å; I136-Y140 HydrophobicContact CG2-CD2 4.24Å; I136-Y140 PolarHBondContact O-N 3.4Å; I136-Y171 HydrophobicContact CB-CE2 3.94Å; I136-Y171 HydrophobicContact CD1-CD2 4.38Å; I136-Y171 HydrophobicContact CD1-CE2 4.2Å; I136-Y171 HydrophobicContact CG2-CD1 4.43Å; I136-Y171 HydrophobicContact CG2-CD2 4.02Å; I136-Y171 HydrophobicContact CG2-CE1 4.08Å; I136-Y171 HydrophobicContact CG2-CE2 3.65Å; I136-Y171 HydrophobicContact CG2-CG 4.41Å
137	Y	98.4	Very high	97.5	Very high	49 Å²	49	62.5 Å²	62.5	19%	0.192	31%	0.309	C	S	.	.	I	π-helix	trans	-61	-50	176.4	-175.6	-88.1	0	0	0	111.9	A133 R134 M135 I141 S142 I159 N160 L163	A133-Y137 PolarHBondContact O-N 3.4Å; R134-Y137 WeakPolarHBondContact O-CB 3.34Å; R134-Y137 PolarHBondContact O-N 3.47Å; M135-Y137 VanDerWaalsContact C-N 3.27Å; M135-Y137 PolarHBondContact O-N 2.81Å; Y137-I141 HydrophobicContact CD2-CB 3.77Å; Y137-I141 HydrophobicContact CD2-CG1 4.33Å; Y137-I141 HydrophobicContact CD2-CG2 3.81Å; Y137-I141 HydrophobicContact CE2-CB 4.1Å; Y137-I141 HydrophobicContact CE2-CG2 3.69Å; Y137-I141 HydrophobicContact CG-CB 4.25Å; Y137-I141 CarbonylContact O-C 3.37Å; Y137-I141 WeakPolarHBondContact O-CA 3.45Å; Y137-I141 WeakPolarHBondContact O-CB 3.42Å; Y137-I141 PolarHBondContact O-N 3.43Å; Y137-S142 PolarHBondContact O-N 3.49Å; Y137-I159 HydrophobicContact CD2-CG2 3.78Å; Y137-I159 HydrophobicContact CE2-CG2 4.06Å; Y137-N160 WeakPolarHBondContact CE2-OD1 3.23Å; Y137-N160 PolarHBondContact OH-OD1 3.32Å; Y137-N160 VanDerWaalsContact OH-OD1 3.07Å; Y137-L163 HydrophobicContact CD1-CD2 3.99Å; Y137-L163 HydrophobicContact CD2-CD1 4.37Å; Y137-L163 HydrophobicContact CD2-CD2 3.91Å; Y137-L163 HydrophobicContact CE1-CD2 4.17Å; Y137-L163 HydrophobicContact CE2-CD2 4.1Å; Y137-L163 HydrophobicContact CG-CD1 4.22Å; Y137-L163 HydrophobicContact CG-CD2 3.85Å
138	E	98	Very high	97.5	Very high	126 Å²	126	58.7 Å²	58.7	59%	0.589	29%	0.293	S	S	*	.	I	π-helix	trans	-63.2	-41.3	-179.6	-72.7	174.1	-168.7	0	0	112.2	R134 M135 S145	R134-E138 WeakPolarHBondContact O-CG 3.37Å; R134-E138 PolarHBondContact O-N 2.91Å; M135-E138 PolarHBondContact O-N 3.24Å; E138-S145 WeakPolarHBondContact O-CB 3.34Å
139	D	97.9	Very high	97.6	Very high	33 Å²	33	56.6 Å²	56.6	18%	0.176	28%	0.281	C	S	.	.	I	π-helix	trans	-81.2	-33.4	-175.4	-78.3	-20.8	0	0	0	113.7	M135 S145 K147	M135-D139 WeakPolarHBondContact O-CB 3.35Å; M135-D139 PolarHBondContact O-N 3.01Å; D139-S145 VanDerWaalsContact C-OG 3.28Å; D139-S145 WeakPolarHBondContact O-CB 3.41Å; D139-S145 PolarHBondContact O-OG 2.75Å; D139-K147 WeakPolarHBondContact O-CB 3.48Å
140	Y	98.4	Very high	97.5	Very high	7 Å²	7	60.5 Å²	60.5	3%	0.027	31%	0.309	C	S	.	.	I	π-helix	trans	-127.3	-21.5	-169.7	-54.6	-72.3	0	0	0	114.7	L112 F113 A116 I136 K147 E148 V149	L112-Y140 HydrophobicContact CB-CE1 3.83Å; F113-Y140 HydrophobicContact CB-CD1 3.87Å; F113-Y140 HydrophobicContact CB-CD2 4.3Å; F113-Y140 HydrophobicContact CB-CE1 4.41Å; F113-Y140 HydrophobicContact CB-CG 3.8Å; F113-Y140 HydrophobicContact CD2-CD2 4.1Å; F113-Y140 AromaticContact CD2-CG 3.93Å; F113-Y140 HydrophobicContact CD2-CG 3.93Å; F113-Y140 HydrophobicContact CG-CG 4.32Å; A116-Y140 HydrophobicContact CB-CE2 4.13Å; I136-Y140 HydrophobicContact CG2-CD2 4.24Å; I136-Y140 PolarHBondContact O-N 3.4Å; Y140-K147 HydrophobicContact CD1-CB 4.21Å; Y140-K147 HydrophobicContact CE1-CB 4.36Å; Y140-K147 HydrophobicContact CE1-CD 4.34Å; Y140-E148 CarbonylContact O-C 3.58Å; Y140-E148 WeakPolarHBondContact O-CA 3.46Å; Y140-V149 WeakPolarHBondContact O-CG2 3.42Å; Y140-V149 PolarHBondContact O-N 2.96Å
141	I	98.2	Very high	97.5	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.302	C	S	.	.	I	π-helix	trans	-103.4	-39.1	-175.1	-50.3	-59.8	0	0	0	111.4	F113 Y137 I143 V149 L151 R156 I159 Y171	F113-I141 HydrophobicContact CD2-CD1 4.37Å; F113-I141 HydrophobicContact CE2-CD1 3.71Å; F113-I141 HydrophobicContact CZ-CD1 4.11Å; Y137-I141 HydrophobicContact CD2-CB 3.77Å; Y137-I141 HydrophobicContact CD2-CG1 4.33Å; Y137-I141 HydrophobicContact CD2-CG2 3.81Å; Y137-I141 HydrophobicContact CE2-CB 4.1Å; Y137-I141 HydrophobicContact CE2-CG2 3.69Å; Y137-I141 HydrophobicContact CG-CB 4.25Å; Y137-I141 CarbonylContact O-C 3.37Å; Y137-I141 WeakPolarHBondContact O-CA 3.45Å; Y137-I141 WeakPolarHBondContact O-CB 3.42Å; Y137-I141 PolarHBondContact O-N 3.43Å; I141-I143 PolarHBondContact O-N 3.26Å; I141-V149 HydrophobicContact CD1-CG2 4.13Å; I141-L151 HydrophobicContact CD1-CD1 3.59Å; I141-R156 PolarHBondContact O-NH1 2.9Å; I141-R156 PolarHBondContact O-NH2 2.98Å; I141-I159 HydrophobicContact CD1-CD1 4.03Å; I141-I159 HydrophobicContact CG1-CD1 4.47Å; I141-I159 HydrophobicContact CG2-CD1 4.39Å; I141-I159 HydrophobicContact CG2-CG2 4.17Å; I141-Y171 HydrophobicContact CD1-CE1 4.39Å; I141-Y171 HydrophobicContact CG1-CE1 3.97Å
142	S	96.9	Very high	97.5	Very high	25 Å²	25	58.2 Å²	58.2	18%	0.175	30%	0.302	C	S	.	.			trans	-54.7	133.4	-177	-178.5	0	0	0	0	111.8	Y137 L144 S145	Y137-S142 PolarHBondContact O-N 3.49Å; S142-L144 PolarHBondContact O-N 3.08Å; S142-L144 PolarHBondContact OG-N 2.95Å; S142-S145 VanDerWaalsContact O-CB 3.25Å; S142-S145 WeakPolarHBondContact O-CB 3.33Å; S142-S145 PolarHBondContact O-N 3.15Å
143	I	95.9	Very high	97.4	Very high	122 Å²	122	61.4 Å²	61.4	63%	0.626	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-10.6	174	64	174.7	0	0	0	113.4	I141	I141-I143 PolarHBondContact O-N 3.26Å
144	L	96.4	Very high	97.4	Very high	153 Å²	153	70.9 Å²	70.9	80%	0.801	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	-2.7	176.6	-55.2	-179.5	0	0	0	111.7	S142	S142-L144 PolarHBondContact O-N 3.08Å; S142-L144 PolarHBondContact OG-N 2.95Å
145	S	96.7	Very high	97.3	Very high	16 Å²	16	66.9 Å²	66.9	11%	0.112	35%	0.352	C	S	.	.			trans	-76.6	135.1	179.8	-177.7	0	0	0	0	111.1	E138 D139 S142 K147 E148	E138-S145 WeakPolarHBondContact O-CB 3.34Å; D139-S145 VanDerWaalsContact C-OG 3.28Å; D139-S145 WeakPolarHBondContact O-CB 3.41Å; D139-S145 PolarHBondContact O-OG 2.75Å; S142-S145 VanDerWaalsContact O-CB 3.25Å; S142-S145 WeakPolarHBondContact O-CB 3.33Å; S142-S145 PolarHBondContact O-N 3.15Å; S145-K147 PolarHBondContact O-N 3.42Å; S145-K147 PolarHBondContact OG-N 2.96Å; S145-E148 PolarHBondContact O-N 3.47Å
146	P	96.5	Very high	97.3	Very high	134 Å²	134	66.6 Å²	66.6	87%	0.87	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-12.1	169.3	30.3	-36.1	0	0	0	113.6
147	K	97.1	Very high	97.2	Very high	82 Å²	82	71.1 Å²	71.1	36%	0.357	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.4	28.5	179.1	-64	178.9	-179	176.3	0	111.7	E109 D139 Y140 S145 V149	E109-K147 HydrophobicContact CB-CB 3.93Å; E109-K147 HydrophobicContact CB-CG 4.46Å; D139-K147 WeakPolarHBondContact O-CB 3.48Å; Y140-K147 HydrophobicContact CD1-CB 4.21Å; Y140-K147 HydrophobicContact CE1-CB 4.36Å; Y140-K147 HydrophobicContact CE1-CD 4.34Å; S145-K147 PolarHBondContact O-N 3.42Å; S145-K147 PolarHBondContact OG-N 2.96Å; K147-V149 PolarHBondContact O-N 3.49Å
148	E	97.7	Very high	97.2	Very high	75 Å²	75	71.4 Å²	71.4	35%	0.35	38%	0.377	S	S	.	.			trans	-57.7	126.3	178.1	-179.2	178.4	-159.2	0	0	111.2	Y140 S145 R156	Y140-E148 CarbonylContact O-C 3.58Å; Y140-E148 WeakPolarHBondContact O-CA 3.46Å; S145-E148 PolarHBondContact O-N 3.47Å; E148-R156 IonicContact OE1-CZ 3.01Å; E148-R156 IonicContact OE1-NH1 2.64Å; E148-R156 PolarHBondContact OE1-NH1 3.24Å; E148-R156 IonicContact OE1-NH2 3.08Å
149	V	98.3	Very high	97.2	Very high	1 Å²	1	65.5 Å²	65.5	1%	0.006	35%	0.349	C	S	.	.			trans	-86.6	145.7	173.4	-64.9	0	0	0	0	111.5	E109 F113 Y140 I141 K147 L151 I178	E109-V149 HydrophobicContact CG-CG1 4.1Å; F113-V149 HydrophobicContact CB-CG1 3.75Å; F113-V149 HydrophobicContact CD1-CG1 4.32Å; F113-V149 HydrophobicContact CD1-CG2 4.12Å; F113-V149 HydrophobicContact CD2-CG2 4.45Å; F113-V149 HydrophobicContact CE1-CG2 4.37Å; F113-V149 HydrophobicContact CG-CG1 4.08Å; F113-V149 HydrophobicContact CG-CG2 4.15Å; Y140-V149 WeakPolarHBondContact O-CG2 3.42Å; Y140-V149 PolarHBondContact O-N 2.96Å; I141-V149 HydrophobicContact CD1-CG2 4.13Å; K147-V149 PolarHBondContact O-N 3.49Å; V149-L151 HydrophobicContact CG2-CD1 3.92Å; V149-L151 HydrophobicContact CG2-CG 3.95Å; V149-L151 PolarHBondContact O-N 3.24Å; V149-I178 HydrophobicContact CB-CD1 3.74Å; V149-I178 HydrophobicContact CB-CG1 4.13Å; V149-I178 HydrophobicContact CG2-CD1 4.09Å; V149-I178 HydrophobicContact CG2-CG1 4.12Å
150	S	97.1	Very high	97.1	Very high	93 Å²	93	67.3 Å²	67.3	65%	0.65	36%	0.359	S	S	*	.			trans	-76.6	109.9	-179.5	-164.4	0	0	0	0	111.3	I178	S150-I178 VanDerWaalsContact O-CD1 3.22Å; S150-I178 WeakPolarHBondContact O-CD1 3.44Å
151	L	97.5	Very high	97.1	Very high	19 Å²	19	74.7 Å²	74.7	10%	0.099	39%	0.387	C	S	.	.			trans	-128.3	149.7	-178.4	-66.5	174.2	0	0	0	112.1	I141 V149 V155 R156 I159 A174 Q177 I178	I141-L151 HydrophobicContact CD1-CD1 3.59Å; V149-L151 HydrophobicContact CG2-CD1 3.92Å; V149-L151 HydrophobicContact CG2-CG 3.95Å; V149-L151 PolarHBondContact O-N 3.24Å; L151-V155 HydrophobicContact CD2-CG1 4.48Å; L151-R156 HydrophobicContact CB-CG 3.82Å; L151-R156 HydrophobicContact CD1-CG 4.46Å; L151-I159 HydrophobicContact CD1-CD1 4.12Å; L151-A174 HydrophobicContact CD1-CB 3.79Å; L151-A174 HydrophobicContact CD2-CB 3.77Å; L151-A174 HydrophobicContact CG-CB 4.46Å; L151-Q177 HydrophobicContact CD2-CB 4.11Å; L151-Q177 HydrophobicContact CD2-CG 4.24Å; L151-I178 HydrophobicContact CD2-CD1 3.73Å; L151-I178 HydrophobicContact CD2-CG1 3.79Å; L151-I178 HydrophobicContact CG-CD1 4.37Å
152	D	96.3	Very high	97	Very high	100 Å²	100	77 Å²	77	54%	0.535	40%	0.399	S	S	.	.			trans	-65.5	145.3	174	-76	6.4	0	0	0	110.8	R154 V155 R156 Q177	D152-R154 PolarHBondContact O-N 3.45Å; D152-V155 HydrophobicContact CB-CG2 4.24Å; D152-V155 WeakPolarHBondContact O-CB 3.46Å; D152-V155 PolarHBondContact O-N 2.94Å; D152-R156 PolarHBondContact O-N 3.44Å; D152-R156 VanDerWaalsContact O-N 3.09Å; D152-Q177 PolarHBondContact OD1-NE2 3.15Å
153	S	96.7	Very high	96.9	Very high	104 Å²	104	77.7 Å²	77.7	73%	0.727	40%	0.401	S	S	*	.	H	α-helix	trans	-55.5	-38.5	-178.1	57.4	0	0	0	0	113.3	R156 E157	S153-R156 PolarHBondContact O-N 2.99Å; S153-E157 PolarHBondContact O-N 3.49Å
154	R	96.8	Very high	96.9	Very high	199 Å²	199	79.2 Å²	79.2	75%	0.751	41%	0.409	S	S	*	.	H	α-helix	trans	-62.5	-42	176.7	-179.6	177.8	174.4	168.5	-1.6	112.2	D152 E157 V158	D152-R154 PolarHBondContact O-N 3.45Å; R154-E157 PolarHBondContact O-N 2.87Å; R154-V158 WeakPolarHBondContact O-CG2 3.28Å; R154-V158 PolarHBondContact O-N 3.11Å
155	V	97.3	Very high	96.9	Very high	23 Å²	23	76.8 Å²	76.8	14%	0.139	40%	0.397	C	S	.	.	H	α-helix	trans	-66.2	-43.7	179.3	175.9	0	0	0	0	109.8	L151 D152 E157 V158 I159 D173 A174	L151-V155 HydrophobicContact CD2-CG1 4.48Å; D152-V155 HydrophobicContact CB-CG2 4.24Å; D152-V155 WeakPolarHBondContact O-CB 3.46Å; D152-V155 PolarHBondContact O-N 2.94Å; V155-E157 VanDerWaalsContact C-N 3.32Å; V155-E157 PolarHBondContact O-N 3.13Å; V155-V158 PolarHBondContact O-N 2.97Å; V155-I159 HydrophobicContact CG1-CD1 4.23Å; V155-I159 WeakPolarHBondContact O-CG1 3.45Å; V155-I159 PolarHBondContact O-N 3.38Å; V155-D173 HydrophobicContact CG1-CB 4.39Å; V155-A174 HydrophobicContact CG1-CB 3.61Å
156	R	97.3	Very high	96.9	Very high	36 Å²	36	76.4 Å²	76.4	14%	0.136	39%	0.394	C	S	.	.	H	α-helix	trans	-60.7	-40.3	175.8	-64	-178.5	65.6	95.8	5.9	112.5	I141 E148 L151 D152 S153 V158 I159 N160	I141-R156 PolarHBondContact O-NH1 2.9Å; I141-R156 PolarHBondContact O-NH2 2.98Å; E148-R156 IonicContact OE1-CZ 3.01Å; E148-R156 IonicContact OE1-NH1 2.64Å; E148-R156 PolarHBondContact OE1-NH1 3.24Å; E148-R156 IonicContact OE1-NH2 3.08Å; L151-R156 HydrophobicContact CB-CG 3.82Å; L151-R156 HydrophobicContact CD1-CG 4.46Å; D152-R156 PolarHBondContact O-N 3.44Å; D152-R156 VanDerWaalsContact O-N 3.09Å; S153-R156 PolarHBondContact O-N 2.99Å; R156-V158 VanDerWaalsContact C-N 3.34Å; R156-V158 PolarHBondContact O-N 3.25Å; R156-I159 PolarHBondContact O-N 3.3Å; R156-N160 VanDerWaalsContact O-CG 3.24Å; R156-N160 PolarHBondContact O-N 2.86Å; R156-N160 PolarHBondContact O-ND2 3.45Å
157	E	96.8	Very high	96.9	Very high	96 Å²	96	72.8 Å²	72.8	45%	0.449	37%	0.368	S	S	.	.	H	α-helix	trans	-61.2	-42.8	176.8	-170.7	-175.5	172.3	0	0	112	S153 R154 V155 N160 R161	S153-E157 PolarHBondContact O-N 3.49Å; R154-E157 PolarHBondContact O-N 2.87Å; V155-E157 VanDerWaalsContact C-N 3.32Å; V155-E157 PolarHBondContact O-N 3.13Å; E157-N160 PolarHBondContact O-N 3.28Å; E157-R161 WeakPolarHBondContact O-CG 3.45Å; E157-R161 PolarHBondContact O-N 2.85Å; E157-R161 IonicContact OE1-CZ 3.8Å; E157-R161 IonicContact OE1-NE 3.95Å; E157-R161 IonicContact OE1-NH2 2.75Å; E157-R161 PolarHBondContact OE1-NH2 3.4Å
158	V	97.3	Very high	97	Very high	56 Å²	56	70.1 Å²	70.1	34%	0.339	36%	0.359	S	S	.	.	H	α-helix	trans	-63.3	-44.5	176.7	173.9	0	0	0	0	111	R154 V155 R156 N160 R161 N162	R154-V158 WeakPolarHBondContact O-CG2 3.28Å; R154-V158 PolarHBondContact O-N 3.11Å; V155-V158 PolarHBondContact O-N 2.97Å; R156-V158 VanDerWaalsContact C-N 3.34Å; R156-V158 PolarHBondContact O-N 3.25Å; V158-N160 VanDerWaalsContact C-N 3.34Å; V158-N160 PolarHBondContact O-N 2.95Å; V158-R161 PolarHBondContact O-N 2.85Å; V158-N162 PolarHBondContact O-N 3.3Å
159	I	97.9	Very high	97	Very high	2 Å²	2	71.2 Å²	71.2	1%	0.01	36%	0.364	C	S	.	.	H	α-helix	trans	-57.4	-47.1	175.4	-70.2	167.7	0	0	0	111.1	Y137 I141 L151 V155 R156 R161 N162 L163 M170 Y171 A174	Y137-I159 HydrophobicContact CD2-CG2 3.78Å; Y137-I159 HydrophobicContact CE2-CG2 4.06Å; I141-I159 HydrophobicContact CD1-CD1 4.03Å; I141-I159 HydrophobicContact CG1-CD1 4.47Å; I141-I159 HydrophobicContact CG2-CD1 4.39Å; I141-I159 HydrophobicContact CG2-CG2 4.17Å; L151-I159 HydrophobicContact CD1-CD1 4.12Å; V155-I159 HydrophobicContact CG1-CD1 4.23Å; V155-I159 WeakPolarHBondContact O-CG1 3.45Å; V155-I159 PolarHBondContact O-N 3.38Å; R156-I159 PolarHBondContact O-N 3.3Å; I159-R161 VanDerWaalsContact C-N 3.26Å; I159-R161 PolarHBondContact O-N 2.96Å; I159-N162 PolarHBondContact O-N 3.07Å; I159-N162 VanDerWaalsContact O-N 3.15Å; I159-L163 PolarHBondContact O-N 2.89Å; I159-M170 HydrophobicContact CG2-CE 4.37Å; I159-Y171 HydrophobicContact CD1-CD1 3.85Å; I159-Y171 HydrophobicContact CD1-CE1 4.1Å; I159-Y171 HydrophobicContact CG1-CD1 3.98Å; I159-Y171 HydrophobicContact CG1-CE1 4.13Å; I159-Y171 HydrophobicContact CG2-CD1 4.34Å; I159-Y171 HydrophobicContact CG2-CE1 3.63Å; I159-A174 HydrophobicContact CD1-CB 3.76Å
160	N	96.4	Very high	96.9	Very high	71 Å²	71	71.6 Å²	71.6	38%	0.38	37%	0.365	S	S	.	.	H	α-helix	trans	-59.9	-36.5	-179.3	-71.8	-19.1	0	0	0	112.5	Y137 R156 E157 V158	Y137-N160 WeakPolarHBondContact CE2-OD1 3.23Å; Y137-N160 PolarHBondContact OH-OD1 3.32Å; Y137-N160 VanDerWaalsContact OH-OD1 3.07Å; R156-N160 VanDerWaalsContact O-CG 3.24Å; R156-N160 PolarHBondContact O-N 2.86Å; R156-N160 PolarHBondContact O-ND2 3.45Å; E157-N160 PolarHBondContact O-N 3.28Å; V158-N160 VanDerWaalsContact C-N 3.34Å; V158-N160 PolarHBondContact O-N 2.95Å
161	R	97.2	Very high	97	Very high	161 Å²	161	67.3 Å²	67.3	61%	0.608	34%	0.335	S	S	*	.	H	α-helix	trans	-70.6	-44.7	175.3	-66.6	176.2	-174.6	-157.5	3.3	111.4	E157 V158 I159 L163 L164	E157-R161 WeakPolarHBondContact O-CG 3.45Å; E157-R161 PolarHBondContact O-N 2.85Å; E157-R161 IonicContact OE1-CZ 3.8Å; E157-R161 IonicContact OE1-NE 3.95Å; E157-R161 IonicContact OE1-NH2 2.75Å; E157-R161 PolarHBondContact OE1-NH2 3.4Å; V158-R161 PolarHBondContact O-N 2.85Å; I159-R161 VanDerWaalsContact C-N 3.26Å; I159-R161 PolarHBondContact O-N 2.96Å; R161-L163 PolarHBondContact O-N 3.22Å; R161-L164 WeakPolarHBondContact O-CB 3.46Å; R161-L164 WeakPolarHBondContact O-CG 3.33Å; R161-L164 PolarHBondContact O-N 3.33Å
162	N	96.4	Very high	97	Very high	50 Å²	50	70.7 Å²	70.7	27%	0.267	35%	0.35	S	S	.	.	H	α-helix	trans	-66.5	-23.1	179.1	-72.2	-16.4	0	0	0	112.8	V158 I159 L164 D165 P166 M170	V158-N162 PolarHBondContact O-N 3.3Å; I159-N162 PolarHBondContact O-N 3.07Å; I159-N162 VanDerWaalsContact O-N 3.15Å; N162-L164 PolarHBondContact O-N 2.85Å; N162-L164 VanDerWaalsContact O-N 3.16Å; N162-D165 CarbonylContact O-C 3.05Å; N162-D165 PolarHBondContact O-N 3.24Å; N162-D165 VanDerWaalsContact O-N 3.13Å; N162-D165 VanDerWaalsContact O-O 3.13Å; N162-P166 WeakPolarHBondContact O-CA 3.47Å; N162-P166 VanDerWaalsContact O-N 3.16Å; N162-M170 HydrophobicContact CB-CB 3.82Å; N162-M170 HydrophobicContact CB-CE 3.79Å
163	L	95.7	Very high	97.1	Very high	39 Å²	39	71 Å²	71	20%	0.204	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-18.2	176.6	-161.6	67.1	0	0	0	113.2	R134 Y137 I159 R161 M170	R134-L163 HydrophobicContact CG-CD1 4.21Å; Y137-L163 HydrophobicContact CD1-CD2 3.99Å; Y137-L163 HydrophobicContact CD2-CD1 4.37Å; Y137-L163 HydrophobicContact CD2-CD2 3.91Å; Y137-L163 HydrophobicContact CE1-CD2 4.17Å; Y137-L163 HydrophobicContact CE2-CD2 4.1Å; Y137-L163 HydrophobicContact CG-CD1 4.22Å; Y137-L163 HydrophobicContact CG-CD2 3.85Å; I159-L163 PolarHBondContact O-N 2.89Å; R161-L163 PolarHBondContact O-N 3.22Å; L163-M170 HydrophobicContact CB-CE 4.43Å; L163-M170 HydrophobicContact CD1-CE 4.21Å
164	L	95.7	Very high	97.2	Very high	153 Å²	153	66.1 Å²	66.1	80%	0.801	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-32.7	174.7	-59.2	177.5	0	0	0	112.7	R161 N162	R161-L164 WeakPolarHBondContact O-CB 3.46Å; R161-L164 WeakPolarHBondContact O-CG 3.33Å; R161-L164 PolarHBondContact O-N 3.33Å; N162-L164 PolarHBondContact O-N 2.85Å; N162-L164 VanDerWaalsContact O-N 3.16Å
165	D	96	Very high	97.3	Very high	102 Å²	102	57.1 Å²	57.1	55%	0.545	28%	0.284	S	S	.	.	S	Bend	trans	-141.4	81.5	172.6	-170.9	36.1	0	0	0	109.1	K126 N162	K126-D165 IonicContact NZ-OD1 2.67Å; K126-D165 PolarHBondContact NZ-OD1 2.94Å; K126-D165 VanDerWaalsContact NZ-OD1 3.12Å; N162-D165 CarbonylContact O-C 3.05Å; N162-D165 PolarHBondContact O-N 3.24Å; N162-D165 VanDerWaalsContact O-N 3.13Å; N162-D165 VanDerWaalsContact O-O 3.13Å
166	P	97	Very high	97.3	Very high	9 Å²	9	61.2 Å²	61.2	6%	0.058	31%	0.305	C	S	.	.			trans	-59.9	140.9	-174.9	-27.2	36.4	0	0	0	113.1	I129 E130 A133 N162 M170	I129-P166 HydrophobicContact CG2-CB 4.37Å; E130-P166 HydrophobicContact CG-CB 4.37Å; E130-P166 HydrophobicContact CG-CG 4.16Å; A133-P166 HydrophobicContact CB-CB 3.73Å; A133-P166 HydrophobicContact CB-CG 4.32Å; N162-P166 WeakPolarHBondContact O-CA 3.47Å; N162-P166 VanDerWaalsContact O-N 3.16Å; P166-M170 HydrophobicContact CB-SD 3.83Å
167	N	97	Very high	97.3	Very high	58 Å²	58	61.7 Å²	61.7	31%	0.31	31%	0.309	S	S	.	.			trans	-133.9	159.2	173	68.8	80.5	0	0	0	110.1	H169 M170	N167-H169 PolarHBondContact O-N 3.38Å; N167-H169 WeakPolarHBondContact OD1-CA 3.43Å; N167-H169 PolarHBondContact OD1-N 2.97Å; N167-M170 WeakPolarHBondContact O-CB 3.25Å; N167-M170 VanDerWaalsContact O-CG 3.29Å; N167-M170 WeakPolarHBondContact O-CG 3.48Å; N167-M170 PolarHBondContact O-N 3.39Å; N167-M170 PolarHBondContact OD1-N 3.45Å; N167-M170 VanDerWaalsContact OD1-N 3.09Å
168	P	97.7	Very high	97.4	Very high	26 Å²	26	57.1 Å²	57.1	17%	0.169	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-21.9	-175.7	-24.8	33.8	0	0	0	115	K121 E123 I129	K121-P168 WeakPolarHBondContact CG-O 3.11Å; E123-P168 WeakPolarHBondContact O-CG 3.49Å; I129-P168 HydrophobicContact CD1-CG 3.54Å; I129-P168 HydrophobicContact CG1-CG 3.99Å; I129-P168 HydrophobicContact CG2-CG 4.4Å
169	H	97.8	Very high	97.5	Very high	97 Å²	97	56 Å²	56	45%	0.449	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	5	-172.5	-58.7	-76.1	0	0	0	112.8	N167 Y171 E172	N167-H169 PolarHBondContact O-N 3.38Å; N167-H169 WeakPolarHBondContact OD1-CA 3.43Å; N167-H169 PolarHBondContact OD1-N 2.97Å; H169-Y171 PolarHBondContact O-N 2.9Å; H169-E172 HydrophobicContact CB-CG 4.14Å; H169-E172 IonicContact CE1-OE1 2.71Å; H169-E172 IonicContact CG-OE1 3.51Å; H169-E172 IonicContact ND1-OE1 2.74Å; H169-E172 PolarHBondContact ND1-OE1 3.26Å; H169-E172 WeakPolarHBondContact O-CG 3.26Å; H169-E172 PolarHBondContact O-N 3.02Å; H169-E172 VanDerWaalsContact O-N 3.17Å
170	M	97.7	Very high	97.5	Very high	9 Å²	9	58 Å²	58	4%	0.044	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-17.5	-171.7	69.2	-178.8	-77.1	0	0	115	L120 A133 I159 N162 L163 P166 N167	L120-M170 HydrophobicContact CD2-CG 4.47Å; A133-M170 HydrophobicContact CB-SD 3.63Å; I159-M170 HydrophobicContact CG2-CE 4.37Å; N162-M170 HydrophobicContact CB-CB 3.82Å; N162-M170 HydrophobicContact CB-CE 3.79Å; L163-M170 HydrophobicContact CB-CE 4.43Å; L163-M170 HydrophobicContact CD1-CE 4.21Å; P166-M170 HydrophobicContact CB-SD 3.83Å; N167-M170 WeakPolarHBondContact O-CB 3.25Å; N167-M170 VanDerWaalsContact O-CG 3.29Å; N167-M170 WeakPolarHBondContact O-CG 3.48Å; N167-M170 PolarHBondContact O-N 3.39Å; N167-M170 PolarHBondContact OD1-N 3.45Å; N167-M170 VanDerWaalsContact OD1-N 3.09Å
171	Y	98.4	Very high	97.6	Very high	3 Å²	3	57.8 Å²	57.8	1%	0.012	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	5.2	180	-64	-65.8	0	0	0	114.1	F113 C117 L120 A133 I136 I141 I159 H169 D173 A174 Q175	F113-Y171 HydrophobicContact CE2-CD1 4.33Å; F113-Y171 HydrophobicContact CZ-CD1 4.48Å; C117-Y171 VanDerWaalsContact SG-CB 3.59Å; L120-Y171 HydrophobicContact CD2-CD2 3.54Å; L120-Y171 HydrophobicContact CD2-CE2 3.77Å; A133-Y171 HydrophobicContact CB-CE2 4.26Å; A133-Y171 PolarHBondContact O-OH 3.19Å; I136-Y171 HydrophobicContact CB-CE2 3.94Å; I136-Y171 HydrophobicContact CD1-CD2 4.38Å; I136-Y171 HydrophobicContact CD1-CE2 4.2Å; I136-Y171 HydrophobicContact CG2-CD1 4.43Å; I136-Y171 HydrophobicContact CG2-CD2 4.02Å; I136-Y171 HydrophobicContact CG2-CE1 4.08Å; I136-Y171 HydrophobicContact CG2-CE2 3.65Å; I136-Y171 HydrophobicContact CG2-CG 4.41Å; I141-Y171 HydrophobicContact CD1-CE1 4.39Å; I141-Y171 HydrophobicContact CG1-CE1 3.97Å; I159-Y171 HydrophobicContact CD1-CD1 3.85Å; I159-Y171 HydrophobicContact CD1-CE1 4.1Å; I159-Y171 HydrophobicContact CG1-CD1 3.98Å; I159-Y171 HydrophobicContact CG1-CE1 4.13Å; I159-Y171 HydrophobicContact CG2-CD1 4.34Å; I159-Y171 HydrophobicContact CG2-CE1 3.63Å; H169-Y171 PolarHBondContact O-N 2.9Å; Y171-D173 PolarHBondContact O-N 3.06Å; Y171-A174 PolarHBondContact O-N 3.47Å; Y171-A174 VanDerWaalsContact O-N 3.15Å; Y171-Q175 VanDerWaalsContact O-CB 3.28Å; Y171-Q175 WeakPolarHBondContact O-CB 3.3Å; Y171-Q175 PolarHBondContact O-N 3.09Å
172	E	97.9	Very high	97.6	Very high	91 Å²	91	50.1 Å²	50.1	43%	0.425	26%	0.259	S	S	.	.	H	α-helix	trans	-56.6	-45.3	-172.8	-76.3	-177.8	160.9	0	0	113.7	K121 H169 A174 Q175 L176	K121-E172 HydrophobicContact CD-CG 4.43Å; H169-E172 HydrophobicContact CB-CG 4.14Å; H169-E172 IonicContact CE1-OE1 2.71Å; H169-E172 IonicContact CG-OE1 3.51Å; H169-E172 IonicContact ND1-OE1 2.74Å; H169-E172 PolarHBondContact ND1-OE1 3.26Å; H169-E172 WeakPolarHBondContact O-CG 3.26Å; H169-E172 PolarHBondContact O-N 3.02Å; H169-E172 VanDerWaalsContact O-N 3.17Å; E172-A174 PolarHBondContact O-N 3.03Å; E172-Q175 PolarHBondContact O-N 3.17Å; E172-L176 WeakPolarHBondContact O-CB 3.38Å; E172-L176 PolarHBondContact O-N 3.37Å
173	D	97.9	Very high	97.7	Very high	106 Å²	106	51.6 Å²	51.6	57%	0.567	26%	0.264	S	S	*	.	H	α-helix	trans	-63.8	-42.6	178	-73.6	-15.7	0	0	0	112	V155 Y171 L176 Q177	V155-D173 HydrophobicContact CG1-CB 4.39Å; Y171-D173 PolarHBondContact O-N 3.06Å; D173-L176 PolarHBondContact O-N 3.49Å; D173-Q177 PolarHBondContact O-N 3.43Å
174	A	98.5	Very high	97.8	Very high	1 Å²	1	59.3 Å²	59.3	1%	0.008	29%	0.291	C	S	.	.	H	α-helix	trans	-67.4	-42.1	177.1	0	0	0	0	0	111.9	F113 L151 V155 I159 Y171 E172 L176 Q177 I178	F113-A174 HydrophobicContact CE1-CB 4.21Å; F113-A174 HydrophobicContact CZ-CB 3.8Å; L151-A174 HydrophobicContact CD1-CB 3.79Å; L151-A174 HydrophobicContact CD2-CB 3.77Å; L151-A174 HydrophobicContact CG-CB 4.46Å; V155-A174 HydrophobicContact CG1-CB 3.61Å; I159-A174 HydrophobicContact CD1-CB 3.76Å; Y171-A174 PolarHBondContact O-N 3.47Å; Y171-A174 VanDerWaalsContact O-N 3.15Å; E172-A174 PolarHBondContact O-N 3.03Å; A174-L176 VanDerWaalsContact C-N 3.3Å; A174-L176 PolarHBondContact O-N 2.82Å; A174-Q177 WeakPolarHBondContact O-CB 3.42Å; A174-Q177 PolarHBondContact O-N 3.47Å; A174-I178 WeakPolarHBondContact O-CG1 3.27Å; A174-I178 PolarHBondContact O-N 2.94Å
175	Q	98.5	Very high	97.9	Very high	11 Å²	11	55.7 Å²	55.7	5%	0.051	27%	0.272	C	S	.	.	H	α-helix	trans	-59.6	-43	176.5	-169.8	-173.5	22.6	0	0	110.6	W114 C117 E118 Y171 E172 I178 Y179	W114-Q175 HydrophobicContact CG-CG 4.16Å; W114-Q175 PolarHBondContact O-NE2 3.31Å; W114-Q175 VanDerWaalsContact O-NE2 3.15Å; C117-Q175 HydrophobicContact CB-CB 4.13Å; C117-Q175 VanDerWaalsContact CB-CD 3.44Å; C117-Q175 HydrophobicContact CB-CG 3.8Å; E118-Q175 PolarHBondContact OE1-NE2 2.91Å; Y171-Q175 VanDerWaalsContact O-CB 3.28Å; Y171-Q175 WeakPolarHBondContact O-CB 3.3Å; Y171-Q175 PolarHBondContact O-N 3.09Å; E172-Q175 PolarHBondContact O-N 3.17Å; Q175-I178 PolarHBondContact O-N 3.42Å; Q175-Y179 VanDerWaalsContact O-CB 3.23Å; Q175-Y179 WeakPolarHBondContact O-CB 3.43Å; Q175-Y179 PolarHBondContact O-N 3.01Å
176	L	98.2	Very high	98	Very high	108 Å²	108	51 Å²	51	57%	0.565	25%	0.247	S	C	*	.	H	α-helix	trans	-65.6	-39.6	176.1	-179.4	61.1	0	0	0	112.2	E172 D173 A174 Y179 T180	E172-L176 WeakPolarHBondContact O-CB 3.38Å; E172-L176 PolarHBondContact O-N 3.37Å; D173-L176 PolarHBondContact O-N 3.49Å; A174-L176 VanDerWaalsContact C-N 3.3Å; A174-L176 PolarHBondContact O-N 2.82Å; L176-Y179 PolarHBondContact O-N 3.19Å; L176-T180 WeakPolarHBondContact O-CB 3.39Å; L176-T180 PolarHBondContact O-N 2.78Å; L176-T180 PolarHBondContact O-OG1 3.38Å
177	Q	98.3	Very high	98	Very high	47 Å²	47	51 Å²	51	22%	0.22	25%	0.247	C	C	.	.	H	α-helix	trans	-61.3	-49.1	176	-176.1	168.6	29.1	0	0	111.4	L151 D152 D173 A174 T180 L181	L151-Q177 HydrophobicContact CD2-CB 4.11Å; L151-Q177 HydrophobicContact CD2-CG 4.24Å; D152-Q177 PolarHBondContact OD1-NE2 3.15Å; D173-Q177 PolarHBondContact O-N 3.43Å; A174-Q177 WeakPolarHBondContact O-CB 3.42Å; A174-Q177 PolarHBondContact O-N 3.47Å; Q177-T180 PolarHBondContact O-N 3.27Å; Q177-L181 PolarHBondContact O-N 2.76Å
178	I	98.4	Very high	98	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-67.9	-37.5	178.7	-61.7	-52.3	0	0	0	111.9	N110 F113 V149 S150 L151 A174 Q175 T180 L181 M182	N110-I178 HydrophobicContact CB-CG2 3.59Å; N110-I178 WeakPolarHBondContact O-CG2 3.25Å; F113-I178 HydrophobicContact CD1-CB 3.99Å; F113-I178 HydrophobicContact CD1-CG1 3.69Å; F113-I178 HydrophobicContact CD1-CG2 4.11Å; F113-I178 HydrophobicContact CE1-CB 4.16Å; F113-I178 HydrophobicContact CE1-CG1 3.7Å; V149-I178 HydrophobicContact CB-CD1 3.74Å; V149-I178 HydrophobicContact CB-CG1 4.13Å; V149-I178 HydrophobicContact CG2-CD1 4.09Å; V149-I178 HydrophobicContact CG2-CG1 4.12Å; S150-I178 VanDerWaalsContact O-CD1 3.22Å; S150-I178 WeakPolarHBondContact O-CD1 3.44Å; L151-I178 HydrophobicContact CD2-CD1 3.73Å; L151-I178 HydrophobicContact CD2-CG1 3.79Å; L151-I178 HydrophobicContact CG-CD1 4.37Å; A174-I178 WeakPolarHBondContact O-CG1 3.27Å; A174-I178 PolarHBondContact O-N 2.94Å; Q175-I178 PolarHBondContact O-N 3.42Å; I178-T180 VanDerWaalsContact C-N 3.3Å; I178-T180 PolarHBondContact O-N 3.44Å; I178-L181 HydrophobicContact CD1-CD2 4.25Å; I178-L181 WeakPolarHBondContact O-CB 3.37Å; I178-L181 PolarHBondContact O-N 2.95Å; I178-M182 HydrophobicContact CG2-CE 4.3Å; I178-M182 WeakPolarHBondContact O-CG 3.29Å; I178-M182 PolarHBondContact O-N 2.92Å
179	Y	98.5	Very high	98.1	Very high	32 Å²	32	55 Å²	55	13%	0.125	26%	0.261	C	S	.	.	H	α-helix	trans	-58.4	-44.7	172.5	-171.9	-95.8	0	0	0	111.8	F85 D86 M89 W114 Q175 L176 M182 H183	F85-Y179 HydrophobicContact CD1-CD1 4.49Å; F85-Y179 AromaticContact CD1-CE1 3.73Å; F85-Y179 HydrophobicContact CD1-CE1 3.73Å; F85-Y179 AromaticContact CD1-CE2 4Å; F85-Y179 HydrophobicContact CD1-CE2 4Å; F85-Y179 AromaticContact CD1-CZ 3.44Å; F85-Y179 VanDerWaalsContact CD1-CZ 3.44Å; F85-Y179 WeakPolarHBondContact CD1-OH 3.45Å; F85-Y179 HydrophobicContact CE1-CD1 4.23Å; F85-Y179 AromaticContact CE1-CD2 3.93Å; F85-Y179 HydrophobicContact CE1-CD2 3.93Å; F85-Y179 AromaticContact CE1-CE1 3.84Å; F85-Y179 HydrophobicContact CE1-CE1 3.84Å; F85-Y179 AromaticContact CE1-CE2 3.53Å; F85-Y179 HydrophobicContact CE1-CE2 3.53Å; F85-Y179 HydrophobicContact CE1-CG 4.28Å; F85-Y179 AromaticContact CE1-CZ 3.46Å; F85-Y179 VanDerWaalsContact CE1-CZ 3.46Å; F85-Y179 HydrophobicContact CZ-CE2 4.45Å; D86-Y179 VanDerWaalsContact CA-OH 3.24Å; D86-Y179 WeakPolarHBondContact CA-OH 3.44Å; D86-Y179 WeakPolarHBondContact OD1-CE1 3.44Å; D86-Y179 PolarHBondContact OD1-OH 3.06Å; M89-Y179 HydrophobicContact CB-CE2 3.95Å; M89-Y179 HydrophobicContact CE-CD2 4.23Å; M89-Y179 HydrophobicContact CE-CE2 4Å; M89-Y179 HydrophobicContact CG-CE2 3.72Å; W114-Y179 AromaticContact CD1-CD2 3.82Å; W114-Y179 AromaticContact CE2-CD2 3.97Å; W114-Y179 HydrophobicContact CZ2-CD2 4.48Å; W114-Y179 HydrophobicContact CZ2-CE2 4.41Å; W114-Y179 AromaticContact NE1-CD2 3.34Å; W114-Y179 VanDerWaalsContact NE1-CD2 3.34Å; Q175-Y179 VanDerWaalsContact O-CB 3.23Å; Q175-Y179 WeakPolarHBondContact O-CB 3.43Å; Q175-Y179 PolarHBondContact O-N 3.01Å; L176-Y179 PolarHBondContact O-N 3.19Å; Y179-M182 PolarHBondContact O-N 3.08Å; Y179-H183 WeakPolarHBondContact O-CB 3.36Å; Y179-H183 PolarHBondContact O-N 3.17Å
180	T	98.1	Very high	98.1	Very high	45 Å²	45	50.3 Å²	50.3	28%	0.276	24%	0.24	S	C	.	.	H	α-helix	trans	-66.7	-38.4	177.7	-57.3	0	0	0	0	111.8	L176 Q177 I178 H183 R184	L176-T180 WeakPolarHBondContact O-CB 3.39Å; L176-T180 PolarHBondContact O-N 2.78Å; L176-T180 PolarHBondContact O-OG1 3.38Å; Q177-T180 PolarHBondContact O-N 3.27Å; I178-T180 VanDerWaalsContact C-N 3.3Å; I178-T180 PolarHBondContact O-N 3.44Å; T180-H183 PolarHBondContact O-N 2.93Å; T180-R184 HydrophobicContact CG2-CG 4.29Å; T180-R184 WeakPolarHBondContact O-CB 3.11Å; T180-R184 WeakPolarHBondContact O-CG 3.41Å; T180-R184 PolarHBondContact O-N 2.93Å
181	L	98	Very high	98	Very high	66 Å²	66	51.6 Å²	51.6	35%	0.346	25%	0.247	S	C	.	.	H	α-helix	trans	-59.2	-53.6	174.3	176.1	63.5	0	0	0	110.9	Q177 I178 H183 R184 D185	Q177-L181 PolarHBondContact O-N 2.76Å; I178-L181 HydrophobicContact CD1-CD2 4.25Å; I178-L181 WeakPolarHBondContact O-CB 3.37Å; I178-L181 PolarHBondContact O-N 2.95Å; L181-H183 VanDerWaalsContact C-N 3.32Å; L181-H183 PolarHBondContact O-N 3.03Å; L181-R184 PolarHBondContact O-N 2.8Å; L181-D185 PolarHBondContact O-N 3.25Å
182	M	98.3	Very high	97.9	Very high	0 Å²	0	57 Å²	57	0%	0	28%	0.276	C	S	.	.	I	π-helix	trans	-58.8	-43.3	177.8	-70.6	-171.1	-66.9	0	0	112	F85 M89 F98 L102 N110 L111 W114 I178 Y179 R184 S186 F187	F85-M182 HydrophobicContact CZ-CB 3.97Å; M89-M182 HydrophobicContact CE-CE 4.2Å; F98-M182 HydrophobicContact CE1-CB 4.11Å; F98-M182 HydrophobicContact CE1-CG 4.41Å; F98-M182 HydrophobicContact CE1-SD 3.98Å; F98-M182 HydrophobicContact CZ-CB 4.24Å; L102-M182 HydrophobicContact CD1-SD 4.2Å; N110-M182 HydrophobicContact CB-CG 3.72Å; N110-M182 HydrophobicContact CB-SD 3.78Å; L111-M182 HydrophobicContact CB-SD 3.89Å; L111-M182 HydrophobicContact CD1-SD 4.49Å; W114-M182 HydrophobicContact CB-CE 4.01Å; W114-M182 HydrophobicContact CG-CE 4.2Å; I178-M182 HydrophobicContact CG2-CE 4.3Å; I178-M182 WeakPolarHBondContact O-CG 3.29Å; I178-M182 PolarHBondContact O-N 2.92Å; Y179-M182 PolarHBondContact O-N 3.08Å; M182-R184 PolarHBondContact O-N 3.31Å; M182-S186 PolarHBondContact O-N 2.94Å; M182-F187 VanDerWaalsContact O-CB 3.3Å; M182-F187 WeakPolarHBondContact O-CB 3.3Å; M182-F187 PolarHBondContact O-N 2.87Å
183	H	98.2	Very high	97.9	Very high	80 Å²	80	53.6 Å²	53.6	37%	0.37	26%	0.262	S	S	.	.	I	π-helix	trans	-64.4	-39.2	179.5	-172.9	-174.1	0	0	0	112.3	F85 Y179 T180 L181 F187 P188	F85-H183 VanDerWaalsContact CB-CD2 3.49Å; F85-H183 WeakPolarHBondContact CB-CD2 3.47Å; F85-H183 HydrophobicContact CD1-CB 3.52Å; F85-H183 AromaticContact CD1-CD2 3.92Å; F85-H183 AromaticContact CD1-CG 3.56Å; F85-H183 HydrophobicContact CE1-CB 3.66Å; F85-H183 HydrophobicContact CG-CB 4.13Å; F85-H183 AromaticContact CG-CD2 3.73Å; F85-H183 AromaticContact CG-CG 3.87Å; F85-H183 HydrophobicContact CZ-CB 4.37Å; Y179-H183 WeakPolarHBondContact O-CB 3.36Å; Y179-H183 PolarHBondContact O-N 3.17Å; T180-H183 PolarHBondContact O-N 2.93Å; L181-H183 VanDerWaalsContact C-N 3.32Å; L181-H183 PolarHBondContact O-N 3.03Å; H183-F187 AromaticContact CD2-CD1 3.84Å; H183-P188 WeakPolarHBondContact O-CD 3.49Å
184	R	97.5	Very high	97.8	Very high	201 Å²	201	54.3 Å²	54.3	76%	0.758	26%	0.262	S	S	*	.	I	π-helix	trans	-86.6	-31.2	-174	-70.8	-175.3	177.8	-175.2	0.9	114	T180 L181 M182	T180-R184 HydrophobicContact CG2-CG 4.29Å; T180-R184 WeakPolarHBondContact O-CB 3.11Å; T180-R184 WeakPolarHBondContact O-CG 3.41Å; T180-R184 PolarHBondContact O-N 2.93Å; L181-R184 PolarHBondContact O-N 2.8Å; M182-R184 PolarHBondContact O-N 3.31Å
185	D	97.5	Very high	97.6	Very high	77 Å²	77	56 Å²	56	41%	0.412	27%	0.271	S	S	.	.	I	π-helix	trans	-106.3	-66.9	-175.7	-180	39.9	0	0	0	112.7	L181 P188 R189	L181-D185 PolarHBondContact O-N 3.25Å; D185-P188 WeakPolarHBondContact O-CD 3.35Å; D185-R189 IonicContact OD1-CZ 2.6Å; D185-R189 IonicContact OD1-NE 3.47Å; D185-R189 PolarHBondContact OD1-NE 3.04Å; D185-R189 IonicContact OD1-NH2 2.63Å; D185-R189 IonicContact OD2-CZ 2.63Å; D185-R189 IonicContact OD2-NH2 3.29Å; D185-R189 PolarHBondContact OD2-NH2 3.25Å
186	S	97.8	Very high	97.5	Very high	3 Å²	3	56.2 Å²	56.2	2%	0.021	27%	0.271	C	S	.	.	I	π-helix	trans	-68.9	-38.6	-173.3	-60.4	0	0	0	0	113.1	F101 L102 E105 M182 R189 F190	F101-S186 VanDerWaalsContact CE1-O 3.32Å; F101-S186 WeakPolarHBondContact CE1-O 3.5Å; L102-S186 VanDerWaalsContact CD2-CB 3.46Å; E105-S186 VanDerWaalsContact OE1-CB 3.23Å; E105-S186 WeakPolarHBondContact OE1-CB 3.42Å; E105-S186 PolarHBondContact OE1-OG 3.2Å; M182-S186 PolarHBondContact O-N 2.94Å; S186-R189 PolarHBondContact O-N 3.38Å; S186-R189 VanDerWaalsContact O-N 3.16Å; S186-F190 WeakPolarHBondContact O-CB 3.22Å; S186-F190 PolarHBondContact O-N 3.16Å
187	F	98	Very high	97.3	Very high	11 Å²	11	55.5 Å²	55.5	5%	0.048	26%	0.263	C	S	.	.	H	α-helix	trans	-65.1	-44.6	-173.3	178.9	-115.5	0	0	0	114	W81 F85 M88 F98 M182 H183 R189 F190 L191	W81-F187 WeakPolarHBondContact O-CZ 3.49Å; F85-F187 HydrophobicContact CB-CD1 4.01Å; F85-F187 HydrophobicContact CB-CE1 3.83Å; F85-F187 HydrophobicContact CB-CG 4.48Å; F85-F187 HydrophobicContact CB-CZ 4.18Å; F85-F187 HydrophobicContact CD2-CB 3.86Å; F85-F187 AromaticContact CD2-CD1 3.77Å; F85-F187 HydrophobicContact CD2-CD1 3.77Å; F85-F187 AromaticContact CD2-CD2 3.36Å; F85-F187 HydrophobicContact CD2-CD2 3.36Å; F85-F187 HydrophobicContact CD2-CE1 4.09Å; F85-F187 AromaticContact CD2-CE2 3.74Å; F85-F187 HydrophobicContact CD2-CE2 3.74Å; F85-F187 AromaticContact CD2-CG 3.36Å; F85-F187 HydrophobicContact CD2-CG 3.36Å; F85-F187 HydrophobicContact CD2-CZ 4.07Å; F85-F187 HydrophobicContact CE2-CB 3.86Å; F85-F187 AromaticContact CE2-CD2 3.78Å; F85-F187 HydrophobicContact CE2-CD2 3.78Å; F85-F187 HydrophobicContact CE2-CE2 4.48Å; F85-F187 AromaticContact CE2-CG 3.84Å; F85-F187 HydrophobicContact CE2-CG 3.84Å; F85-F187 HydrophobicContact CG-CD1 4.17Å; F85-F187 HydrophobicContact CG-CD2 4.47Å; F85-F187 HydrophobicContact CG-CE1 4.39Å; F85-F187 HydrophobicContact CG-CG 4.2Å; M88-F187 HydrophobicContact CE-CD2 3.87Å; M88-F187 HydrophobicContact CE-CE2 3.92Å; M88-F187 HydrophobicContact SD-CD2 4.08Å; M88-F187 HydrophobicContact SD-CE2 3.61Å; F98-F187 HydrophobicContact CE2-CB 4.41Å; F98-F187 HydrophobicContact CZ-CB 4.31Å; M182-F187 VanDerWaalsContact O-CB 3.3Å; M182-F187 WeakPolarHBondContact O-CB 3.3Å; M182-F187 PolarHBondContact O-N 2.87Å; H183-F187 AromaticContact CD2-CD1 3.84Å; F187-R189 VanDerWaalsContact C-N 3.26Å; F187-R189 PolarHBondContact O-N 2.55Å; F187-F190 AromaticContact CD2-CD1 3.89Å; F187-F190 HydrophobicContact CD2-CD1 3.89Å; F187-F190 HydrophobicContact CE2-CD1 4.01Å; F187-F190 HydrophobicContact CE2-CE1 4.46Å; F187-F190 WeakPolarHBondContact O-CB 3.41Å; F187-F190 PolarHBondContact O-N 2.95Å; F187-L191 HydrophobicContact CD1-CD1 4.38Å; F187-L191 HydrophobicContact CD2-CG 4.38Å; F187-L191 HydrophobicContact CE1-CD1 3.79Å; F187-L191 HydrophobicContact CE1-CG 4.38Å; F187-L191 HydrophobicContact CE2-CD1 4.2Å; F187-L191 HydrophobicContact CE2-CD2 3.77Å; F187-L191 HydrophobicContact CE2-CG 3.94Å; F187-L191 HydrophobicContact CZ-CD1 3.69Å; F187-L191 HydrophobicContact CZ-CD2 3.9Å; F187-L191 HydrophobicContact CZ-CG 3.95Å; F187-L191 WeakPolarHBondContact O-CG 3.36Å; F187-L191 PolarHBondContact O-N 3.13Å
188	P	97.6	Very high	97.1	Very high	60 Å²	60	55.5 Å²	55.5	39%	0.39	27%	0.269	S	S	.	.	H	α-helix	trans	-58.4	-36.1	171.3	-27.1	34.9	0	0	0	113.4	H183 D185 N192	H183-P188 WeakPolarHBondContact O-CD 3.49Å; D185-P188 WeakPolarHBondContact O-CD 3.35Å; P188-N192 PolarHBondContact O-ND2 2.91Å
189	R	98.2	Very high	96.8	Very high	106 Å²	106	58 Å²	58	40%	0.4	28%	0.28	S	S	.	.	H	α-helix	trans	-71.1	-39	176.8	-64.5	-168.2	-76.2	125.5	1.2	111.3	F101 E105 D185 S186 F187 N192 S193	F101-R189 HydrophobicContact CE1-CB 4.48Å; F101-R189 HydrophobicContact CZ-CB 3.71Å; E105-R189 IonicContact OE1-NH2 3.56Å; E105-R189 PolarHBondContact OE1-NH2 3.08Å; E105-R189 IonicContact OE2-CZ 3.79Å; E105-R189 IonicContact OE2-NE 3.36Å; E105-R189 IonicContact OE2-NH1 3.12Å; E105-R189 PolarHBondContact OE2-NH1 3.37Å; E105-R189 IonicContact OE2-NH2 3.08Å; E105-R189 PolarHBondContact OE2-NH2 3.27Å; E105-R189 VanDerWaalsContact OE2-NH2 3.08Å; D185-R189 IonicContact OD1-CZ 2.6Å; D185-R189 IonicContact OD1-NE 3.47Å; D185-R189 PolarHBondContact OD1-NE 3.04Å; D185-R189 IonicContact OD1-NH2 2.63Å; D185-R189 IonicContact OD2-CZ 2.63Å; D185-R189 IonicContact OD2-NH2 3.29Å; D185-R189 PolarHBondContact OD2-NH2 3.25Å; S186-R189 PolarHBondContact O-N 3.38Å; S186-R189 VanDerWaalsContact O-N 3.16Å; F187-R189 VanDerWaalsContact C-N 3.26Å; F187-R189 PolarHBondContact O-N 2.55Å; R189-N192 PolarHBondContact O-N 3.16Å; R189-S193 PolarHBondContact O-N 3.31Å; R189-S193 VanDerWaalsContact O-N 3.07Å
190	F	98.1	Very high	96.5	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-56.7	-49.8	173.7	168.9	-116.3	0	0	0	112.3	M88 L97 F98 F101 S186 F187 N192 S193 Y196	M88-F190 HydrophobicContact SD-CD1 3.97Å; M88-F190 HydrophobicContact SD-CE1 3.41Å; M88-F190 WeakPolarHBondContact SD-CE1 3.48Å; M88-F190 HydrophobicContact SD-CZ 4.26Å; L97-F190 HydrophobicContact CB-CZ 4.46Å; L97-F190 HydrophobicContact CD2-CE2 4.27Å; L97-F190 HydrophobicContact CD2-CZ 3.8Å; L97-F190 HydrophobicContact CG-CE2 3.94Å; L97-F190 HydrophobicContact CG-CZ 3.85Å; F98-F190 HydrophobicContact CD2-CB 3.88Å; F98-F190 AromaticContact CD2-CD1 3.86Å; F98-F190 HydrophobicContact CD2-CD1 3.86Å; F98-F190 HydrophobicContact CD2-CD2 4.03Å; F98-F190 HydrophobicContact CD2-CE1 4.39Å; F98-F190 AromaticContact CD2-CG 3.64Å; F98-F190 HydrophobicContact CD2-CG 3.64Å; F98-F190 HydrophobicContact CE2-CB 3.77Å; F98-F190 HydrophobicContact CE2-CD1 4.36Å; F98-F190 HydrophobicContact CE2-CG 4.06Å; F101-F190 HydrophobicContact CB-CD2 3.48Å; F101-F190 VanDerWaalsContact CB-CD2 3.48Å; F101-F190 HydrophobicContact CB-CE2 4.02Å; F101-F190 HydrophobicContact CB-CG 4.46Å; F101-F190 HydrophobicContact CD1-CB 3.57Å; F101-F190 AromaticContact CD1-CD2 3.97Å; F101-F190 HydrophobicContact CD1-CD2 3.97Å; F101-F190 HydrophobicContact CD1-CG 4.17Å; F101-F190 HydrophobicContact CD2-CB 4.34Å; F101-F190 HydrophobicContact CD2-CD2 4.13Å; F101-F190 HydrophobicContact CE1-CB 3.68Å; F101-F190 HydrophobicContact CE2-CB 4.43Å; F101-F190 HydrophobicContact CG-CB 3.92Å; F101-F190 AromaticContact CG-CD2 3.57Å; F101-F190 HydrophobicContact CG-CD2 3.57Å; F101-F190 HydrophobicContact CG-CG 4.21Å; F101-F190 HydrophobicContact CZ-CB 4.13Å; F101-F190 VanDerWaalsContact CZ-N 3.33Å; S186-F190 WeakPolarHBondContact O-CB 3.22Å; S186-F190 PolarHBondContact O-N 3.16Å; F187-F190 AromaticContact CD2-CD1 3.89Å; F187-F190 HydrophobicContact CD2-CD1 3.89Å; F187-F190 HydrophobicContact CE2-CD1 4.01Å; F187-F190 HydrophobicContact CE2-CE1 4.46Å; F187-F190 WeakPolarHBondContact O-CB 3.41Å; F187-F190 PolarHBondContact O-N 2.95Å; F190-N192 PolarHBondContact O-N 2.96Å; F190-N192 VanDerWaalsContact O-N 3.15Å; F190-S193 VanDerWaalsContact O-CB 3.24Å; F190-S193 WeakPolarHBondContact O-CB 3.43Å; F190-S193 PolarHBondContact O-N 3.36Å; F190-S193 PolarHBondContact O-OG 3.12Å; F190-Y196 HydrophobicContact CD1-CD2 4.41Å; F190-Y196 AromaticContact CE1-CD2 3.58Å; F190-Y196 HydrophobicContact CE1-CD2 3.58Å; F190-Y196 HydrophobicContact CE1-CE2 4.16Å; F190-Y196 HydrophobicContact CE1-CG 4.27Å; F190-Y196 HydrophobicContact CE2-CD2 4.25Å; F190-Y196 AromaticContact CZ-CD2 3.52Å; F190-Y196 HydrophobicContact CZ-CD2 3.52Å; F190-Y196 HydrophobicContact CZ-CE2 4.4Å; F190-Y196 HydrophobicContact CZ-CG 4.19Å; F190-Y196 VanDerWaalsContact O-CB 3.24Å; F190-Y196 WeakPolarHBondContact O-CB 3.47Å
191	L	96.7	Very high	96.2	Very high	36 Å²	36	61.9 Å²	61.9	19%	0.188	30%	0.298	C	S	.	.	H	α-helix	trans	-62.1	-24.9	-179.8	-64.2	-179.8	0	0	0	113.3	S82 F187 Y196	S82-L191 WeakPolarHBondContact O-CD1 3.35Å; F187-L191 HydrophobicContact CD1-CD1 4.38Å; F187-L191 HydrophobicContact CD2-CG 4.38Å; F187-L191 HydrophobicContact CE1-CD1 3.79Å; F187-L191 HydrophobicContact CE1-CG 4.38Å; F187-L191 HydrophobicContact CE2-CD1 4.2Å; F187-L191 HydrophobicContact CE2-CD2 3.77Å; F187-L191 HydrophobicContact CE2-CG 3.94Å; F187-L191 HydrophobicContact CZ-CD1 3.69Å; F187-L191 HydrophobicContact CZ-CD2 3.9Å; F187-L191 HydrophobicContact CZ-CG 3.95Å; F187-L191 WeakPolarHBondContact O-CG 3.36Å; F187-L191 PolarHBondContact O-N 3.13Å; L191-Y196 HydrophobicContact CD2-CD1 4.23Å; L191-Y196 HydrophobicContact CD2-CD2 4.33Å; L191-Y196 HydrophobicContact CD2-CE1 3.9Å; L191-Y196 HydrophobicContact CD2-CE2 4Å; L191-Y196 HydrophobicContact CD2-CG 4.42Å; L191-Y196 WeakPolarHBondContact O-CD1 3.49Å
192	N	96.4	Very high	95.9	Very high	116 Å²	116	62.2 Å²	62.2	62%	0.62	31%	0.305	S	S	*	.	H	α-helix	trans	-90.8	-12.3	176.7	-73.6	-61.3	0	0	0	113.7	P188 R189 F190 K197	P188-N192 PolarHBondContact O-ND2 2.91Å; R189-N192 PolarHBondContact O-N 3.16Å; F190-N192 PolarHBondContact O-N 2.96Å; F190-N192 VanDerWaalsContact O-N 3.15Å; N192-K197 WeakPolarHBondContact O-CE 3.49Å; N192-K197 PolarHBondContact O-NZ 2.64Å; N192-K197 VanDerWaalsContact O-NZ 3.08Å
193	S	96.9	Very high	95.3	Very high	19 Å²	19	62.8 Å²	62.8	13%	0.133	31%	0.309	C	S	.	.	S	Bend	trans	-69.5	155.9	-175.8	77.2	0	0	0	0	112.8	R189 F190 I195 Y196 K197	R189-S193 PolarHBondContact O-N 3.31Å; R189-S193 VanDerWaalsContact O-N 3.07Å; F190-S193 VanDerWaalsContact O-CB 3.24Å; F190-S193 WeakPolarHBondContact O-CB 3.43Å; F190-S193 PolarHBondContact O-N 3.36Å; F190-S193 PolarHBondContact O-OG 3.12Å; S193-I195 PolarHBondContact O-N 3.15Å; S193-Y196 PolarHBondContact OG-N 3.29Å; S193-K197 WeakPolarHBondContact O-CG 3.48Å; S193-K197 PolarHBondContact O-N 3.41Å
194	Q	96.2	Very high	94.6	Very high	121 Å²	121	61.4 Å²	61.4	57%	0.565	31%	0.311	S	S	*	.	H	α-helix	trans	-66.3	-29.2	173.4	-171.2	57.8	36.5	0	0	111.8	K197 S198	Q194-K197 PolarHBondContact O-N 2.78Å; Q194-S198 PolarHBondContact NE2-OG 3.36Å; Q194-S198 VanDerWaalsContact O-CB 3.27Å; Q194-S198 WeakPolarHBondContact O-CB 3.2Å; Q194-S198 PolarHBondContact O-N 2.7Å; Q194-S198 PolarHBondContact O-OG 2.95Å
195	I	95.3	Very high	93.5	Very high	38 Å²	38	53.5 Å²	53.5	20%	0.195	29%	0.292	C	S	.	.	H	α-helix	trans	-59.3	-52.4	177.8	-66.2	171	0	0	0	109.8	L97 E100 F101 T104 S193 F199	L97-I195 HydrophobicContact CD1-CG2 3.6Å; L97-I195 HydrophobicContact CG-CG2 4.3Å; E100-I195 HydrophobicContact CG-CD1 4.47Å; F101-I195 HydrophobicContact CB-CD1 4.25Å; T104-I195 HydrophobicContact CG2-CD1 3.78Å; S193-I195 PolarHBondContact O-N 3.15Å; I195-F199 WeakPolarHBondContact O-CB 3.25Å; I195-F199 PolarHBondContact O-N 3.05Å; I195-F199 VanDerWaalsContact O-N 3.11Å
196	Y	95.2	Very high	91.8	Very high	14 Å²	14	53.5 Å²	53.5	6%	0.055	30%	0.298	C	S	.	.	H	α-helix	trans	-64.2	-46.4	178.8	-178.9	-105.4	0	0	0	112.2	V78 W81 L97 F190 L191 S193 S198 F199 V200	V78-Y196 HydrophobicContact CG1-CE2 3.92Å; V78-Y196 PolarHBondContact O-OH 3.23Å; W81-Y196 HydrophobicContact CE3-CE2 4.46Å; L97-Y196 HydrophobicContact CD2-CD2 4.39Å; F190-Y196 HydrophobicContact CD1-CD2 4.41Å; F190-Y196 AromaticContact CE1-CD2 3.58Å; F190-Y196 HydrophobicContact CE1-CD2 3.58Å; F190-Y196 HydrophobicContact CE1-CE2 4.16Å; F190-Y196 HydrophobicContact CE1-CG 4.27Å; F190-Y196 HydrophobicContact CE2-CD2 4.25Å; F190-Y196 AromaticContact CZ-CD2 3.52Å; F190-Y196 HydrophobicContact CZ-CD2 3.52Å; F190-Y196 HydrophobicContact CZ-CE2 4.4Å; F190-Y196 HydrophobicContact CZ-CG 4.19Å; F190-Y196 VanDerWaalsContact O-CB 3.24Å; F190-Y196 WeakPolarHBondContact O-CB 3.47Å; L191-Y196 HydrophobicContact CD2-CD1 4.23Å; L191-Y196 HydrophobicContact CD2-CD2 4.33Å; L191-Y196 HydrophobicContact CD2-CE1 3.9Å; L191-Y196 HydrophobicContact CD2-CE2 4Å; L191-Y196 HydrophobicContact CD2-CG 4.42Å; L191-Y196 WeakPolarHBondContact O-CD1 3.49Å; S193-Y196 PolarHBondContact OG-N 3.29Å; Y196-S198 PolarHBondContact O-N 3.06Å; Y196-F199 PolarHBondContact O-N 3.33Å; Y196-V200 HydrophobicContact CD1-CG2 4.29Å; Y196-V200 HydrophobicContact CE1-CG2 3.87Å; Y196-V200 HydrophobicContact CE2-CG2 4.21Å; Y196-V200 WeakPolarHBondContact O-CG2 3.46Å; Y196-V200 PolarHBondContact O-N 3.31Å
197	K	94.5	Very high	89.9	Confident	93 Å²	93	57 Å²	57	40%	0.404	32%	0.322	S	S	.	.	H	α-helix	trans	-60.4	-46	179.7	-69.9	172.5	-178.7	164.3	0	112.5	N192 S193 Q194 F199 V200 E201	N192-K197 WeakPolarHBondContact O-CE 3.49Å; N192-K197 PolarHBondContact O-NZ 2.64Å; N192-K197 VanDerWaalsContact O-NZ 3.08Å; S193-K197 WeakPolarHBondContact O-CG 3.48Å; S193-K197 PolarHBondContact O-N 3.41Å; Q194-K197 PolarHBondContact O-N 2.78Å; K197-F199 VanDerWaalsContact C-N 3.27Å; K197-F199 PolarHBondContact O-N 3.25Å; K197-V200 PolarHBondContact O-N 3.34Å; K197-E201 WeakPolarHBondContact O-CG 3.43Å; K197-E201 PolarHBondContact O-N 2.98Å
198	S	93.7	Very high	87.9	Confident	48 Å²	48	60.8 Å²	60.8	34%	0.336	35%	0.35	S	S	.	.	H	α-helix	trans	-64	-34.4	178.3	-49.6	0	0	0	0	111.7	Q194 Y196 E201 S202	Q194-S198 PolarHBondContact NE2-OG 3.36Å; Q194-S198 VanDerWaalsContact O-CB 3.27Å; Q194-S198 WeakPolarHBondContact O-CB 3.2Å; Q194-S198 PolarHBondContact O-N 2.7Å; Q194-S198 PolarHBondContact O-OG 2.95Å; Y196-S198 PolarHBondContact O-N 3.06Å; S198-E201 PolarHBondContact O-N 3.25Å; S198-S202 WeakPolarHBondContact O-CB 3.49Å; S198-S202 PolarHBondContact O-N 3.23Å; S198-S202 PolarHBondContact O-OG 3.17Å
199	F	92.8	Very high	85.6	Confident	53 Å²	53	66.6 Å²	66.6	23%	0.232	37%	0.372	C	S	.	.	H	α-helix	trans	-71.5	-36.9	176.8	-167	-95.7	0	0	0	112.8	P73 V78 W81 L97 I195 Y196 K197 S202 T203	P73-F199 HydrophobicContact CG-CE1 3.79Å; P73-F199 HydrophobicContact CG-CZ 3.85Å; V78-F199 HydrophobicContact CG1-CD1 3.77Å; V78-F199 HydrophobicContact CG1-CE1 4.22Å; V78-F199 HydrophobicContact CG2-CD1 3.9Å; V78-F199 HydrophobicContact CG2-CE1 3.55Å; W81-F199 HydrophobicContact CH2-CE1 4.32Å; W81-F199 HydrophobicContact CZ3-CE1 4.15Å; L97-F199 HydrophobicContact CD1-CB 4.08Å; L97-F199 HydrophobicContact CD1-CD2 3.83Å; L97-F199 HydrophobicContact CD1-CE2 4.44Å; L97-F199 HydrophobicContact CD1-CG 3.95Å; L97-F199 HydrophobicContact CD2-CB 3.76Å; L97-F199 HydrophobicContact CD2-CD1 3.42Å; L97-F199 VanDerWaalsContact CD2-CD1 3.42Å; L97-F199 HydrophobicContact CD2-CD2 4.07Å; L97-F199 HydrophobicContact CD2-CE1 3.96Å; L97-F199 HydrophobicContact CD2-CG 3.48Å; L97-F199 VanDerWaalsContact CD2-CG 3.48Å; L97-F199 HydrophobicContact CG-CG 4.36Å; I195-F199 WeakPolarHBondContact O-CB 3.25Å; I195-F199 PolarHBondContact O-N 3.05Å; I195-F199 VanDerWaalsContact O-N 3.11Å; Y196-F199 PolarHBondContact O-N 3.33Å; K197-F199 VanDerWaalsContact C-N 3.27Å; K197-F199 PolarHBondContact O-N 3.25Å; F199-S202 PolarHBondContact O-OG 2.91Å; F199-T203 HydrophobicContact CD1-CG2 4.34Å; F199-T203 HydrophobicContact CE1-CG2 4.07Å; F199-T203 HydrophobicContact CZ-CG2 4.39Å; F199-T203 WeakPolarHBondContact O-CG2 3.42Å; F199-T203 PolarHBondContact O-N 3.42Å; F199-T203 VanDerWaalsContact O-N 3.15Å; F199-T203 PolarHBondContact O-OG1 3.34Å
200	V	92.4	Very high	82.7	Confident	27 Å²	27	69.7 Å²	69.7	16%	0.164	41%	0.411	C	S	.	.	H	α-helix	trans	-63.4	-43	171.4	172.8	0	0	0	0	110.7	V78 L79 Y196 K197 T203 A204	V78-V200 HydrophobicContact CG1-CG2 3.54Å; L79-V200 HydrophobicContact CD2-CG1 3.71Å; L79-V200 HydrophobicContact CD2-CG2 4.39Å; L79-V200 HydrophobicContact CG-CG1 4.24Å; Y196-V200 HydrophobicContact CD1-CG2 4.29Å; Y196-V200 HydrophobicContact CE1-CG2 3.87Å; Y196-V200 HydrophobicContact CE2-CG2 4.21Å; Y196-V200 WeakPolarHBondContact O-CG2 3.46Å; Y196-V200 PolarHBondContact O-N 3.31Å; K197-V200 PolarHBondContact O-N 3.34Å; V200-T203 PolarHBondContact O-OG1 3.38Å; V200-A204 PolarHBondContact O-N 2.97Å; V200-A204 VanDerWaalsContact O-N 3.1Å
201	E	91.4	Very high	81.9	Confident	131 Å²	131	73.2 Å²	73.2	61%	0.612	43%	0.431	S	S	*	.	H	α-helix	trans	-66	-41.9	178.6	-71.8	170	-171	0	0	112.5	K197 S198 T203 A204 G205	K197-E201 WeakPolarHBondContact O-CG 3.43Å; K197-E201 PolarHBondContact O-N 2.98Å; S198-E201 PolarHBondContact O-N 3.25Å; E201-T203 VanDerWaalsContact C-N 3.35Å; E201-T203 PolarHBondContact O-N 3.48Å; E201-A204 PolarHBondContact O-N 3.38Å; E201-G205 PolarHBondContact O-N 3Å; E201-G205 VanDerWaalsContact O-N 3.12Å
202	S	90.4	Very high	81.2	Confident	73 Å²	73	75.2 Å²	75.2	51%	0.51	44%	0.444	S	S	.	.	H	α-helix	trans	-66.3	-36.1	179.2	68.7	0	0	0	0	112.7	S198 F199 S206	S198-S202 WeakPolarHBondContact O-CB 3.49Å; S198-S202 PolarHBondContact O-N 3.23Å; S198-S202 PolarHBondContact O-OG 3.17Å; F199-S202 PolarHBondContact O-OG 2.91Å; S202-S206 PolarHBondContact O-N 3.17Å
203	T	87.5	Confident	80.3	Confident	12 Å²	12	72.9 Å²	72.9	7%	0.074	43%	0.434	C	S	.	.	H	α-helix	trans	-73	-34.2	176.3	51	0	0	0	0	112.3	V78 F199 V200 E201 S206 S207	V78-T203 HydrophobicContact CG2-CG2 4.14Å; F199-T203 HydrophobicContact CD1-CG2 4.34Å; F199-T203 HydrophobicContact CE1-CG2 4.07Å; F199-T203 HydrophobicContact CZ-CG2 4.39Å; F199-T203 WeakPolarHBondContact O-CG2 3.42Å; F199-T203 PolarHBondContact O-N 3.42Å; F199-T203 VanDerWaalsContact O-N 3.15Å; F199-T203 PolarHBondContact O-OG1 3.34Å; V200-T203 PolarHBondContact O-OG1 3.38Å; E201-T203 VanDerWaalsContact C-N 3.35Å; E201-T203 PolarHBondContact O-N 3.48Å; T203-S206 PolarHBondContact O-OG 3.21Å; T203-S207 PolarHBondContact O-OG 2.98Å
204	A	83.1	Confident	79.3	Confident	50 Å²	50	76.1 Å²	76.1	41%	0.413	45%	0.452	S	S	.	.	H	α-helix	trans	-65.9	-42.7	174.6	0	0	0	0	0	112.6	A75 V200 E201 S206 S207	A75-A204 HydrophobicContact CB-CB 4.48Å; V200-A204 PolarHBondContact O-N 2.97Å; V200-A204 VanDerWaalsContact O-N 3.1Å; E201-A204 PolarHBondContact O-N 3.38Å; A204-S206 VanDerWaalsContact C-N 3.28Å; A204-S206 PolarHBondContact O-N 3.09Å; A204-S207 PolarHBondContact O-N 3.07Å; A204-S207 VanDerWaalsContact O-N 3.16Å
205	G	73.2	Confident	78.3	Confident	35 Å²	35	73.3 Å²	73.3	36%	0.361	45%	0.445	S	S	.	.	H	α-helix	trans	-62.1	-34.1	179.2	0	0	0	0	0	113.6	E201 S207 S208	E201-G205 PolarHBondContact O-N 3Å; E201-G205 VanDerWaalsContact O-N 3.12Å; G205-S207 VanDerWaalsContact C-N 3.26Å; G205-S207 PolarHBondContact O-N 3.39Å; G205-S208 PolarHBondContact O-N 2.67Å; G205-S208 PolarHBondContact O-OG 3.24Å
206	S	62.6	Low	77.1	Confident	77 Å²	77	75.6 Å²	75.6	54%	0.538	46%	0.461	S	S	.	.	H	α-helix	trans	-68	-21.8	177.7	71.8	0	0	0	0	114.3	S202 T203 A204	S202-S206 PolarHBondContact O-N 3.17Å; T203-S206 PolarHBondContact O-OG 3.21Å; A204-S206 VanDerWaalsContact C-N 3.28Å; A204-S206 PolarHBondContact O-N 3.09Å
207	S	57.7	Low	75.9	Confident	76 Å²	76	80 Å²	80	53%	0.531	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-10.5	-179	-58.5	0	0	0	0	113.3	T203 A204 G205	T203-S207 PolarHBondContact O-OG 2.98Å; A204-S207 PolarHBondContact O-N 3.07Å; A204-S207 VanDerWaalsContact O-N 3.16Å; G205-S207 VanDerWaalsContact C-N 3.26Å; G205-S207 PolarHBondContact O-N 3.39Å
208	S	56.9	Low	74.4	Confident	91 Å²	91	79 Å²	79	64%	0.636	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	-0.6	-176.8	34.7	0	0	0	0	115.5	G205	G205-S208 PolarHBondContact O-N 2.67Å; G205-S208 PolarHBondContact O-OG 3.24Å
209	E	48.6	Very low	72.8	Confident	182 Å²	182	81.6 Å²	81.6	85%	0.85	51%	0.51	S	S	*	.			trans	-116.3	21.4	179.5	-76.3	-173.8	110.3	0	0	114
210	S	37.3	Very low	71	Confident	172 Å²	172	84.2 Å²	84.2	100%	1.203	54%	0.536	S	S	*	.			trans	-120.6	0	170.6	-60.6	0	0	0	0	111.3

Retrieved 210 of 210 residues in 134.8 ms (Link to these results)

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