A0A096MYK6_PAPAN Loading...

E2 ubiquitin-conjugating enzyme

AlphaFold DB (A0A2K6BIP0), UniProt , Accession A0A096MYK6, Species PAPAN (Papio anubis, Olive baboon), Gene UBE2E3, Length 207 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	41.3	Very low	44.8	Very low	242 Å²	242	150.9 Å²	150.9	100%	1.192	76%	0.762	S	S	*	*				0	112	0	-61.5	-172.6	175.3	0	0	105.6
2	S	44	Very low	45.3	Very low	101 Å²	101	146.8 Å²	146.8	71%	0.706	76%	0.758	S	S	*	*			cis	-155	138	9	-68	0	0	0	0	105.1
3	S	46.8	Very low	45.6	Very low	101 Å²	101	144.7 Å²	144.7	71%	0.706	76%	0.759	S	S	*	*				54.8	121	94	-28.6	0	0	0	0	111.1
4	D	49.4	Very low	45.6	Very low	125 Å²	125	143.4 Å²	143.4	67%	0.668	77%	0.768	S	S	*	*				-171.2	138.1	56.8	-93.3	-59.9	0	0	0	108.7
5	R	50.8	Low	45.3	Very low	202 Å²	202	142.8 Å²	142.8	76%	0.762	77%	0.772	S	S	*	*				59.6	140.2	90.9	-63.5	-173	177.5	-173.9	-0.7	112.9
6	Q	47.5	Very low	45.2	Very low	141 Å²	141	141.7 Å²	141.7	66%	0.659	78%	0.778	S	S	*	*			cis	-178.9	155	19.5	-129.9	157.2	-25.7	0	0	110
7	R	47.7	Very low	44.7	Very low	214 Å²	214	140.3 Å²	140.3	81%	0.808	78%	0.781	S	S	*	*			trans	58.1	158	139.5	-94.8	-178.3	170.7	-159.6	-5.8	120
8	S	43.3	Very low	44.2	Very low	87 Å²	87	137.2 Å²	137.2	61%	0.608	79%	0.786	S	S	*	*			cis	-176.1	133.5	12.3	28	0	0	0	0	105.9
9	D	42	Very low	44	Very low	138 Å²	138	136.2 Å²	136.2	74%	0.738	79%	0.788	S	S	*	*				90.6	153.2	99.6	-62	-37.7	0	0	0	115.9
10	D	42.2	Very low	43.9	Very low	138 Å²	138	135.3 Å²	135.3	74%	0.738	79%	0.79	S	S	*	*			trans	83.9	107.8	166.1	-77.9	-68.8	0	0	0	120.4
11	E	38.1	Very low	43.6	Very low	171 Å²	171	136.8 Å²	136.8	80%	0.799	80%	0.795	S	S	*	*				80.9	110.4	68.4	-158.1	175.9	116.8	0	0	111.8
12	S	51.1	Low	43.3	Very low	101 Å²	101	129 Å²	129	71%	0.706	77%	0.768	S	S	*	*				176.9	148.2	89	-61.2	0	0	0	0	111.2
13	P	49	Very low	42.8	Very low	120 Å²	120	130.9 Å²	130.9	78%	0.779	77%	0.771	S	S	*	*			trans	-101.4	129	158.5	33.3	-23.3	0	0	0	111.2	T15	P13-T15 PolarHBondContact O-N 3.01Å
14	S	45	Very low	42.5	Very low	126 Å²	126	133.2 Å²	133.2	88%	0.881	77%	0.771	S	S	*	*			trans	-79.2	114.8	175.4	52.8	0	0	0	0	111.5
15	T	41.3	Very low	41.9	Very low	135 Å²	135	137.4 Å²	137.4	83%	0.828	78%	0.777	S	S	*	*			trans	-82.9	140.2	161.1	53.1	0	0	0	0	110.2	P13	P13-T15 PolarHBondContact O-N 3.01Å
16	S	44.1	Very low	41.3	Very low	125 Å²	125	135.3 Å²	135.3	87%	0.874	78%	0.781	S	S	*	*			trans	-128.8	117.9	154.8	63.5	0	0	0	0	110.7
17	S	37.1	Very low	41.2	Very low	118 Å²	118	134.4 Å²	134.4	83%	0.825	79%	0.788	S	S	*	*			trans	-79.3	144.9	172.1	47.6	0	0	0	0	111.3
18	G	35.3	Very low	40.7	Very low	84 Å²	84	129 Å²	129	87%	0.866	79%	0.788	S	S	*	*			trans	-149.2	98.3	162.1	0	0	0	0	0	109.9
19	S	39.3	Very low	40.8	Very low	119 Å²	119	129.4 Å²	129.4	83%	0.832	80%	0.797	S	S	*	*			trans	-109	141.5	170.8	-70.8	0	0	0	0	109.9
20	S	43.4	Very low	40.9	Very low	117 Å²	117	128.9 Å²	128.9	82%	0.818	80%	0.801	S	S	*	*			trans	168.8	97	143	46.9	0	0	0	0	107.5
21	D	36.8	Very low	40.9	Very low	168 Å²	168	131.3 Å²	131.3	90%	0.898	81%	0.808	S	S	*	*				67.9	131.9	74.5	-112.8	-19.1	0	0	0	117.5
22	A	35.9	Very low	41.2	Very low	77 Å²	77	128.6 Å²	128.6	64%	0.636	81%	0.805	S	S	*	*			trans	84.5	112	151.6	0	0	0	0	0	122.7
23	D	33.5	Very low	40.7	Very low	142 Å²	142	132.9 Å²	132.9	76%	0.759	81%	0.814	S	S	*	*				71.8	115.6	124.4	-76.2	-32.3	0	0	0	121
24	Q	38.9	Very low	40	Very low	150 Å²	150	136.3 Å²	136.3	70%	0.701	82%	0.82	S	S	*	*				178	118.4	106.4	-93.6	156.8	82.6	0	0	115.4
25	R	37.7	Very low	39.6	Very low	212 Å²	212	139.4 Å²	139.4	80%	0.8	82%	0.82	S	S	*	*				50.8	116.8	129.9	-65.5	-178.8	-77.4	-160.3	-7	121
26	D	38.8	Very low	39.3	Very low	159 Å²	159	141.5 Å²	141.5	85%	0.85	82%	0.821	S	S	*	*			trans	-57.2	158.9	156	-66.2	-54.4	0	0	0	112.8
27	P	45.7	Very low	38.8	Very low	122 Å²	122	143.2 Å²	143.2	79%	0.792	82%	0.815	S	S	*	*				-149.4	160	96.6	37.3	-19.3	0	0	0	117.7
28	A	36.7	Very low	38.6	Very low	99 Å²	99	149.2 Å²	149.2	82%	0.818	82%	0.819	S	S	*	*			trans	81.2	116.6	140.9	0	0	0	0	0	121.2
29	A	44.2	Very low	38.9	Very low	97 Å²	97	154.8 Å²	154.8	80%	0.802	82%	0.82	S	S	*	*			trans	-75.5	159.6	163.5	0	0	0	0	0	112.6
30	P	44.6	Very low	38.9	Very low	127 Å²	127	155.1 Å²	155.1	83%	0.825	82%	0.819	S	S	*	*			trans	-107.2	134.3	155.8	33.1	-22	0	0	0	112.1
31	E	42.5	Very low	38.4	Very low	189 Å²	189	155.1 Å²	155.1	88%	0.883	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-85.8	169.5	166.1	-98.6	-162.2	169.1	0	0	111.4
32	P	44	Very low	38.7	Very low	113 Å²	113	151.7 Å²	151.7	73%	0.734	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-96.6	152.9	-144.9	37.1	-34	0	0	0	115
33	E	40	Very low	38.9	Very low	192 Å²	192	152.2 Å²	152.2	90%	0.897	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-86.4	125.2	168.9	-71.6	-174.9	159.3	0	0	111.4
34	E	36.2	Very low	39.4	Very low	191 Å²	191	154.4 Å²	154.4	89%	0.893	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-77.5	132.3	165.3	-74.1	179.4	136.9	0	0	110.7
35	Q	36	Very low	39.4	Very low	192 Å²	192	155.4 Å²	155.4	90%	0.897	83%	0.829	S	S	*	*			trans	-136.9	135.9	154.8	-81.3	-169.6	-8.9	0	0	111.3
36	E	34.6	Very low	39.4	Very low	179 Å²	179	155.2 Å²	155.2	84%	0.836	83%	0.834	S	S	*	*			trans	-89	141.8	-163.9	-162.7	176	-166.8	0	0	113.1
37	E	33.4	Very low	39.4	Very low	160 Å²	160	156 Å²	156	75%	0.748	83%	0.829	S	S	*	*			trans	35.6	130.6	158.7	-72.1	-161.5	129.1	0	0	123.6
38	R	33.6	Very low	38.9	Very low	244 Å²	244	157 Å²	157	92%	0.921	83%	0.829	S	S	*	*				-168.7	117.6	118.9	-98.7	160.1	-164.1	-153.6	6	111.6
39	K	41.9	Very low	38.9	Very low	202 Å²	202	158.4 Å²	158.4	88%	0.878	83%	0.827	S	S	*	*			trans	-70.4	143.9	165.8	-74.6	178	178.1	172.6	0	110.6
40	P	38.1	Very low	38.6	Very low	126 Å²	126	163 Å²	163	82%	0.818	83%	0.829	S	S	*	*			trans	-123.9	155	141.2	28.8	-13.4	0	0	0	113.2
41	S	33.6	Very low	38.4	Very low	117 Å²	117	164.3 Å²	164.3	82%	0.818	83%	0.828	S	S	*	*			trans	-55.5	156.5	-172.2	177.7	0	0	0	0	116.3
42	A	41.9	Very low	38.4	Very low	96 Å²	96	160.6 Å²	160.6	79%	0.793	82%	0.823	S	S	*	*			trans	-51.1	130.8	171	0	0	0	0	0	114.1
43	A	40.2	Very low	38.5	Very low	88 Å²	88	159.8 Å²	159.8	73%	0.727	82%	0.82	S	S	*	*			trans	-162.8	110.4	148.1	0	0	0	0	0	110.5
44	Q	44.1	Very low	38.8	Very low	187 Å²	187	160 Å²	160	87%	0.874	82%	0.818	S	S	*	*			trans	39	107.7	144.5	-67.3	161.8	-27.8	0	0	119.3
45	Q	39.1	Very low	39.5	Very low	172 Å²	172	157.2 Å²	157.2	80%	0.804	81%	0.814	S	S	*	*			trans	-156.3	95.6	136.8	-109.2	170.9	34	0	0	110.3	K47	Q45-K47 PolarHBondContact O-N 2.9Å
46	K	39.4	Very low	40.5	Very low	207 Å²	207	154.5 Å²	154.5	90%	0.9	81%	0.811	S	S	*	*			trans	-66	94.4	163.6	-75.4	-179.8	176.3	179	0	108.2	N48	K46-N48 PolarHBondContact O-N 2.96Å
47	K	37.3	Very low	42.1	Very low	175 Å²	175	150.1 Å²	150.1	76%	0.761	81%	0.805	S	S	*	*			trans	-80.4	103	162.9	-83.2	-177	178.3	176	0	108.1	Q45 T49	Q45-K47 PolarHBondContact O-N 2.9Å; K47-T49 PolarHBondContact O-N 2.94Å
48	N	34.9	Very low	44.4	Very low	145 Å²	145	151.5 Å²	151.5	78%	0.775	81%	0.809	S	S	*	*			trans	-57.7	95.8	164.4	-85.8	-15.5	0	0	0	109.3	K46 K50	K46-N48 PolarHBondContact O-N 2.96Å; N48-K50 PolarHBondContact O-N 3.33Å
49	T	37.7	Very low	46.9	Very low	127 Å²	127	144.1 Å²	144.1	78%	0.779	79%	0.787	S	S	*	*			trans	-69.6	86.3	153.2	43.4	0	0	0	0	107	K47 L51	K47-T49 PolarHBondContact O-N 2.94Å; T49-L51 VanDerWaalsContact C-N 3.3Å; T49-L51 PolarHBondContact O-N 2.84Å
50	K	36.7	Very low	49.4	Very low	193 Å²	193	137 Å²	137	84%	0.839	76%	0.762	S	S	*	*			trans	-58.4	99.9	162.1	-98.9	-177.6	174.4	178.8	0	106.5	N48 S52	N48-K50 PolarHBondContact O-N 3.33Å; K50-S52 PolarHBondContact O-N 3.02Å
51	L	41.6	Very low	52.2	Low	155 Å²	155	136.4 Å²	136.4	81%	0.812	76%	0.757	S	S	*	*			trans	-50.6	112.7	151.5	-102.2	68.2	0	0	0	105.5	T49 S53	T49-L51 VanDerWaalsContact C-N 3.3Å; T49-L51 PolarHBondContact O-N 2.84Å; L51-S53 VanDerWaalsContact C-N 3.26Å; L51-S53 PolarHBondContact O-N 2.98Å
52	S	42.6	Very low	55.2	Low	111 Å²	111	131 Å²	131	78%	0.776	72%	0.719	S	S	*	*			trans	-59.6	98	168.1	-178.8	0	0	0	0	106.5	K50 K54	K50-S52 PolarHBondContact O-N 3.02Å; S52-K54 PolarHBondContact O-N 2.84Å
53	S	44.9	Very low	57.9	Low	96 Å²	96	126.7 Å²	126.7	67%	0.671	68%	0.684	S	S	*	*			trans	-58	107.6	168.1	54.4	0	0	0	0	105.9	L51 T55	L51-S53 VanDerWaalsContact C-N 3.26Å; L51-S53 PolarHBondContact O-N 2.98Å; S53-T55 PolarHBondContact O-N 2.86Å
54	K	47.8	Very low	60.6	Low	197 Å²	197	127.2 Å²	127.2	86%	0.857	67%	0.669	S	S	*	*			trans	-50.1	106	168.6	-77.4	-179	176.5	178.7	0	106.9	S52 T56	S52-K54 PolarHBondContact O-N 2.84Å; K54-T56 PolarHBondContact O-N 2.97Å
55	T	49.2	Very low	63.2	Low	132 Å²	132	120.9 Å²	120.9	81%	0.81	64%	0.638	S	S	*	*			trans	-65.2	101.7	169.2	-12.2	0	0	0	0	105.2	S53 A57	S53-T55 PolarHBondContact O-N 2.86Å; T55-A57 VanDerWaalsContact C-N 3.32Å; T55-A57 PolarHBondContact O-N 3.24Å
56	T	58.9	Low	66.1	Low	136 Å²	136	112.8 Å²	112.8	83%	0.834	60%	0.6	S	S	*	*			trans	-59	102.8	167.9	-40.6	0	0	0	0	105.9	K54 K58	K54-T56 PolarHBondContact O-N 2.97Å; T56-K58 PolarHBondContact O-N 3.39Å; T56-K58 VanDerWaalsContact O-N 3.1Å
57	A	68.3	Low	68.8	Low	87 Å²	87	108.1 Å²	108.1	72%	0.719	58%	0.581	S	S	*	*			trans	-55.7	122.1	-177.9	0	0	0	0	0	108.2	T55 L59	T55-A57 VanDerWaalsContact C-N 3.32Å; T55-A57 PolarHBondContact O-N 3.24Å; A57-L59 PolarHBondContact O-N 3.05Å; A57-L59 VanDerWaalsContact O-N 3.1Å
58	K	80.9	Confident	71.8	Confident	189 Å²	189	105.9 Å²	105.9	82%	0.822	57%	0.572	S	S	*	*			trans	-65	114.6	-179.4	-168.1	176.2	-176.3	179	0	107.5	T56 S60	T56-K58 PolarHBondContact O-N 3.39Å; T56-K58 VanDerWaalsContact O-N 3.1Å; K58-S60 PolarHBondContact O-N 3.05Å
59	L	85.4	Confident	74.8	Confident	89 Å²	89	99.2 Å²	99.2	47%	0.466	54%	0.536	S	S	.	.			trans	-53	138.4	177.8	-69.8	171.2	0	0	0	110.8	A57 A63 K64	A57-L59 PolarHBondContact O-N 3.05Å; A57-L59 VanDerWaalsContact O-N 3.1Å; L59-A63 HydrophobicContact CB-CB 4.36Å; L59-A63 HydrophobicContact CD2-CB 4.28Å; L59-K64 HydrophobicContact CB-CG 3.88Å; L59-K64 WeakPolarHBondContact O-CE 3.37Å; L59-K64 PolarHBondContact O-NZ 3.45Å
60	S	95.5	Very high	77.7	Confident	51 Å²	51	95.4 Å²	95.4	36%	0.357	51%	0.51	S	S	.	.			trans	-60.3	160.3	173.6	67.2	0	0	0	0	110.8	K58 S62 A63 K64 Y91	K58-S60 PolarHBondContact O-N 3.05Å; S60-S62 VanDerWaalsContact C-N 3.3Å; S60-S62 PolarHBondContact O-N 2.66Å; S60-S62 PolarHBondContact OG-OG 3.1Å; S60-A63 PolarHBondContact O-N 2.99Å; S60-A63 VanDerWaalsContact OG-CB 3.23Å; S60-A63 WeakPolarHBondContact OG-CB 3.5Å; S60-A63 PolarHBondContact OG-N 3.34Å; S60-K64 WeakPolarHBondContact O-CG 3.33Å; S60-K64 PolarHBondContact O-N 3.4Å; S60-Y91 PolarHBondContact OG-OH 3.1Å
61	T	95.9	Very high	80.6	Confident	114 Å²	114	89.2 Å²	89.2	70%	0.699	50%	0.495	S	S	*	.	H	α-helix	trans	-59.2	-43	175.2	45.2	0	0	0	0	111.6	K64 R65	T61-K64 PolarHBondContact O-N 3.27Å; T61-R65 WeakPolarHBondContact O-CB 3.48Å; T61-R65 PolarHBondContact O-N 3.43Å
62	S	97.6	Very high	83.2	Confident	4 Å²	4	85.3 Å²	85.3	3%	0.028	47%	0.473	C	S	.	.	H	α-helix	trans	-60.2	-46.9	174	42	0	0	0	0	112.1	S60 K64 R65 I66 Y91 S118 Y120	S60-S62 VanDerWaalsContact C-N 3.3Å; S60-S62 PolarHBondContact O-N 2.66Å; S60-S62 PolarHBondContact OG-OG 3.1Å; S62-K64 PolarHBondContact O-N 3.06Å; S62-R65 WeakPolarHBondContact O-CB 3.26Å; S62-R65 PolarHBondContact O-N 2.86Å; S62-I66 VanDerWaalsContact O-CG1 3.29Å; S62-I66 WeakPolarHBondContact O-CG1 3.47Å; S62-I66 PolarHBondContact O-N 3.44Å; S62-Y91 PolarHBondContact OG-OH 2.98Å; S62-S118 VanDerWaalsContact CB-O 3.28Å; S62-S118 WeakPolarHBondContact CB-O 3.26Å; S62-S118 PolarHBondContact OG-O 2.85Å; S62-Y120 WeakPolarHBondContact CA-O 3.37Å; S62-Y120 WeakPolarHBondContact CB-O 3.39Å
63	A	97.9	Very high	85.8	Confident	6 Å²	6	80.2 Å²	80.2	5%	0.05	44%	0.437	C	S	.	.	H	α-helix	trans	-62.2	-42.6	178.2	0	0	0	0	0	112.2	L59 S60 R65 I66 Q67 I90 Y91	L59-A63 HydrophobicContact CB-CB 4.36Å; L59-A63 HydrophobicContact CD2-CB 4.28Å; S60-A63 PolarHBondContact O-N 2.99Å; S60-A63 VanDerWaalsContact OG-CB 3.23Å; S60-A63 WeakPolarHBondContact OG-CB 3.5Å; S60-A63 PolarHBondContact OG-N 3.34Å; A63-R65 VanDerWaalsContact C-N 3.33Å; A63-R65 PolarHBondContact O-N 3.14Å; A63-I66 PolarHBondContact O-N 2.68Å; A63-Q67 WeakPolarHBondContact O-CB 3.15Å; A63-Q67 PolarHBondContact O-N 3.32Å; A63-I90 HydrophobicContact CB-CD1 3.95Å; A63-I90 VanDerWaalsContact O-CD1 3.29Å; A63-I90 WeakPolarHBondContact O-CD1 3.39Å; A63-Y91 HydrophobicContact CB-CE2 4.46Å; A63-Y91 PolarHBondContact N-OH 3.18Å
64	K	97.9	Very high	88.3	Confident	98 Å²	98	80.5 Å²	80.5	43%	0.426	44%	0.435	S	S	.	.	H	α-helix	trans	-61.5	-41.6	175.4	-71.9	170.3	-179.7	168.8	0	112.1	L59 S60 T61 S62 K68	L59-K64 HydrophobicContact CB-CG 3.88Å; L59-K64 WeakPolarHBondContact O-CE 3.37Å; L59-K64 PolarHBondContact O-NZ 3.45Å; S60-K64 WeakPolarHBondContact O-CG 3.33Å; S60-K64 PolarHBondContact O-N 3.4Å; T61-K64 PolarHBondContact O-N 3.27Å; S62-K64 PolarHBondContact O-N 3.06Å; K64-K68 WeakPolarHBondContact O-CB 3.42Å; K64-K68 PolarHBondContact O-N 3.31Å
65	R	98.3	Very high	90.6	Very high	55 Å²	55	78.4 Å²	78.4	21%	0.208	43%	0.432	C	S	.	.	H	α-helix	trans	-62.8	-47.8	176.9	172.4	62.1	-171.5	-89.6	-17.4	111.3	T61 S62 A63 K68 E69 Y120 P121 P155 L157	T61-R65 WeakPolarHBondContact O-CB 3.48Å; T61-R65 PolarHBondContact O-N 3.43Å; S62-R65 WeakPolarHBondContact O-CB 3.26Å; S62-R65 PolarHBondContact O-N 2.86Å; A63-R65 VanDerWaalsContact C-N 3.33Å; A63-R65 PolarHBondContact O-N 3.14Å; R65-K68 WeakPolarHBondContact O-CB 3.19Å; R65-K68 PolarHBondContact O-N 2.87Å; R65-E69 IonicContact CZ-OE1 3.59Å; R65-E69 IonicContact NE-OE1 3.73Å; R65-E69 PolarHBondContact NE-OE1 3.4Å; R65-E69 IonicContact NH2-OE1 3.05Å; R65-E69 PolarHBondContact NH2-OE1 2.98Å; R65-E69 PolarHBondContact O-N 2.92Å; R65-Y120 HydrophobicContact CG-CD1 3.95Å; R65-Y120 HydrophobicContact CG-CE1 3.69Å; R65-P121 HydrophobicContact CG-CB 4.31Å; R65-P121 HydrophobicContact CG-CG 4.18Å; R65-P155 PolarHBondContact NH1-O 3.28Å; R65-P155 PolarHBondContact NH2-O 3Å; R65-L157 PolarHBondContact NH2-O 3.43Å
66	I	98.6	Very high	92.8	Very high	1 Å²	1	78.3 Å²	78.3	1%	0.005	43%	0.426	C	S	.	.	H	α-helix	trans	-63.6	-42.2	178.6	-64.1	162.3	0	0	0	110.9	S62 A63 K68 E69 L70 I90 Y91 W93 F116 Y120	S62-I66 VanDerWaalsContact O-CG1 3.29Å; S62-I66 WeakPolarHBondContact O-CG1 3.47Å; S62-I66 PolarHBondContact O-N 3.44Å; A63-I66 PolarHBondContact O-N 2.68Å; I66-K68 VanDerWaalsContact C-N 3.31Å; I66-K68 PolarHBondContact O-N 2.89Å; I66-E69 PolarHBondContact O-N 3.42Å; I66-L70 PolarHBondContact O-N 3.29Å; I66-I90 HydrophobicContact CB-CD1 3.89Å; I66-I90 HydrophobicContact CB-CG1 4.26Å; I66-I90 HydrophobicContact CD1-CG1 4.43Å; I66-I90 HydrophobicContact CG2-CD1 3.87Å; I66-I90 HydrophobicContact CG2-CG1 3.89Å; I66-I90 WeakPolarHBondContact CG2-O 3.14Å; I66-Y91 HydrophobicContact CD1-CD1 3.63Å; I66-Y91 HydrophobicContact CD1-CE1 3.63Å; I66-Y91 HydrophobicContact CD1-CG 4.23Å; I66-W93 HydrophobicContact CG2-CZ2 3.59Å; I66-F116 HydrophobicContact CD1-CB 3.66Å; I66-F116 HydrophobicContact CD1-CD1 4.03Å; I66-F116 HydrophobicContact CD1-CD2 4.13Å; I66-F116 HydrophobicContact CD1-CG 3.69Å; I66-F116 HydrophobicContact CG1-CB 4.47Å; I66-F116 HydrophobicContact CG1-CD1 3.9Å; I66-F116 HydrophobicContact CG1-CD2 4.45Å; I66-F116 HydrophobicContact CG1-CE1 4.13Å; I66-F116 HydrophobicContact CG1-CG 4.04Å; I66-F116 HydrophobicContact CG2-CD2 4.47Å; I66-F116 HydrophobicContact CG2-CE2 4.2Å; I66-F116 HydrophobicContact CG2-CZ 4.28Å; I66-Y120 HydrophobicContact CD1-CD1 4.34Å; I66-Y120 HydrophobicContact CG1-CD1 3.72Å; I66-Y120 HydrophobicContact CG1-CE1 4.1Å
67	Q	98.1	Very high	94.5	Very high	109 Å²	109	74.9 Å²	74.9	51%	0.509	41%	0.407	S	S	.	.	H	α-helix	trans	-64.2	-36.6	177.5	-170.1	174.4	18.2	0	0	112.3	A63 L70 A71 I90	A63-Q67 WeakPolarHBondContact O-CB 3.15Å; A63-Q67 PolarHBondContact O-N 3.32Å; Q67-L70 PolarHBondContact O-N 3.23Å; Q67-A71 PolarHBondContact O-N 3.19Å; Q67-A71 VanDerWaalsContact O-N 3.14Å; Q67-I90 HydrophobicContact CB-CD1 4.45Å
68	K	98.3	Very high	95.8	Very high	129 Å²	129	71.1 Å²	71.1	56%	0.561	38%	0.375	S	S	*	.	H	α-helix	trans	-62.8	-48.3	173.2	-168.7	-170.4	-176.6	-118.7	0	111.1	K64 R65 I66 L70 A71 E72	K64-K68 WeakPolarHBondContact O-CB 3.42Å; K64-K68 PolarHBondContact O-N 3.31Å; R65-K68 WeakPolarHBondContact O-CB 3.19Å; R65-K68 PolarHBondContact O-N 2.87Å; I66-K68 VanDerWaalsContact C-N 3.31Å; I66-K68 PolarHBondContact O-N 2.89Å; K68-L70 VanDerWaalsContact C-N 3.29Å; K68-L70 PolarHBondContact O-N 3.37Å; K68-A71 WeakPolarHBondContact O-CB 3.44Å; K68-A71 PolarHBondContact O-N 2.88Å; K68-E72 WeakPolarHBondContact CE-OE1 3.47Å; K68-E72 IonicContact NZ-OE1 3.7Å; K68-E72 PolarHBondContact NZ-OE1 3.47Å; K68-E72 WeakPolarHBondContact O-CG 3.36Å; K68-E72 PolarHBondContact O-N 3.01Å
69	E	98.5	Very high	96.3	Very high	5 Å²	5	66.8 Å²	66.8	2%	0.023	37%	0.366	C	S	.	.	H	α-helix	trans	-64.3	-33.4	177.6	-75.2	-171.7	-131.4	0	0	112.9	R65 I66 A71 E72 I73 Y120 T158 I159	R65-E69 IonicContact CZ-OE1 3.59Å; R65-E69 IonicContact NE-OE1 3.73Å; R65-E69 PolarHBondContact NE-OE1 3.4Å; R65-E69 IonicContact NH2-OE1 3.05Å; R65-E69 PolarHBondContact NH2-OE1 2.98Å; R65-E69 PolarHBondContact O-N 2.92Å; I66-E69 PolarHBondContact O-N 3.42Å; E69-A71 VanDerWaalsContact C-N 3.34Å; E69-E72 PolarHBondContact O-N 3.46Å; E69-I73 WeakPolarHBondContact O-CB 3.23Å; E69-I73 WeakPolarHBondContact O-CG2 3.28Å; E69-I73 PolarHBondContact O-N 3.39Å; E69-Y120 WeakPolarHBondContact OE1-CE1 3.34Å; E69-Y120 PolarHBondContact OE1-OH 3.45Å; E69-Y120 PolarHBondContact OE2-OH 3.4Å; E69-T158 HydrophobicContact CG-CG2 4.41Å; E69-T158 VanDerWaalsContact OE2-CA 3.25Å; E69-T158 WeakPolarHBondContact OE2-CA 3.29Å; E69-T158 VanDerWaalsContact OE2-CB 3.28Å; E69-T158 WeakPolarHBondContact OE2-CB 3.37Å; E69-I159 PolarHBondContact OE2-N 3.03Å
70	L	98.4	Very high	96.7	Very high	46 Å²	46	66.1 Å²	66.1	24%	0.241	36%	0.363	C	S	.	.	H	α-helix	trans	-61.2	-44.4	173.1	-177.7	55.7	0	0	0	111.3	I66 Q67 K68 I73 T74 P85 W93	I66-L70 PolarHBondContact O-N 3.29Å; Q67-L70 PolarHBondContact O-N 3.23Å; K68-L70 VanDerWaalsContact C-N 3.29Å; K68-L70 PolarHBondContact O-N 3.37Å; L70-I73 HydrophobicContact CD1-CG2 4.41Å; L70-I73 WeakPolarHBondContact O-CG2 3.48Å; L70-T74 VanDerWaalsContact O-CB 3.26Å; L70-T74 WeakPolarHBondContact O-CB 3.25Å; L70-T74 PolarHBondContact O-N 2.75Å; L70-T74 PolarHBondContact O-OG1 2.66Å; L70-P85 HydrophobicContact CD1-CG 4.49Å; L70-P85 HydrophobicContact CD2-CG 3.81Å; L70-W93 HydrophobicContact CB-CH2 3.87Å; L70-W93 HydrophobicContact CB-CZ2 3.72Å; L70-W93 HydrophobicContact CD1-CH2 4.03Å; L70-W93 HydrophobicContact CD1-CZ2 4.02Å; L70-W93 HydrophobicContact CG-CZ2 4.34Å
71	A	98.1	Very high	96.8	Very high	63 Å²	63	64.3 Å²	64.3	52%	0.521	35%	0.35	S	S	.	.	H	α-helix	trans	-64.3	-43.7	176.3	0	0	0	0	0	111.3	Q67 K68 E69 T74 L75	Q67-A71 PolarHBondContact O-N 3.19Å; Q67-A71 VanDerWaalsContact O-N 3.14Å; K68-A71 WeakPolarHBondContact O-CB 3.44Å; K68-A71 PolarHBondContact O-N 2.88Å; E69-A71 VanDerWaalsContact C-N 3.34Å; A71-T74 PolarHBondContact O-N 3.34Å; A71-L75 WeakPolarHBondContact O-CB 3.49Å; A71-L75 PolarHBondContact O-N 2.79Å
72	E	97.1	Very high	96.9	Very high	73 Å²	73	61.9 Å²	61.9	34%	0.341	34%	0.337	S	S	.	.	H	α-helix	trans	-61.9	-50	178.4	-70.8	172.2	-176	0	0	111.9	K68 E69 T74 L75 D76	K68-E72 WeakPolarHBondContact CE-OE1 3.47Å; K68-E72 IonicContact NZ-OE1 3.7Å; K68-E72 PolarHBondContact NZ-OE1 3.47Å; K68-E72 WeakPolarHBondContact O-CG 3.36Å; K68-E72 PolarHBondContact O-N 3.01Å; E69-E72 PolarHBondContact O-N 3.46Å; E72-T74 VanDerWaalsContact C-N 3.3Å; E72-T74 PolarHBondContact O-N 2.7Å; E72-L75 PolarHBondContact O-N 3.41Å; E72-D76 PolarHBondContact O-N 2.76Å
73	I	97.1	Very high	96.9	Very high	5 Å²	5	62.5 Å²	62.5	3%	0.026	34%	0.343	C	S	.	.	H	α-helix	trans	-70.5	-25.9	-178.7	-158.8	165.1	0	0	0	113.1	E69 L70 P77 A83 W93 I159 L163	E69-I73 WeakPolarHBondContact O-CB 3.23Å; E69-I73 WeakPolarHBondContact O-CG2 3.28Å; E69-I73 PolarHBondContact O-N 3.39Å; L70-I73 HydrophobicContact CD1-CG2 4.41Å; L70-I73 WeakPolarHBondContact O-CG2 3.48Å; I73-P77 VanDerWaalsContact O-CA 3.26Å; I73-P77 WeakPolarHBondContact O-CA 3.49Å; I73-P77 WeakPolarHBondContact O-CB 3.29Å; I73-A83 HydrophobicContact CD1-CB 3.96Å; I73-W93 HydrophobicContact CG2-CH2 4.32Å; I73-W93 HydrophobicContact CG2-CZ3 4.15Å; I73-I159 HydrophobicContact CD1-CG2 4.11Å; I73-L163 HydrophobicContact CD1-CD1 3.98Å
74	T	96.1	Very high	97	Very high	102 Å²	102	63 Å²	63	63%	0.626	35%	0.349	S	S	*	.	H	α-helix	trans	-73.9	-36.6	174.3	-58	0	0	0	0	110.9	L70 A71 E72	L70-T74 VanDerWaalsContact O-CB 3.26Å; L70-T74 WeakPolarHBondContact O-CB 3.25Å; L70-T74 PolarHBondContact O-N 2.75Å; L70-T74 PolarHBondContact O-OG1 2.66Å; A71-T74 PolarHBondContact O-N 3.34Å; E72-T74 VanDerWaalsContact C-N 3.3Å; E72-T74 PolarHBondContact O-N 2.7Å
75	L	96.6	Very high	97	Very high	153 Å²	153	60.6 Å²	60.6	80%	0.801	34%	0.343	S	S	*	.	H	α-helix	trans	-77.2	-43	179.4	-178.8	63.7	0	0	0	112.2	A71 E72	A71-L75 WeakPolarHBondContact O-CB 3.49Å; A71-L75 PolarHBondContact O-N 2.79Å; E72-L75 PolarHBondContact O-N 3.41Å
76	D	95.6	Very high	96.9	Very high	129 Å²	129	62 Å²	62	69%	0.69	35%	0.351	S	S	*	.	S	Bend	trans	-135.2	77.6	-176.5	-172.4	29.2	0	0	0	110	E72	E72-D76 PolarHBondContact O-N 2.76Å
77	P	95.3	Very high	96.8	Very high	65 Å²	65	64.1 Å²	64.1	42%	0.422	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-69	142	-179.7	27.4	-33.4	0	0	0	110.9	I73	I73-P77 VanDerWaalsContact O-CA 3.26Å; I73-P77 WeakPolarHBondContact O-CA 3.49Å; I73-P77 WeakPolarHBondContact O-CB 3.29Å
78	P	94.4	Very high	96.7	Very high	8 Å²	8	67 Å²	67	5%	0.052	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-57.5	145.5	171.7	-15.9	23.6	0	0	0	110.8	N80 C81 L164	P78-N80 PolarHBondContact O-N 2.76Å; P78-C81 HydrophobicContact CB-CB 3.9Å; P78-C81 HydrophobicContact CG-CB 4.17Å; P78-C81 WeakPolarHBondContact O-CB 3.47Å; P78-C81 PolarHBondContact O-N 3.48Å; P78-L164 HydrophobicContact CB-CD2 3.81Å; P78-L164 HydrophobicContact CB-CG 3.91Å
79	P	92.8	Very high	96.7	Very high	97 Å²	97	64.4 Å²	64.4	63%	0.63	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.6	134.6	176.5	-27.9	34.8	0	0	0	111.5	C81	P79-C81 PolarHBondContact O-N 3.05Å; P79-C81 PolarHBondContact O-SG 3Å; P79-C81 VanDerWaalsContact O-SG 3.36Å
80	N	93.2	Very high	96.6	Very high	76 Å²	76	66.6 Å²	66.6	41%	0.406	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.1	12.9	179.4	-63	-31.5	0	0	0	115.4	P78 L98	P78-N80 PolarHBondContact O-N 2.76Å; N80-L98 HydrophobicContact CB-CB 4.03Å; N80-L98 PolarHBondContact O-N 3.43Å
81	C	97.5	Very high	96.6	Very high	13 Å²	13	66.9 Å²	66.9	9%	0.088	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	149	-179.3	-58.7	0	0	0	0	111.7	P78 P79 T96 L163 C167	P78-C81 HydrophobicContact CB-CB 3.9Å; P78-C81 HydrophobicContact CG-CB 4.17Å; P78-C81 WeakPolarHBondContact O-CB 3.47Å; P78-C81 PolarHBondContact O-N 3.48Å; P79-C81 PolarHBondContact O-N 3.05Å; P79-C81 PolarHBondContact O-SG 3Å; P79-C81 VanDerWaalsContact O-SG 3.36Å; C81-T96 CarbonylContact C-O 3.51Å; C81-T96 WeakPolarHBondContact CA-O 3.28Å; C81-L163 HydrophobicContact CB-CB 4.43Å; C81-L163 HydrophobicContact CB-CD1 4.29Å; C81-C167 PolarHBondContact SG-SG 3.08Å
82	S	97.9	Very high	96.7	Very high	62 Å²	62	67.8 Å²	67.8	43%	0.434	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	152.1	161	63.6	0	0	0	0	109.6	S95 T96	S82-S95 CarbonylContact O-C 3.59Å; S82-S95 WeakPolarHBondContact O-CA 3.13Å; S82-S95 VanDerWaalsContact O-CB 3.31Å; S82-S95 WeakPolarHBondContact O-CB 3.45Å; S82-S95 PolarHBondContact O-OG 3.44Å; S82-T96 PolarHBondContact N-O 2.88Å; S82-T96 PolarHBondContact O-N 3.25Å
83	A	98.4	Very high	96.7	Very high	17 Å²	17	64.4 Å²	64.4	14%	0.14	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	151.3	170.1	0	0	0	0	0	111.8	I73 W93 R94 I114 I159 L163	I73-A83 HydrophobicContact CD1-CB 3.96Å; A83-W93 HydrophobicContact CB-CE3 3.87Å; A83-W93 HydrophobicContact CB-CZ3 4.24Å; A83-R94 VanDerWaalsContact CA-O 3.3Å; A83-R94 WeakPolarHBondContact CA-O 3.31Å; A83-I114 HydrophobicContact CB-CD1 4.37Å; A83-I159 HydrophobicContact CB-CG2 4.44Å; A83-L163 HydrophobicContact CB-CD1 3.98Å
84	G	98.3	Very high	96.8	Very high	17 Å²	17	69.3 Å²	69.3	18%	0.175	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.5	176	173.9	0	0	0	0	0	112.4	W93 R94	G84-W93 VanDerWaalsContact C-CG 3.49Å; G84-W93 CarbonylContact O-C 3.51Å; G84-W93 WeakPolarHBondContact O-CA 3.33Å; G84-W93 VanDerWaalsContact O-CB 3.29Å; G84-W93 WeakPolarHBondContact O-CB 3.35Å; G84-R94 PolarHBondContact N-O 3.36Å; G84-R94 PolarHBondContact O-N 2.82Å
85	P	98.4	Very high	96.9	Very high	48 Å²	48	64.5 Å²	64.5	31%	0.312	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.2	142.8	180	-23.4	32.6	0	0	0	112.6	L70 G87 E92	L70-P85 HydrophobicContact CD1-CG 4.49Å; L70-P85 HydrophobicContact CD2-CG 3.81Å; P85-G87 WeakPolarHBondContact CB-O 3.4Å; P85-G87 PolarHBondContact O-N 2.86Å; P85-E92 CarbonylContact C-O 3.6Å; P85-E92 WeakPolarHBondContact CA-O 3.32Å
86	K	97.4	Very high	97	Very high	84 Å²	84	58.7 Å²	58.7	37%	0.365	33%	0.331	S	S	.	.	S	Bend	trans	-71.9	-21.6	173.6	-66.4	178.5	-177.3	178.8	0	113	E92 W93 R94 D113	K86-E92 HydrophobicContact CD-CB 4.38Å; K86-E92 PolarHBondContact N-O 3.06Å; K86-W93 WeakPolarHBondContact CE-O 3.3Å; K86-R94 HydrophobicContact CG-CB 3.91Å; K86-D113 WeakPolarHBondContact CE-OD1 2.97Å; K86-D113 IonicContact NZ-OD1 3.83Å; K86-D113 PolarHBondContact NZ-OD1 3.47Å; K86-D113 IonicContact NZ-OD2 2.68Å
87	G	96.3	Very high	97.2	Very high	46 Å²	46	52.6 Å²	52.6	47%	0.474	30%	0.298	S	S	.	.	S	Bend	trans	-178.8	-143.5	-175.9	0	0	0	0	0	109.1	P85 N89	P85-G87 WeakPolarHBondContact CB-O 3.4Å; P85-G87 PolarHBondContact O-N 2.86Å; G87-N89 VanDerWaalsContact C-N 3.29Å; G87-N89 PolarHBondContact O-N 2.88Å
88	D	95.7	Very high	97.4	Very high	170 Å²	170	53.2 Å²	53.2	91%	0.909	30%	0.298	S	S	*	.	S	Bend	trans	-71.1	-22.6	-173.3	-58.2	-22.1	0	0	0	114	I90	D88-I90 PolarHBondContact O-N 3.12Å
89	N	97.1	Very high	97.5	Very high	73 Å²	73	53.1 Å²	53.1	39%	0.39	30%	0.298	S	S	.	.			trans	-78.2	104.8	177.5	-174.5	4.1	0	0	0	111.2	G87 Y91 E92	G87-N89 VanDerWaalsContact C-N 3.29Å; G87-N89 PolarHBondContact O-N 2.88Å; N89-Y91 PolarHBondContact O-N 3.12Å; N89-Y91 VanDerWaalsContact O-N 3.12Å; N89-Y91 WeakPolarHBondContact OD1-CB 3.29Å; N89-Y91 PolarHBondContact OD1-N 2.86Å; N89-E92 PolarHBondContact ND2-OE1 2.89Å; N89-E92 PolarHBondContact O-N 3.05Å; N89-E92 VanDerWaalsContact O-N 3.12Å
90	I	97.6	Very high	97.8	Very high	52 Å²	52	49 Å²	49	27%	0.267	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-18.6	-178.9	107.8	163.2	0	0	0	113	A63 I66 Q67 D88 E92 W93	A63-I90 HydrophobicContact CB-CD1 3.95Å; A63-I90 VanDerWaalsContact O-CD1 3.29Å; A63-I90 WeakPolarHBondContact O-CD1 3.39Å; I66-I90 HydrophobicContact CB-CD1 3.89Å; I66-I90 HydrophobicContact CB-CG1 4.26Å; I66-I90 HydrophobicContact CD1-CG1 4.43Å; I66-I90 HydrophobicContact CG2-CD1 3.87Å; I66-I90 HydrophobicContact CG2-CG1 3.89Å; I66-I90 WeakPolarHBondContact CG2-O 3.14Å; Q67-I90 HydrophobicContact CB-CD1 4.45Å; D88-I90 PolarHBondContact O-N 3.12Å; I90-E92 VanDerWaalsContact C-N 3.29Å; I90-W93 PolarHBondContact O-NE1 2.84Å
91	Y	98.5	Very high	98	Very high	52 Å²	52	49.8 Å²	49.8	20%	0.204	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-2.3	179.6	-66.7	-98.4	0	0	0	113.4	S60 S62 A63 I66 N89 T115 F116	S60-Y91 PolarHBondContact OG-OH 3.1Å; S62-Y91 PolarHBondContact OG-OH 2.98Å; A63-Y91 HydrophobicContact CB-CE2 4.46Å; A63-Y91 PolarHBondContact N-OH 3.18Å; I66-Y91 HydrophobicContact CD1-CD1 3.63Å; I66-Y91 HydrophobicContact CD1-CE1 3.63Å; I66-Y91 HydrophobicContact CD1-CG 4.23Å; N89-Y91 PolarHBondContact O-N 3.12Å; N89-Y91 VanDerWaalsContact O-N 3.12Å; N89-Y91 WeakPolarHBondContact OD1-CB 3.29Å; N89-Y91 PolarHBondContact OD1-N 2.86Å; Y91-T115 WeakPolarHBondContact O-CA 3.44Å; Y91-F116 HydrophobicContact CD1-CB 3.79Å; Y91-F116 HydrophobicContact CG-CB 4.49Å; Y91-F116 WeakPolarHBondContact O-CD2 3.45Å; Y91-F116 PolarHBondContact O-N 2.93Å
92	E	98.7	Very high	98	Very high	82 Å²	82	52.7 Å²	52.7	38%	0.383	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	109.3	179.1	-73.2	179.7	-144.8	0	0	110.8	P85 K86 N89 I90	P85-E92 CarbonylContact C-O 3.6Å; P85-E92 WeakPolarHBondContact CA-O 3.32Å; K86-E92 HydrophobicContact CD-CB 4.38Å; K86-E92 PolarHBondContact N-O 3.06Å; N89-E92 PolarHBondContact ND2-OE1 2.89Å; N89-E92 PolarHBondContact O-N 3.05Å; N89-E92 VanDerWaalsContact O-N 3.12Å; I90-E92 VanDerWaalsContact C-N 3.29Å
93	W	98.8	Very high	98	Very high	1 Å²	1	50.6 Å²	50.6	0%	0.004	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	154	-178	-76.7	29.7	0	0	0	111.4	I66 L70 I73 A83 G84 K86 I90 I114 F116 I159	I66-W93 HydrophobicContact CG2-CZ2 3.59Å; L70-W93 HydrophobicContact CB-CH2 3.87Å; L70-W93 HydrophobicContact CB-CZ2 3.72Å; L70-W93 HydrophobicContact CD1-CH2 4.03Å; L70-W93 HydrophobicContact CD1-CZ2 4.02Å; L70-W93 HydrophobicContact CG-CZ2 4.34Å; I73-W93 HydrophobicContact CG2-CH2 4.32Å; I73-W93 HydrophobicContact CG2-CZ3 4.15Å; A83-W93 HydrophobicContact CB-CE3 3.87Å; A83-W93 HydrophobicContact CB-CZ3 4.24Å; G84-W93 VanDerWaalsContact C-CG 3.49Å; G84-W93 CarbonylContact O-C 3.51Å; G84-W93 WeakPolarHBondContact O-CA 3.33Å; G84-W93 VanDerWaalsContact O-CB 3.29Å; G84-W93 WeakPolarHBondContact O-CB 3.35Å; K86-W93 WeakPolarHBondContact CE-O 3.3Å; I90-W93 PolarHBondContact O-NE1 2.84Å; W93-I114 HydrophobicContact CB-CB 3.95Å; W93-I114 HydrophobicContact CB-CG2 4.44Å; W93-I114 PolarHBondContact N-O 2.72Å; W93-I114 PolarHBondContact O-N 2.71Å; W93-F116 HydrophobicContact CB-CE2 4.2Å; W93-F116 AromaticContact CD1-CE2 3.65Å; W93-F116 AromaticContact CD2-CE2 3.74Å; W93-F116 HydrophobicContact CD2-CE2 3.74Å; W93-F116 AromaticContact CD2-CZ 4Å; W93-F116 HydrophobicContact CD2-CZ 4Å; W93-F116 AromaticContact CE2-CE2 3.77Å; W93-F116 HydrophobicContact CE3-CE2 4.39Å; W93-F116 HydrophobicContact CE3-CZ 4.24Å; W93-F116 AromaticContact CG-CE2 3.66Å; W93-F116 HydrophobicContact CG-CE2 3.66Å; W93-F116 HydrophobicContact CG-CZ 4.37Å; W93-F116 HydrophobicContact CZ2-CE2 4.44Å; W93-F116 HydrophobicContact CZ2-CZ 4.3Å; W93-F116 AromaticContact NE1-CE2 3.7Å; W93-I159 HydrophobicContact CE3-CG2 4.37Å; W93-I159 HydrophobicContact CZ3-CB 4.4Å; W93-I159 HydrophobicContact CZ3-CG1 4.37Å; W93-I159 HydrophobicContact CZ3-CG2 4.12Å
94	R	98.8	Very high	98	Very high	109 Å²	109	50.5 Å²	50.5	41%	0.411	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	140.2	163.7	177.7	151.7	57.3	-178.6	-0.3	108.5	A83 G84 K86 L112	A83-R94 VanDerWaalsContact CA-O 3.3Å; A83-R94 WeakPolarHBondContact CA-O 3.31Å; G84-R94 PolarHBondContact N-O 3.36Å; G84-R94 PolarHBondContact O-N 2.82Å; K86-R94 HydrophobicContact CG-CB 3.91Å; R94-L112 WeakPolarHBondContact CA-O 3.3Å
95	S	98.8	Very high	98	Very high	0 Å²	0	50 Å²	50	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	151.6	172.7	178.4	0	0	0	0	110.7	S82 F111 L112 L163	S82-S95 CarbonylContact O-C 3.59Å; S82-S95 WeakPolarHBondContact O-CA 3.13Å; S82-S95 VanDerWaalsContact O-CB 3.31Å; S82-S95 WeakPolarHBondContact O-CB 3.45Å; S82-S95 PolarHBondContact O-OG 3.44Å; S95-F111 WeakPolarHBondContact O-CA 3.42Å; S95-L112 PolarHBondContact N-O 3.43Å; S95-L112 PolarHBondContact O-N 2.77Å; S95-L163 VanDerWaalsContact OG-CD2 3.3Å; S95-L163 WeakPolarHBondContact OG-CD2 3.34Å
96	T	98.7	Very high	98	Very high	32 Å²	32	53.1 Å²	53.1	20%	0.196	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	130.9	169	-50.8	0	0	0	0	108.3	C81 S82 V109 F110 F111	C81-T96 CarbonylContact C-O 3.51Å; C81-T96 WeakPolarHBondContact CA-O 3.28Å; S82-T96 PolarHBondContact N-O 2.88Å; S82-T96 PolarHBondContact O-N 3.25Å; T96-V109 HydrophobicContact CG2-CG1 3.47Å; T96-V109 VanDerWaalsContact CG2-CG1 3.47Å; T96-F110 CarbonylContact C-O 3.6Å; T96-F110 WeakPolarHBondContact CA-O 3.14Å; T96-F111 HydrophobicContact CG2-CD1 4.45Å; T96-F111 HydrophobicContact CG2-CE1 4.23Å
97	I	98.7	Very high	98.1	Very high	0 Å²	0	52 Å²	52	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	123.6	169.5	-66.2	178.3	0	0	0	107.3	F110 L112 L163 I166 L170	I97-F110 PolarHBondContact N-O 2.96Å; I97-F110 PolarHBondContact O-N 2.87Å; I97-L112 HydrophobicContact CB-CD1 4.21Å; I97-L112 HydrophobicContact CD1-CD1 3.78Å; I97-L112 HydrophobicContact CD1-CD2 4.18Å; I97-L112 HydrophobicContact CG1-CD1 3.86Å; I97-L163 HydrophobicContact CD1-CD2 4.1Å; I97-L163 HydrophobicContact CG1-CD2 4.44Å; I97-I166 HydrophobicContact CD1-CB 4.14Å; I97-I166 HydrophobicContact CD1-CG2 3.65Å; I97-L170 HydrophobicContact CG2-CD1 4.14Å
98	L	98.6	Very high	98.2	Very high	78 Å²	78	49.9 Å²	49.9	41%	0.408	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	134.3	165.1	-51.2	178.1	0	0	0	108.1	N80 G108 V109	N80-L98 HydrophobicContact CB-CB 4.03Å; N80-L98 PolarHBondContact O-N 3.43Å; L98-G108 CarbonylContact C-O 3.5Å; L98-G108 WeakPolarHBondContact CA-O 3.33Å; L98-V109 HydrophobicContact CD2-CG1 4.36Å; L98-V109 HydrophobicContact CD2-CG2 3.91Å
99	G	98.5	Very high	98.3	Very high	6 Å²	6	44.2 Å²	44.2	6%	0.062	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-55.1	130	-179.6	0	0	0	0	0	111.4	Y105 G108	G99-Y105 WeakPolarHBondContact CA-O 3.44Å; G99-G108 PolarHBondContact N-O 3.37Å
100	P	98.3	Very high	98.4	Very high	12 Å²	12	40.8 Å²	40.8	8%	0.078	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-55.5	135.3	-175.2	-27.5	34.4	0	0	0	112.3	S103 L170	P100-S103 VanDerWaalsContact O-CB 3.29Å; P100-S103 WeakPolarHBondContact O-CB 3.3Å; P100-S103 PolarHBondContact O-N 3.16Å; P100-S103 VanDerWaalsContact O-N 3.12Å; P100-S103 PolarHBondContact O-OG 3.03Å; P100-L170 HydrophobicContact CG-CB 4.04Å
101	P	97.3	Very high	98.5	Very high	91 Å²	91	42.1 Å²	42.1	59%	0.591	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.5	139.4	174.6	-24.5	33.9	0	0	0	111.9	S103	P101-S103 PolarHBondContact O-N 3.35Å
102	G	96.6	Very high	98.5	Very high	74 Å²	74	39.7 Å²	39.7	76%	0.763	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.9	-8.5	-176.3	0	0	0	0	0	114.8	E106	G102-E106 WeakPolarHBondContact CA-OE2 3.32Å; G102-E106 PolarHBondContact N-OE2 2.96Å
103	S	98.4	Very high	98.5	Very high	19 Å²	19	37.3 Å²	37.3	13%	0.133	23%	0.227	C	C	.	.	S	Bend	trans	-86.4	167.2	176.2	79.4	0	0	0	0	112.1	P100 P101 Y105 E106	P100-S103 VanDerWaalsContact O-CB 3.29Å; P100-S103 WeakPolarHBondContact O-CB 3.3Å; P100-S103 PolarHBondContact O-N 3.16Å; P100-S103 VanDerWaalsContact O-N 3.12Å; P100-S103 PolarHBondContact O-OG 3.03Å; P101-S103 PolarHBondContact O-N 3.35Å; S103-Y105 PolarHBondContact O-N 3.01Å; S103-Y105 VanDerWaalsContact O-N 3.1Å; S103-Y105 PolarHBondContact OG-N 3.49Å; S103-Y105 VanDerWaalsContact OG-N 3.1Å; S103-E106 WeakPolarHBondContact O-CB 3.48Å; S103-E106 PolarHBondContact O-N 3.38Å; S103-E106 PolarHBondContact OG-N 3.05Å
104	V	98.7	Very high	98.5	Very high	15 Å²	15	37.3 Å²	37.3	9%	0.091	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-9.3	170.5	-61.6	0	0	0	0	113.5	D195 A198 R199 T202	V104-D195 HydrophobicContact CG1-CB 3.65Å; V104-D195 VanDerWaalsContact CG1-CG 3.49Å; V104-A198 HydrophobicContact CB-CB 3.79Å; V104-A198 HydrophobicContact CG1-CB 4.43Å; V104-A198 HydrophobicContact CG2-CB 3.54Å; V104-R199 HydrophobicContact CB-CG 4.05Å; V104-R199 HydrophobicContact CG1-CG 4.44Å; V104-R199 WeakPolarHBondContact O-CG 3.48Å; V104-T202 PolarHBondContact O-OG1 3.13Å; V104-T202 VanDerWaalsContact O-OG1 3.07Å
105	Y	98.8	Very high	98.5	Very high	5 Å²	5	34.9 Å²	34.9	2%	0.02	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-5.9	179.9	-51.5	-63.1	0	0	0	113	G99 S103 G107 G108 F110 I133 Y134 H135 L170 A198 T202	G99-Y105 WeakPolarHBondContact CA-O 3.44Å; S103-Y105 PolarHBondContact O-N 3.01Å; S103-Y105 VanDerWaalsContact O-N 3.1Å; S103-Y105 PolarHBondContact OG-N 3.49Å; S103-Y105 VanDerWaalsContact OG-N 3.1Å; Y105-G107 PolarHBondContact O-N 2.95Å; Y105-G108 PolarHBondContact O-N 3.14Å; Y105-F110 HydrophobicContact CD1-CZ 4Å; Y105-F110 HydrophobicContact CG-CZ 4.32Å; Y105-I133 HydrophobicContact CD1-CD1 3.86Å; Y105-I133 HydrophobicContact CD1-CG1 4.01Å; Y105-I133 HydrophobicContact CE1-CD1 3.7Å; Y105-I133 HydrophobicContact CE1-CG1 3.6Å; Y105-I133 HydrophobicContact CG-CD1 4.43Å; Y105-Y134 PolarHBondContact OH-O 2.86Å; Y105-H135 AromaticContact CE2-CD2 3.95Å; Y105-H135 AromaticContact CZ-CD2 3.82Å; Y105-H135 PolarHBondContact OH-CD2 2.91Å; Y105-L170 HydrophobicContact CD2-CB 3.92Å; Y105-L170 HydrophobicContact CD2-CD2 4.25Å; Y105-L170 VanDerWaalsContact CD2-O 3.24Å; Y105-L170 WeakPolarHBondContact CD2-O 3.47Å; Y105-L170 HydrophobicContact CE2-CB 4.23Å; Y105-L170 HydrophobicContact CE2-CD2 4.15Å; Y105-L170 WeakPolarHBondContact CE2-O 3.48Å; Y105-A198 HydrophobicContact CE1-CB 4.33Å; Y105-T202 WeakPolarHBondContact O-CG2 3.49Å
106	E	98.6	Very high	98.5	Very high	115 Å²	115	35.3 Å²	35.3	54%	0.537	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.8	136.7	-179.9	-176.7	175.8	169.6	0	0	112.3	G102 S103 G108	G102-E106 WeakPolarHBondContact CA-OE2 3.32Å; G102-E106 PolarHBondContact N-OE2 2.96Å; S103-E106 WeakPolarHBondContact O-CB 3.48Å; S103-E106 PolarHBondContact O-N 3.38Å; S103-E106 PolarHBondContact OG-N 3.05Å; E106-G108 PolarHBondContact O-N 3.12Å
107	G	98.3	Very high	98.5	Very high	60 Å²	60	35.8 Å²	35.8	62%	0.619	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.2	-10.3	-176.4	0	0	0	0	0	114.7	Y105	Y105-G107 PolarHBondContact O-N 2.95Å
108	G	98.7	Very high	98.4	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.01	26%	0.259	C	S	.	.			trans	-79	151.9	173.9	0	0	0	0	0	113.7	L98 G99 Y105 E106 A206	L98-G108 CarbonylContact C-O 3.5Å; L98-G108 WeakPolarHBondContact CA-O 3.33Å; G99-G108 PolarHBondContact N-O 3.37Å; Y105-G108 PolarHBondContact O-N 3.14Å; E106-G108 PolarHBondContact O-N 3.12Å; G108-A206 CarbonylContact C-O 3.57Å; G108-A206 WeakPolarHBondContact CA-O 3.4Å
109	V	98.8	Very high	98.4	Very high	51 Å²	51	39.3 Å²	39.3	31%	0.309	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	110.1	174.6	-174.7	0	0	0	0	108.4	T96 L98 F111 A206	T96-V109 HydrophobicContact CG2-CG1 3.47Å; T96-V109 VanDerWaalsContact CG2-CG1 3.47Å; L98-V109 HydrophobicContact CD2-CG1 4.36Å; L98-V109 HydrophobicContact CD2-CG2 3.91Å; V109-F111 HydrophobicContact CG1-CE1 4.37Å; V109-F111 HydrophobicContact CG1-CZ 4.1Å; V109-A206 PolarHBondContact N-O 3.1Å
110	F	98.9	Very high	98.3	Very high	1 Å²	1	39.1 Å²	39.1	0%	0.004	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	123.4	-175.3	-59.2	-88.1	0	0	0	110.5	T96 I97 Y105 L112 F129 T131 I133 T202 A206	T96-F110 CarbonylContact C-O 3.6Å; T96-F110 WeakPolarHBondContact CA-O 3.14Å; I97-F110 PolarHBondContact N-O 2.96Å; I97-F110 PolarHBondContact O-N 2.87Å; Y105-F110 HydrophobicContact CD1-CZ 4Å; Y105-F110 HydrophobicContact CG-CZ 4.32Å; F110-L112 HydrophobicContact CB-CD1 4.45Å; F110-F129 HydrophobicContact CB-CD1 4.28Å; F110-F129 HydrophobicContact CB-CE1 3.88Å; F110-F129 HydrophobicContact CD1-CD1 4.44Å; F110-F129 HydrophobicContact CD1-CE1 4.21Å; F110-F129 HydrophobicContact CG-CE1 4.21Å; F110-T131 HydrophobicContact CD1-CG2 3.82Å; F110-T131 HydrophobicContact CE1-CG2 4.37Å; F110-I133 HydrophobicContact CD1-CB 4.45Å; F110-I133 HydrophobicContact CD1-CD1 4.05Å; F110-I133 HydrophobicContact CD1-CG1 4.46Å; F110-I133 HydrophobicContact CE1-CB 4.18Å; F110-I133 HydrophobicContact CE1-CD1 3.73Å; F110-I133 HydrophobicContact CE1-CG1 3.88Å; F110-I133 HydrophobicContact CZ-CD1 4.23Å; F110-T202 HydrophobicContact CZ-CG2 4.19Å; F110-A206 HydrophobicContact CD1-CB 4.01Å; F110-A206 HydrophobicContact CE1-CB 3.6Å; F110-A206 HydrophobicContact CE2-CB 4.28Å; F110-A206 HydrophobicContact CZ-CB 3.75Å
111	F	98.8	Very high	98.3	Very high	81 Å²	81	39.3 Å²	39.3	36%	0.355	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	135.8	173.8	-61.2	-66.5	0	0	0	110.4	S95 T96 V109 R130 T131	S95-F111 WeakPolarHBondContact O-CA 3.42Å; T96-F111 HydrophobicContact CG2-CD1 4.45Å; T96-F111 HydrophobicContact CG2-CE1 4.23Å; V109-F111 HydrophobicContact CG1-CE1 4.37Å; V109-F111 HydrophobicContact CG1-CZ 4.1Å; F111-R130 HydrophobicContact CB-CB 4.26Å; F111-R130 WeakPolarHBondContact O-CA 3.42Å; F111-R130 WeakPolarHBondContact O-CB 3.4Å; F111-R130 PolarHBondContact O-N 3.18Å; F111-T131 PolarHBondContact N-OG1 3.3Å; F111-T131 PolarHBondContact O-N 2.96Å
112	L	98.9	Very high	98.4	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	147.1	174.9	-62.7	84.7	0	0	0	109.8	R94 S95 I97 F110 V127 T128 F129 I144 I166	R94-L112 WeakPolarHBondContact CA-O 3.3Å; S95-L112 PolarHBondContact N-O 3.43Å; S95-L112 PolarHBondContact O-N 2.77Å; I97-L112 HydrophobicContact CB-CD1 4.21Å; I97-L112 HydrophobicContact CD1-CD1 3.78Å; I97-L112 HydrophobicContact CD1-CD2 4.18Å; I97-L112 HydrophobicContact CG1-CD1 3.86Å; F110-L112 HydrophobicContact CB-CD1 4.45Å; L112-V127 HydrophobicContact CB-CG1 4.48Å; L112-V127 HydrophobicContact CD2-CG1 3.83Å; L112-T128 CarbonylContact C-O 3.56Å; L112-T128 VanDerWaalsContact CA-O 3.28Å; L112-T128 WeakPolarHBondContact CA-O 3.43Å; L112-F129 HydrophobicContact CD1-CD1 4.48Å; L112-F129 HydrophobicContact CD1-CE1 4.22Å; L112-F129 HydrophobicContact CD1-CZ 4.38Å; L112-F129 HydrophobicContact CD2-CD2 3.93Å; L112-F129 HydrophobicContact CD2-CE1 4.49Å; L112-F129 HydrophobicContact CD2-CE2 3.69Å; L112-F129 HydrophobicContact CD2-CG 4.43Å; L112-F129 HydrophobicContact CD2-CZ 3.99Å; L112-F129 HydrophobicContact CG-CD1 4.3Å; L112-F129 HydrophobicContact CG-CD2 4.24Å; L112-F129 HydrophobicContact CG-CE1 4.36Å; L112-F129 HydrophobicContact CG-CE2 4.29Å; L112-F129 HydrophobicContact CG-CG 4.24Å; L112-F129 HydrophobicContact CG-CZ 4.35Å; L112-I144 HydrophobicContact CD2-CD1 4.28Å; L112-I166 HydrophobicContact CD2-CD1 4Å; L112-I166 HydrophobicContact CD2-CG2 4.43Å
113	D	98.8	Very high	98.4	Very high	32 Å²	32	44.2 Å²	44.2	17%	0.171	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	133.9	169	-72	-38.6	0	0	0	109.2	K86 V127 T128	K86-D113 WeakPolarHBondContact CE-OD1 2.97Å; K86-D113 IonicContact NZ-OD1 3.83Å; K86-D113 PolarHBondContact NZ-OD1 3.47Å; K86-D113 IonicContact NZ-OD2 2.68Å; D113-V127 WeakPolarHBondContact O-CA 3.42Å; D113-T128 PolarHBondContact N-O 3.32Å; D113-T128 PolarHBondContact O-N 2.99Å
114	I	98.9	Very high	98.4	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.005	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	124.7	178.3	-58.3	169.7	0	0	0	107.6	A83 W93 F116 P125 K126 V127 I159 L163	A83-I114 HydrophobicContact CB-CD1 4.37Å; W93-I114 HydrophobicContact CB-CB 3.95Å; W93-I114 HydrophobicContact CB-CG2 4.44Å; W93-I114 PolarHBondContact N-O 2.72Å; W93-I114 PolarHBondContact O-N 2.71Å; I114-F116 HydrophobicContact CG2-CD2 4.44Å; I114-F116 HydrophobicContact CG2-CE1 4.48Å; I114-F116 HydrophobicContact CG2-CE2 3.89Å; I114-F116 HydrophobicContact CG2-CZ 3.94Å; I114-P125 HydrophobicContact CG2-CB 4.1Å; I114-K126 CarbonylContact C-O 3.55Å; I114-K126 WeakPolarHBondContact CA-O 3.15Å; I114-V127 HydrophobicContact CG1-CG1 4.13Å; I114-V127 HydrophobicContact CG1-CG2 4.19Å; I114-V127 HydrophobicContact CG2-CG2 4.38Å; I114-I159 HydrophobicContact CD1-CG2 3.99Å; I114-I159 HydrophobicContact CG2-CD1 3.95Å; I114-L163 HydrophobicContact CD1-CD2 4.4Å
115	T	98.8	Very high	98.4	Very high	59 Å²	59	44.7 Å²	44.7	36%	0.362	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	122.5	177.9	-53	0	0	0	0	109.9	Y91 P125 K126	Y91-T115 WeakPolarHBondContact O-CA 3.44Å; T115-P125 WeakPolarHBondContact O-CA 3.4Å; T115-K126 PolarHBondContact N-O 2.83Å; T115-K126 PolarHBondContact O-N 2.75Å
116	F	98.6	Very high	98.4	Very high	9 Å²	9	51.3 Å²	51.3	4%	0.039	28%	0.278	C	S	.	.			trans	-91.2	145.1	174.6	-54.9	-94.2	0	0	0	109.8	I66 Y91 W93 I114 Y120 P125 I159	I66-F116 HydrophobicContact CD1-CB 3.66Å; I66-F116 HydrophobicContact CD1-CD1 4.03Å; I66-F116 HydrophobicContact CD1-CD2 4.13Å; I66-F116 HydrophobicContact CD1-CG 3.69Å; I66-F116 HydrophobicContact CG1-CB 4.47Å; I66-F116 HydrophobicContact CG1-CD1 3.9Å; I66-F116 HydrophobicContact CG1-CD2 4.45Å; I66-F116 HydrophobicContact CG1-CE1 4.13Å; I66-F116 HydrophobicContact CG1-CG 4.04Å; I66-F116 HydrophobicContact CG2-CD2 4.47Å; I66-F116 HydrophobicContact CG2-CE2 4.2Å; I66-F116 HydrophobicContact CG2-CZ 4.28Å; Y91-F116 HydrophobicContact CD1-CB 3.79Å; Y91-F116 HydrophobicContact CG-CB 4.49Å; Y91-F116 WeakPolarHBondContact O-CD2 3.45Å; Y91-F116 PolarHBondContact O-N 2.93Å; W93-F116 HydrophobicContact CB-CE2 4.2Å; W93-F116 AromaticContact CD1-CE2 3.65Å; W93-F116 AromaticContact CD2-CE2 3.74Å; W93-F116 HydrophobicContact CD2-CE2 3.74Å; W93-F116 AromaticContact CD2-CZ 4Å; W93-F116 HydrophobicContact CD2-CZ 4Å; W93-F116 AromaticContact CE2-CE2 3.77Å; W93-F116 HydrophobicContact CE3-CE2 4.39Å; W93-F116 HydrophobicContact CE3-CZ 4.24Å; W93-F116 AromaticContact CG-CE2 3.66Å; W93-F116 HydrophobicContact CG-CE2 3.66Å; W93-F116 HydrophobicContact CG-CZ 4.37Å; W93-F116 HydrophobicContact CZ2-CE2 4.44Å; W93-F116 HydrophobicContact CZ2-CZ 4.3Å; W93-F116 AromaticContact NE1-CE2 3.7Å; I114-F116 HydrophobicContact CG2-CD2 4.44Å; I114-F116 HydrophobicContact CG2-CE1 4.48Å; I114-F116 HydrophobicContact CG2-CE2 3.89Å; I114-F116 HydrophobicContact CG2-CZ 3.94Å; F116-Y120 AromaticContact CD1-CD1 3.87Å; F116-Y120 HydrophobicContact CD1-CD1 3.87Å; F116-Y120 AromaticContact CD1-CD2 3.76Å; F116-Y120 HydrophobicContact CD1-CD2 3.76Å; F116-Y120 AromaticContact CD1-CE1 3.97Å; F116-Y120 HydrophobicContact CD1-CE1 3.97Å; F116-Y120 AromaticContact CD1-CE2 3.89Å; F116-Y120 HydrophobicContact CD1-CE2 3.89Å; F116-Y120 AromaticContact CD1-CG 3.75Å; F116-Y120 HydrophobicContact CD1-CG 3.75Å; F116-Y120 HydrophobicContact CE1-CD1 4.34Å; F116-Y120 HydrophobicContact CE1-CD2 4.43Å; F116-Y120 AromaticContact CE1-CE1 3.99Å; F116-Y120 HydrophobicContact CE1-CE1 3.99Å; F116-Y120 HydrophobicContact CE1-CE2 4.11Å; F116-Y120 AromaticContact CE1-CZ 3.88Å; F116-P125 HydrophobicContact CD1-CB 4.06Å; F116-P125 HydrophobicContact CE1-CB 4.32Å; F116-I159 HydrophobicContact CE1-CD1 3.56Å; F116-I159 HydrophobicContact CE1-CG1 3.66Å; F116-I159 HydrophobicContact CZ-CD1 3.73Å; F116-I159 HydrophobicContact CZ-CG1 3.6Å
117	S	98	Very high	98.4	Very high	42 Å²	42	46.2 Å²	46.2	29%	0.294	26%	0.255	S	S	.	.			trans	-92.3	167.7	167.6	68.9	0	0	0	0	110.8	D119 Y120	S117-D119 PolarHBondContact O-N 2.93Å; S117-D119 VanDerWaalsContact O-N 3.14Å; S117-D119 PolarHBondContact OG-N 2.86Å; S117-Y120 WeakPolarHBondContact O-CB 3.38Å; S117-Y120 PolarHBondContact O-N 2.89Å; S117-Y120 VanDerWaalsContact O-N 3.16Å
118	S	97.3	Very high	98.4	Very high	85 Å²	85	44.7 Å²	44.7	59%	0.594	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-24.2	171.4	52.8	0	0	0	0	113.2	S62 Y120	S62-S118 VanDerWaalsContact CB-O 3.28Å; S62-S118 WeakPolarHBondContact CB-O 3.26Å; S62-S118 PolarHBondContact OG-O 2.85Å; S118-Y120 VanDerWaalsContact C-N 3.34Å
119	D	97.7	Very high	98.4	Very high	66 Å²	66	45 Å²	45	35%	0.353	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-0.6	-176.6	-57.8	-22.2	0	0	0	112.9	S117 F122 K123	S117-D119 PolarHBondContact O-N 2.93Å; S117-D119 VanDerWaalsContact O-N 3.14Å; S117-D119 PolarHBondContact OG-N 2.86Å; D119-F122 WeakPolarHBondContact O-CA 3.34Å; D119-F122 WeakPolarHBondContact O-CB 3.28Å; D119-F122 PolarHBondContact O-N 2.89Å; D119-K123 HydrophobicContact CB-CB 4.24Å; D119-K123 HydrophobicContact CB-CD 3.91Å; D119-K123 HydrophobicContact CB-CG 3.99Å; D119-K123 PolarHBondContact O-N 2.89Å; D119-K123 WeakPolarHBondContact OD2-CD 3.34Å; D119-K123 VanDerWaalsContact OD2-CE 3.31Å; D119-K123 WeakPolarHBondContact OD2-CE 3.37Å; D119-K123 IonicContact OD2-NZ 2.77Å; D119-K123 PolarHBondContact OD2-NZ 2.7Å
120	Y	98.4	Very high	98.4	Very high	3 Å²	3	50 Å²	50	1%	0.012	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	132.9	175.3	-171.1	-100.5	0	0	0	110.7	S62 R65 I66 E69 F116 S117 S118 K123 P125 W153	S62-Y120 WeakPolarHBondContact CA-O 3.37Å; S62-Y120 WeakPolarHBondContact CB-O 3.39Å; R65-Y120 HydrophobicContact CG-CD1 3.95Å; R65-Y120 HydrophobicContact CG-CE1 3.69Å; I66-Y120 HydrophobicContact CD1-CD1 4.34Å; I66-Y120 HydrophobicContact CG1-CD1 3.72Å; I66-Y120 HydrophobicContact CG1-CE1 4.1Å; E69-Y120 WeakPolarHBondContact OE1-CE1 3.34Å; E69-Y120 PolarHBondContact OE1-OH 3.45Å; E69-Y120 PolarHBondContact OE2-OH 3.4Å; F116-Y120 AromaticContact CD1-CD1 3.87Å; F116-Y120 HydrophobicContact CD1-CD1 3.87Å; F116-Y120 AromaticContact CD1-CD2 3.76Å; F116-Y120 HydrophobicContact CD1-CD2 3.76Å; F116-Y120 AromaticContact CD1-CE1 3.97Å; F116-Y120 HydrophobicContact CD1-CE1 3.97Å; F116-Y120 AromaticContact CD1-CE2 3.89Å; F116-Y120 HydrophobicContact CD1-CE2 3.89Å; F116-Y120 AromaticContact CD1-CG 3.75Å; F116-Y120 HydrophobicContact CD1-CG 3.75Å; F116-Y120 HydrophobicContact CE1-CD1 4.34Å; F116-Y120 HydrophobicContact CE1-CD2 4.43Å; F116-Y120 AromaticContact CE1-CE1 3.99Å; F116-Y120 HydrophobicContact CE1-CE1 3.99Å; F116-Y120 HydrophobicContact CE1-CE2 4.11Å; F116-Y120 AromaticContact CE1-CZ 3.88Å; S117-Y120 WeakPolarHBondContact O-CB 3.38Å; S117-Y120 PolarHBondContact O-N 2.89Å; S117-Y120 VanDerWaalsContact O-N 3.16Å; S118-Y120 VanDerWaalsContact C-N 3.34Å; Y120-K123 WeakPolarHBondContact CD2-O 3.44Å; Y120-P125 HydrophobicContact CE2-CB 4.5Å; Y120-P125 HydrophobicContact CE2-CG 4.32Å; Y120-W153 HydrophobicContact CD2-CZ2 4.23Å; Y120-W153 AromaticContact CE2-CH2 3.7Å; Y120-W153 HydrophobicContact CE2-CH2 3.7Å; Y120-W153 AromaticContact CE2-CZ2 3.56Å; Y120-W153 HydrophobicContact CE2-CZ2 3.56Å
121	P	98	Very high	98.4	Very high	16 Å²	16	50.6 Å²	50.6	10%	0.104	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	cis	-97.8	13.8	12	39.6	-37.5	0	0	0	114.9	R65 K123 W153 P155	R65-P121 HydrophobicContact CG-CB 4.31Å; R65-P121 HydrophobicContact CG-CG 4.18Å; P121-K123 VanDerWaalsContact C-N 3.34Å; P121-W153 HydrophobicContact CB-CZ2 4.5Å; P121-W153 PolarHBondContact O-NE1 3.02Å; P121-P155 HydrophobicContact CB-CB 4.29Å; P121-P155 HydrophobicContact CG-CB 4.16Å; P121-P155 WeakPolarHBondContact O-CA 3.38Å
122	F	97.9	Very high	98.4	Very high	156 Å²	156	54.2 Å²	54.2	68%	0.684	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-21	-179.6	-57.8	-73.5	0	0	0	113.3	D119 P155	D119-F122 WeakPolarHBondContact O-CA 3.34Å; D119-F122 WeakPolarHBondContact O-CB 3.28Å; D119-F122 PolarHBondContact O-N 2.89Å; F122-P155 HydrophobicContact CD1-CB 4.41Å; F122-P155 HydrophobicContact CD1-CG 3.88Å; F122-P155 HydrophobicContact CE1-CG 4.39Å
123	K	98	Very high	98.4	Very high	112 Å²	112	55 Å²	55	49%	0.487	27%	0.268	S	S	.	.	S	Bend	trans	-112.8	146.5	165.3	-69.5	-175.7	-178.1	158	0	110.5	D119 Y120 P121	D119-K123 HydrophobicContact CB-CB 4.24Å; D119-K123 HydrophobicContact CB-CD 3.91Å; D119-K123 HydrophobicContact CB-CG 3.99Å; D119-K123 PolarHBondContact O-N 2.89Å; D119-K123 WeakPolarHBondContact OD2-CD 3.34Å; D119-K123 VanDerWaalsContact OD2-CE 3.31Å; D119-K123 WeakPolarHBondContact OD2-CE 3.37Å; D119-K123 IonicContact OD2-NZ 2.77Å; D119-K123 PolarHBondContact OD2-NZ 2.7Å; Y120-K123 WeakPolarHBondContact CD2-O 3.44Å; P121-K123 VanDerWaalsContact C-N 3.34Å
124	P	98.3	Very high	98.4	Very high	40 Å²	40	54.9 Å²	54.9	26%	0.26	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-62.3	153.3	176.2	25	-32.4	0	0	0	111.5	L149 W153	P124-L149 WeakPolarHBondContact CG-O 3.44Å; P124-W153 VanDerWaalsContact CA-CD2 3.5Å; P124-W153 HydrophobicContact CB-CB 3.97Å; P124-W153 HydrophobicContact CB-CD2 3.58Å; P124-W153 HydrophobicContact CB-CE3 3.82Å; P124-W153 HydrophobicContact CB-CG 3.63Å; P124-W153 HydrophobicContact CG-CB 4.12Å; P124-W153 HydrophobicContact CG-CG 4.07Å
125	P	98.5	Very high	98.4	Very high	4 Å²	4	54.9 Å²	54.9	3%	0.026	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-71.5	148.4	166.9	32.9	-31.1	0	0	0	109.2	I114 T115 F116 Y120 V127 W153 I159	I114-P125 HydrophobicContact CG2-CB 4.1Å; T115-P125 WeakPolarHBondContact O-CA 3.4Å; F116-P125 HydrophobicContact CD1-CB 4.06Å; F116-P125 HydrophobicContact CE1-CB 4.32Å; Y120-P125 HydrophobicContact CE2-CB 4.5Å; Y120-P125 HydrophobicContact CE2-CG 4.32Å; P125-V127 HydrophobicContact CG-CG2 4.25Å; P125-W153 HydrophobicContact CG-CH2 4.48Å; P125-I159 HydrophobicContact CB-CD1 4.19Å; P125-I159 HydrophobicContact CG-CD1 3.74Å
126	K	98.6	Very high	98.4	Very high	143 Å²	143	52.1 Å²	52.1	62%	0.622	25%	0.248	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-79.3	122	168.3	-178.1	-179.8	177.4	-177.1	0	108.3	I114 T115 T128	I114-K126 CarbonylContact C-O 3.55Å; I114-K126 WeakPolarHBondContact CA-O 3.15Å; T115-K126 PolarHBondContact N-O 2.83Å; T115-K126 PolarHBondContact O-N 2.75Å; K126-T128 HydrophobicContact CG-CG2 4.45Å
127	V	98.8	Very high	98.4	Very high	8 Å²	8	51.8 Å²	51.8	5%	0.048	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	128.3	177.2	-172.3	0	0	0	0	109.5	L112 D113 I114 P125 I144 L149 V162 I166	L112-V127 HydrophobicContact CB-CG1 4.48Å; L112-V127 HydrophobicContact CD2-CG1 3.83Å; D113-V127 WeakPolarHBondContact O-CA 3.42Å; I114-V127 HydrophobicContact CG1-CG1 4.13Å; I114-V127 HydrophobicContact CG1-CG2 4.19Å; I114-V127 HydrophobicContact CG2-CG2 4.38Å; P125-V127 HydrophobicContact CG-CG2 4.25Å; V127-I144 HydrophobicContact CB-CD1 4.39Å; V127-I144 HydrophobicContact CG1-CD1 3.99Å; V127-L149 HydrophobicContact CB-CD1 4.07Å; V127-L149 HydrophobicContact CG2-CD1 4.37Å; V127-L149 HydrophobicContact CG2-CD2 4.07Å; V127-V162 HydrophobicContact CG2-CG1 4.17Å; V127-I166 HydrophobicContact CG1-CD1 3.88Å
128	T	98.8	Very high	98.4	Very high	28 Å²	28	49.9 Å²	49.9	17%	0.172	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	139.7	179.9	51.3	0	0	0	0	111.7	L112 D113 K126 R130 G142	L112-T128 CarbonylContact C-O 3.56Å; L112-T128 VanDerWaalsContact CA-O 3.28Å; L112-T128 WeakPolarHBondContact CA-O 3.43Å; D113-T128 PolarHBondContact N-O 3.32Å; D113-T128 PolarHBondContact O-N 2.99Å; K126-T128 HydrophobicContact CG-CG2 4.45Å; T128-R130 PolarHBondContact O-N 2.92Å; T128-G142 CarbonylContact C-O 3.52Å; T128-G142 VanDerWaalsContact CA-O 3.27Å; T128-G142 WeakPolarHBondContact CA-O 3.29Å
129	F	98.8	Very high	98.5	Very high	9 Å²	9	48.1 Å²	48.1	4%	0.039	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	130.2	169.3	-84.5	-104.1	0	0	0	110.6	F110 L112 I133 I138 G142 I144 I166 L170	F110-F129 HydrophobicContact CB-CD1 4.28Å; F110-F129 HydrophobicContact CB-CE1 3.88Å; F110-F129 HydrophobicContact CD1-CD1 4.44Å; F110-F129 HydrophobicContact CD1-CE1 4.21Å; F110-F129 HydrophobicContact CG-CE1 4.21Å; L112-F129 HydrophobicContact CD1-CD1 4.48Å; L112-F129 HydrophobicContact CD1-CE1 4.22Å; L112-F129 HydrophobicContact CD1-CZ 4.38Å; L112-F129 HydrophobicContact CD2-CD2 3.93Å; L112-F129 HydrophobicContact CD2-CE1 4.49Å; L112-F129 HydrophobicContact CD2-CE2 3.69Å; L112-F129 HydrophobicContact CD2-CG 4.43Å; L112-F129 HydrophobicContact CD2-CZ 3.99Å; L112-F129 HydrophobicContact CG-CD1 4.3Å; L112-F129 HydrophobicContact CG-CD2 4.24Å; L112-F129 HydrophobicContact CG-CE1 4.36Å; L112-F129 HydrophobicContact CG-CE2 4.29Å; L112-F129 HydrophobicContact CG-CG 4.24Å; L112-F129 HydrophobicContact CG-CZ 4.35Å; F129-I133 HydrophobicContact CD1-CG2 4.18Å; F129-I133 HydrophobicContact CE1-CD1 4.09Å; F129-I133 HydrophobicContact CG-CG2 4.43Å; F129-I138 HydrophobicContact CB-CG2 4.21Å; F129-I138 HydrophobicContact CD2-CD1 3.8Å; F129-I138 HydrophobicContact CD2-CG1 4.33Å; F129-I138 HydrophobicContact CD2-CG2 3.97Å; F129-I138 HydrophobicContact CE1-CD1 4.32Å; F129-I138 HydrophobicContact CE2-CD1 3.41Å; F129-I138 VanDerWaalsContact CE2-CD1 3.41Å; F129-I138 HydrophobicContact CE2-CG1 4.25Å; F129-I138 HydrophobicContact CG-CD1 4.41Å; F129-I138 HydrophobicContact CG-CG2 4.18Å; F129-I138 HydrophobicContact CZ-CD1 3.71Å; F129-G142 PolarHBondContact N-O 3.4Å; F129-G142 WeakPolarHBondContact O-CA 3.49Å; F129-I144 HydrophobicContact CD2-CD1 3.65Å; F129-I144 HydrophobicContact CD2-CG1 3.73Å; F129-I144 HydrophobicContact CE2-CD1 3.62Å; F129-I144 HydrophobicContact CE2-CG1 3.97Å; F129-I166 HydrophobicContact CE2-CG2 3.93Å; F129-I166 HydrophobicContact CZ-CG2 3.86Å; F129-L170 HydrophobicContact CZ-CD1 4.41Å; F129-L170 HydrophobicContact CZ-CD2 4.21Å
130	R	98.6	Very high	98.5	Very high	154 Å²	154	50.2 Å²	50.2	58%	0.581	24%	0.237	S	C	*	.			trans	-94.1	-37.4	168.9	-178.2	175.5	163.8	164.7	-1.2	110.8	F111 T128	F111-R130 HydrophobicContact CB-CB 4.26Å; F111-R130 WeakPolarHBondContact O-CA 3.42Å; F111-R130 WeakPolarHBondContact O-CB 3.4Å; F111-R130 PolarHBondContact O-N 3.18Å; T128-R130 PolarHBondContact O-N 2.92Å
131	T	98.8	Very high	98.5	Very high	14 Å²	14	57 Å²	57	9%	0.086	27%	0.269	C	S	.	.	S	Bend	trans	-73.2	131.6	171.5	-59.3	0	0	0	0	109.9	F110 F111 Y205 A206	F110-T131 HydrophobicContact CD1-CG2 3.82Å; F110-T131 HydrophobicContact CE1-CG2 4.37Å; F111-T131 PolarHBondContact N-OG1 3.3Å; F111-T131 PolarHBondContact O-N 2.96Å; T131-Y205 VanDerWaalsContact CG2-O 3.28Å; T131-Y205 WeakPolarHBondContact CG2-O 3.37Å; T131-A206 HydrophobicContact CG2-CB 3.83Å
132	R	98.6	Very high	98.5	Very high	158 Å²	158	56.5 Å²	56.5	60%	0.596	27%	0.266	S	S	*	.			trans	-65	138.1	175.1	-66	-177.7	-177.4	178.3	1.4	110	W201 Y205	R132-W201 HydrophobicContact CB-CE3 4.48Å; R132-W201 HydrophobicContact CB-CZ3 4.23Å; R132-Y205 HydrophobicContact CB-CD2 4.19Å; R132-Y205 HydrophobicContact CB-CG 4.06Å
133	I	98.9	Very high	98.5	Very high	16 Å²	16	52 Å²	52	8%	0.082	25%	0.252	C	S	.	.			trans	-141.2	146.9	-178.4	-168.9	170	0	0	0	110.5	Y105 F110 F129 H135 I138 L170	Y105-I133 HydrophobicContact CD1-CD1 3.86Å; Y105-I133 HydrophobicContact CD1-CG1 4.01Å; Y105-I133 HydrophobicContact CE1-CD1 3.7Å; Y105-I133 HydrophobicContact CE1-CG1 3.6Å; Y105-I133 HydrophobicContact CG-CD1 4.43Å; F110-I133 HydrophobicContact CD1-CB 4.45Å; F110-I133 HydrophobicContact CD1-CD1 4.05Å; F110-I133 HydrophobicContact CD1-CG1 4.46Å; F110-I133 HydrophobicContact CE1-CB 4.18Å; F110-I133 HydrophobicContact CE1-CD1 3.73Å; F110-I133 HydrophobicContact CE1-CG1 3.88Å; F110-I133 HydrophobicContact CZ-CD1 4.23Å; F129-I133 HydrophobicContact CD1-CG2 4.18Å; F129-I133 HydrophobicContact CE1-CD1 4.09Å; F129-I133 HydrophobicContact CG-CG2 4.43Å; I133-H135 HydrophobicContact CD1-CB 4.47Å; I133-H135 HydrophobicContact CG1-CB 4.28Å; I133-H135 HydrophobicContact CG2-CB 4.4Å; I133-I138 HydrophobicContact CD1-CD1 4.24Å; I133-I138 HydrophobicContact CG2-CB 3.93Å; I133-I138 HydrophobicContact CG2-CD1 3.84Å; I133-I138 HydrophobicContact CG2-CG2 3.67Å; I133-L170 HydrophobicContact CD1-CD2 3.54Å
134	Y	98.8	Very high	98.5	Very high	30 Å²	30	47.1 Å²	47.1	12%	0.118	23%	0.23	C	C	.	.			trans	-96.7	97.1	172.8	-165.4	-97.6	0	0	0	108.8	Y105 I183 Q186 H194 I197 A198 W201	Y105-Y134 PolarHBondContact OH-O 2.86Å; Y134-I183 HydrophobicContact CD1-CD1 4.43Å; Y134-I183 HydrophobicContact CD1-CG2 4.09Å; Y134-I183 HydrophobicContact CD2-CD1 3.83Å; Y134-I183 HydrophobicContact CD2-CG1 4.41Å; Y134-I183 HydrophobicContact CE1-CB 4.44Å; Y134-I183 HydrophobicContact CE1-CD1 4.34Å; Y134-I183 HydrophobicContact CE1-CG1 4.14Å; Y134-I183 HydrophobicContact CE1-CG2 3.68Å; Y134-I183 HydrophobicContact CE2-CD1 3.71Å; Y134-I183 HydrophobicContact CE2-CG1 3.8Å; Y134-I183 HydrophobicContact CG-CD1 4.19Å; Y134-Q186 PolarHBondContact OH-OE1 2.84Å; Y134-H194 AromaticContact CE1-CD2 3.77Å; Y134-I197 HydrophobicContact CD1-CB 4.4Å; Y134-I197 HydrophobicContact CD1-CG2 3.92Å; Y134-I197 HydrophobicContact CD2-CG2 3.76Å; Y134-I197 HydrophobicContact CE1-CB 4.2Å; Y134-I197 HydrophobicContact CE1-CG2 3.87Å; Y134-I197 HydrophobicContact CE2-CG2 3.72Å; Y134-I197 HydrophobicContact CG-CG2 3.86Å; Y134-A198 HydrophobicContact CD1-CB 4.18Å; Y134-W201 HydrophobicContact CD2-CD2 4.13Å; Y134-W201 AromaticContact CD2-CE2 3.87Å; Y134-W201 HydrophobicContact CD2-CG 4.48Å; Y134-W201 HydrophobicContact CD2-CZ2 4.12Å; Y134-W201 HydrophobicContact CG-CD2 4.42Å; Y134-W201 HydrophobicContact CG-CG 4.47Å
135	H	98.8	Very high	98.4	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.222	C	C	.	.	B	Isolated β-bridge	trans	-153	138	-174.8	-171.4	-78.2	0	0	0	110.1	Y105 I133 N137 I138 L169 C173	Y105-H135 AromaticContact CE2-CD2 3.95Å; Y105-H135 AromaticContact CZ-CD2 3.82Å; Y105-H135 PolarHBondContact OH-CD2 2.91Å; I133-H135 HydrophobicContact CD1-CB 4.47Å; I133-H135 HydrophobicContact CG1-CB 4.28Å; I133-H135 HydrophobicContact CG2-CB 4.4Å; H135-N137 PolarHBondContact CE1-OD1 3.12Å; H135-N137 PolarHBondContact ND1-N 3.32Å; H135-N137 PolarHBondContact O-N 3.21Å; H135-I138 HydrophobicContact CB-CB 4.15Å; H135-I138 HydrophobicContact CB-CD1 3.99Å; H135-I138 HydrophobicContact CB-CG1 4.23Å; H135-I138 PolarHBondContact O-N 3.27Å; H135-L169 PolarHBondContact NE2-O 2.65Å; H135-L169 VanDerWaalsContact NE2-O 3.08Å; H135-C173 WeakPolarHBondContact NE2-CB 3.38Å
136	C	98.5	Very high	98.3	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.007	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-29.5	-173.7	62.4	0	0	0	0	113.9	C173 P178 L179 V180 I183 A184	C136-C173 VanDerWaalsContact SG-SG 3.63Å; C136-P178 HydrophobicContact CB-CB 4.2Å; C136-L179 PolarHBondContact O-N 2.92Å; C136-V180 PolarHBondContact O-N 2.69Å; C136-I183 HydrophobicContact CB-CB 4.08Å; C136-I183 HydrophobicContact CB-CG2 3.91Å; C136-A184 HydrophobicContact CB-CB 3.89Å
137	N	98.7	Very high	98	Very high	2 Å²	2	43.5 Å²	43.5	1%	0.011	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	6.5	175.4	-46.8	102.3	0	0	0	114.2	H135 C145 L169 N174 D177 L179	H135-N137 PolarHBondContact CE1-OD1 3.12Å; H135-N137 PolarHBondContact ND1-N 3.32Å; H135-N137 PolarHBondContact O-N 3.21Å; N137-C145 HydrophobicContact CB-CB 4.4Å; N137-C145 PolarHBondContact O-N 2.94Å; N137-L169 HydrophobicContact CB-CD1 4.33Å; N137-L169 HydrophobicContact CB-CD2 4.17Å; N137-N174 PolarHBondContact ND2-O 3.17Å; N137-N174 PolarHBondContact OD1-N 3.04Å; N137-D177 PolarHBondContact ND2-O 3.42Å; N137-L179 WeakPolarHBondContact O-CD1 3.45Å
138	I	98.8	Very high	97.9	Very high	2 Å²	2	44.2 Å²	44.2	1%	0.01	22%	0.22	C	C	.	.	B	Isolated β-bridge	trans	-128.1	118.3	177.7	-53.8	165	0	0	0	108.7	F129 I133 H135 V143 I144 L170	F129-I138 HydrophobicContact CB-CG2 4.21Å; F129-I138 HydrophobicContact CD2-CD1 3.8Å; F129-I138 HydrophobicContact CD2-CG1 4.33Å; F129-I138 HydrophobicContact CD2-CG2 3.97Å; F129-I138 HydrophobicContact CE1-CD1 4.32Å; F129-I138 HydrophobicContact CE2-CD1 3.41Å; F129-I138 VanDerWaalsContact CE2-CD1 3.41Å; F129-I138 HydrophobicContact CE2-CG1 4.25Å; F129-I138 HydrophobicContact CG-CD1 4.41Å; F129-I138 HydrophobicContact CG-CG2 4.18Å; F129-I138 HydrophobicContact CZ-CD1 3.71Å; I133-I138 HydrophobicContact CD1-CD1 4.24Å; I133-I138 HydrophobicContact CG2-CB 3.93Å; I133-I138 HydrophobicContact CG2-CD1 3.84Å; I133-I138 HydrophobicContact CG2-CG2 3.67Å; H135-I138 HydrophobicContact CB-CB 4.15Å; H135-I138 HydrophobicContact CB-CD1 3.99Å; H135-I138 HydrophobicContact CB-CG1 4.23Å; H135-I138 PolarHBondContact O-N 3.27Å; I138-V143 VanDerWaalsContact CA-O 3.3Å; I138-V143 WeakPolarHBondContact CA-O 3.39Å; I138-I144 HydrophobicContact CG1-CG1 4.43Å; I138-I144 HydrophobicContact CG1-CG2 4.44Å; I138-L170 HydrophobicContact CD1-CD2 4.02Å
139	N	98.3	Very high	97.7	Very high	48 Å²	48	44 Å²	44	26%	0.257	22%	0.217	S	C	.	.			trans	-84.8	178.3	-177.1	76.1	11.7	0	0	0	113.1	Q141 G142 V143 L179 V180	N139-Q141 PolarHBondContact O-N 2.84Å; N139-Q141 VanDerWaalsContact O-N 3.14Å; N139-Q141 WeakPolarHBondContact OD1-CA 3.48Å; N139-Q141 PolarHBondContact OD1-N 3.14Å; N139-G142 WeakPolarHBondContact O-CA 3.48Å; N139-G142 PolarHBondContact O-N 3.16Å; N139-G142 PolarHBondContact OD1-N 3.07Å; N139-V143 PolarHBondContact N-O 2.97Å; N139-V143 WeakPolarHBondContact OD1-CB 3.43Å; N139-V143 PolarHBondContact OD1-N 2.94Å; N139-L179 HydrophobicContact CB-CB 4.17Å; N139-L179 HydrophobicContact CB-CD1 4.37Å; N139-V180 HydrophobicContact CB-CG2 4.1Å
140	S	97.5	Very high	97.4	Very high	110 Å²	110	48.5 Å²	48.5	77%	0.769	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-17.2	-178.3	60.5	0	0	0	0	114.9	G142	S140-G142 VanDerWaalsContact C-N 3.35Å
141	Q	98.1	Very high	97.1	Very high	146 Å²	146	48.6 Å²	48.6	68%	0.682	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.1	4.6	174	-55.4	-55.8	-54.6	0	0	112.2	N139 V143	N139-Q141 PolarHBondContact O-N 2.84Å; N139-Q141 VanDerWaalsContact O-N 3.14Å; N139-Q141 WeakPolarHBondContact OD1-CA 3.48Å; N139-Q141 PolarHBondContact OD1-N 3.14Å; Q141-V143 VanDerWaalsContact C-N 3.27Å; Q141-V143 HydrophobicContact CB-CG2 4.41Å; Q141-V143 PolarHBondContact O-N 2.86Å
142	G	98.3	Very high	97	Very high	5 Å²	5	52.6 Å²	52.6	5%	0.052	27%	0.27	C	S	.	.			trans	75.4	10.5	-179.7	0	0	0	0	0	114.9	T128 F129 N139 S140	T128-G142 CarbonylContact C-O 3.52Å; T128-G142 VanDerWaalsContact CA-O 3.27Å; T128-G142 WeakPolarHBondContact CA-O 3.29Å; F129-G142 PolarHBondContact N-O 3.4Å; F129-G142 WeakPolarHBondContact O-CA 3.49Å; N139-G142 WeakPolarHBondContact O-CA 3.48Å; N139-G142 PolarHBondContact O-N 3.16Å; N139-G142 PolarHBondContact OD1-N 3.07Å; S140-G142 VanDerWaalsContact C-N 3.35Å
143	V	98.4	Very high	96.9	Very high	63 Å²	63	46.5 Å²	46.5	38%	0.382	25%	0.247	S	C	.	.	B	Isolated β-bridge	trans	-67.7	135.1	173.8	-179.9	0	0	0	0	108.7	I138 N139 Q141 L179	I138-V143 VanDerWaalsContact CA-O 3.3Å; I138-V143 WeakPolarHBondContact CA-O 3.39Å; N139-V143 PolarHBondContact N-O 2.97Å; N139-V143 WeakPolarHBondContact OD1-CB 3.43Å; N139-V143 PolarHBondContact OD1-N 2.94Å; Q141-V143 VanDerWaalsContact C-N 3.27Å; Q141-V143 HydrophobicContact CB-CG2 4.41Å; Q141-V143 PolarHBondContact O-N 2.86Å; V143-L179 HydrophobicContact CB-CD1 4.42Å; V143-L179 HydrophobicContact CG1-CD1 4.21Å; V143-L179 WeakPolarHBondContact O-CD1 3.47Å
144	I	98.4	Very high	96.9	Very high	8 Å²	8	48.1 Å²	48.1	4%	0.041	26%	0.26	C	S	.	.	B	Isolated β-bridge	trans	-104.4	130.2	-177.7	-49.4	171.3	0	0	0	108.6	L112 V127 F129 I138 L146 I166 L169	L112-I144 HydrophobicContact CD2-CD1 4.28Å; V127-I144 HydrophobicContact CB-CD1 4.39Å; V127-I144 HydrophobicContact CG1-CD1 3.99Å; F129-I144 HydrophobicContact CD2-CD1 3.65Å; F129-I144 HydrophobicContact CD2-CG1 3.73Å; F129-I144 HydrophobicContact CE2-CD1 3.62Å; F129-I144 HydrophobicContact CE2-CG1 3.97Å; I138-I144 HydrophobicContact CG1-CG1 4.43Å; I138-I144 HydrophobicContact CG1-CG2 4.44Å; I144-L146 HydrophobicContact CG2-CB 3.92Å; I144-L146 PolarHBondContact O-N 3.2Å; I144-I166 HydrophobicContact CD1-CD1 3.86Å; I144-I166 HydrophobicContact CD1-CG1 4.31Å; I144-L169 HydrophobicContact CG2-CD2 3.87Å
145	C	96.6	Very high	96.9	Very high	13 Å²	13	49.1 Å²	49.1	9%	0.088	27%	0.27	C	S	.	.			trans	-88.7	102.2	161.9	-160.5	0	0	0	0	108.7	N137 K150 D177 L179	N137-C145 HydrophobicContact CB-CB 4.4Å; N137-C145 PolarHBondContact O-N 2.94Å; C145-K150 PolarHBondContact SG-NZ 3.42Å; C145-K150 VanDerWaalsContact SG-NZ 3.45Å; C145-D177 PolarHBondContact SG-OD2 2.91Å; C145-L179 HydrophobicContact CB-CD1 3.94Å; C145-L179 HydrophobicContact CB-CD2 3.88Å; C145-L179 HydrophobicContact CB-CG 3.63Å
146	L	95.3	Very high	96.8	Very high	19 Å²	19	52.3 Å²	52.3	10%	0.099	30%	0.296	C	S	.	.			trans	-142.2	123	174.7	-176.9	63.7	0	0	0	106.5	I144 I148 L149 I166	I144-L146 HydrophobicContact CG2-CB 3.92Å; I144-L146 PolarHBondContact O-N 3.2Å; L146-I148 VanDerWaalsContact C-N 3.3Å; L146-I148 HydrophobicContact CD1-CG1 4.38Å; L146-I148 HydrophobicContact CD2-CD1 4.03Å; L146-I148 HydrophobicContact CD2-CG1 3.72Å; L146-I148 HydrophobicContact CG-CD1 4.47Å; L146-I148 HydrophobicContact CG-CG1 3.66Å; L146-I148 PolarHBondContact O-N 3.44Å; L146-L149 HydrophobicContact CB-CD1 4.2Å; L146-L149 HydrophobicContact CB-CG 4.37Å; L146-L149 HydrophobicContact CD2-CD1 4.23Å; L146-L149 HydrophobicContact CD2-CG 4.27Å; L146-L149 WeakPolarHBondContact O-CB 3.4Å; L146-L149 PolarHBondContact O-N 2.96Å; L146-I166 HydrophobicContact CD2-CG1 3.95Å
147	D	93	Very high	96.8	Very high	80 Å²	80	53.8 Å²	53.8	43%	0.428	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-60.3	-37.4	-171.4	66.5	-33.1	0	0	0	112.9	L149 K150 D151 N152	D147-L149 PolarHBondContact O-N 3.34Å; D147-K150 CarbonylContact O-C 3.38Å; D147-K150 WeakPolarHBondContact O-CA 3.31Å; D147-K150 PolarHBondContact O-N 2.79Å; D147-D151 PolarHBondContact O-N 3.39Å; D147-N152 HydrophobicContact CB-CB 4.26Å; D147-N152 PolarHBondContact O-N 3.23Å; D147-N152 PolarHBondContact OD2-ND2 2.73Å
148	I	96.3	Very high	96.8	Very high	22 Å²	22	54.8 Å²	54.8	11%	0.113	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-66.3	-15	176.3	62.5	157.5	0	0	0	113.1	L146 K150 N152 W153 L157 V162	L146-I148 VanDerWaalsContact C-N 3.3Å; L146-I148 HydrophobicContact CD1-CG1 4.38Å; L146-I148 HydrophobicContact CD2-CD1 4.03Å; L146-I148 HydrophobicContact CD2-CG1 3.72Å; L146-I148 HydrophobicContact CG-CD1 4.47Å; L146-I148 HydrophobicContact CG-CG1 3.66Å; L146-I148 PolarHBondContact O-N 3.44Å; I148-K150 VanDerWaalsContact C-N 3.33Å; I148-N152 HydrophobicContact CG2-CB 4.48Å; I148-W153 WeakPolarHBondContact O-CA 3.45Å; I148-W153 WeakPolarHBondContact O-CB 3.36Å; I148-W153 VanDerWaalsContact O-CE3 3.27Å; I148-L157 HydrophobicContact CB-CD1 3.81Å; I148-L157 HydrophobicContact CD1-CD1 4.41Å; I148-L157 HydrophobicContact CG2-CD1 4.06Å; I148-V162 HydrophobicContact CD1-CG2 4.14Å
149	L	95.4	Very high	96.8	Very high	23 Å²	23	54.8 Å²	54.8	12%	0.12	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-91.8	3.4	172	-64	178.1	0	0	0	112.7	P124 V127 L146 D147 V162	P124-L149 WeakPolarHBondContact CG-O 3.44Å; V127-L149 HydrophobicContact CB-CD1 4.07Å; V127-L149 HydrophobicContact CG2-CD1 4.37Å; V127-L149 HydrophobicContact CG2-CD2 4.07Å; L146-L149 HydrophobicContact CB-CD1 4.2Å; L146-L149 HydrophobicContact CB-CG 4.37Å; L146-L149 HydrophobicContact CD2-CD1 4.23Å; L146-L149 HydrophobicContact CD2-CG 4.27Å; L146-L149 WeakPolarHBondContact O-CB 3.4Å; L146-L149 PolarHBondContact O-N 2.96Å; D147-L149 PolarHBondContact O-N 3.34Å; L149-V162 HydrophobicContact CD2-CG1 3.86Å; L149-V162 HydrophobicContact CD2-CG2 4.31Å
150	K	91.7	Very high	96.7	Very high	105 Å²	105	53.6 Å²	53.6	46%	0.457	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133.2	-109.8	-178.9	-62.5	179.2	-178.7	173.4	0	109.7	C145 D147 I148 W153	C145-K150 PolarHBondContact SG-NZ 3.42Å; C145-K150 VanDerWaalsContact SG-NZ 3.45Å; D147-K150 CarbonylContact O-C 3.38Å; D147-K150 WeakPolarHBondContact O-CA 3.31Å; D147-K150 PolarHBondContact O-N 2.79Å; I148-K150 VanDerWaalsContact C-N 3.33Å; K150-W153 PolarHBondContact O-N 3.49Å
151	D	91.7	Very high	96.8	Very high	155 Å²	155	53.4 Å²	53.4	83%	0.829	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-23.8	-166.4	-53.8	-38.2	0	0	0	112.7	D147	D147-D151 PolarHBondContact O-N 3.39Å
152	N	96.2	Very high	96.8	Very high	99 Å²	99	46.5 Å²	46.5	53%	0.529	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	17.7	179	-70.4	-20.2	0	0	0	112.9	D147 I148 S154	D147-N152 HydrophobicContact CB-CB 4.26Å; D147-N152 PolarHBondContact O-N 3.23Å; D147-N152 PolarHBondContact OD2-ND2 2.73Å; I148-N152 HydrophobicContact CG2-CB 4.48Å; N152-S154 PolarHBondContact O-N 3.49Å
153	W	98.3	Very high	96.8	Very high	29 Å²	29	46.2 Å²	46.2	11%	0.11	26%	0.256	C	S	.	.			trans	-65.4	135.1	172.5	175.7	-103.9	0	0	0	110.9	Y120 P121 P124 P125 I148 K150 L157 V162	Y120-W153 HydrophobicContact CD2-CZ2 4.23Å; Y120-W153 AromaticContact CE2-CH2 3.7Å; Y120-W153 HydrophobicContact CE2-CH2 3.7Å; Y120-W153 AromaticContact CE2-CZ2 3.56Å; Y120-W153 HydrophobicContact CE2-CZ2 3.56Å; P121-W153 HydrophobicContact CB-CZ2 4.5Å; P121-W153 PolarHBondContact O-NE1 3.02Å; P124-W153 VanDerWaalsContact CA-CD2 3.5Å; P124-W153 HydrophobicContact CB-CB 3.97Å; P124-W153 HydrophobicContact CB-CD2 3.58Å; P124-W153 HydrophobicContact CB-CE3 3.82Å; P124-W153 HydrophobicContact CB-CG 3.63Å; P124-W153 HydrophobicContact CG-CB 4.12Å; P124-W153 HydrophobicContact CG-CG 4.07Å; P125-W153 HydrophobicContact CG-CH2 4.48Å; I148-W153 WeakPolarHBondContact O-CA 3.45Å; I148-W153 WeakPolarHBondContact O-CB 3.36Å; I148-W153 VanDerWaalsContact O-CE3 3.27Å; K150-W153 PolarHBondContact O-N 3.49Å; W153-L157 HydrophobicContact CE3-CB 4.07Å; W153-L157 HydrophobicContact CE3-CD1 3.83Å; W153-L157 HydrophobicContact CH2-CB 3.92Å; W153-L157 HydrophobicContact CZ3-CB 3.61Å; W153-L157 HydrophobicContact CZ3-CD1 4.13Å; W153-V162 HydrophobicContact CZ3-CG2 3.93Å
154	S	98.1	Very high	96.8	Very high	50 Å²	50	47 Å²	47	35%	0.35	26%	0.258	S	S	.	.			trans	-126.8	139	172.2	171.3	0	0	0	0	109.9	N152 A156 L157	N152-S154 PolarHBondContact O-N 3.49Å; S154-A156 PolarHBondContact O-N 2.82Å; S154-A156 PolarHBondContact OG-N 2.93Å; S154-L157 WeakPolarHBondContact O-CB 3.28Å; S154-L157 PolarHBondContact O-N 3.03Å
155	P	97.7	Very high	96.7	Very high	52 Å²	52	48.8 Å²	48.8	34%	0.338	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-14.7	173.4	-24.3	33.6	0	0	0	114.7	R65 P121 F122	R65-P155 PolarHBondContact NH1-O 3.28Å; R65-P155 PolarHBondContact NH2-O 3Å; P121-P155 HydrophobicContact CB-CB 4.29Å; P121-P155 HydrophobicContact CG-CB 4.16Å; P121-P155 WeakPolarHBondContact O-CA 3.38Å; F122-P155 HydrophobicContact CD1-CB 4.41Å; F122-P155 HydrophobicContact CD1-CG 3.88Å; F122-P155 HydrophobicContact CE1-CG 4.39Å
156	A	97.7	Very high	96.8	Very high	67 Å²	67	48.2 Å²	48.2	55%	0.554	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-10.4	174.1	0	0	0	0	0	114.1	S154	S154-A156 PolarHBondContact O-N 2.82Å; S154-A156 PolarHBondContact OG-N 2.93Å
157	L	98.3	Very high	97	Very high	31 Å²	31	48.2 Å²	48.2	16%	0.162	27%	0.268	C	S	.	.			trans	-75.9	148.5	170.4	-64.8	175.3	0	0	0	110.1	R65 I148 W153 S154 K161	R65-L157 PolarHBondContact NH2-O 3.43Å; I148-L157 HydrophobicContact CB-CD1 3.81Å; I148-L157 HydrophobicContact CD1-CD1 4.41Å; I148-L157 HydrophobicContact CG2-CD1 4.06Å; W153-L157 HydrophobicContact CE3-CB 4.07Å; W153-L157 HydrophobicContact CE3-CD1 3.83Å; W153-L157 HydrophobicContact CH2-CB 3.92Å; W153-L157 HydrophobicContact CZ3-CB 3.61Å; W153-L157 HydrophobicContact CZ3-CD1 4.13Å; S154-L157 WeakPolarHBondContact O-CB 3.28Å; S154-L157 PolarHBondContact O-N 3.03Å; L157-K161 HydrophobicContact CD2-CB 4.39Å; L157-K161 HydrophobicContact CD2-CD 4.05Å
158	T	98.3	Very high	97.2	Very high	24 Å²	24	47.9 Å²	47.9	15%	0.147	27%	0.272	C	S	.	.			trans	-124.7	165.1	179.8	61.6	0	0	0	0	109.5	E69 S160 K161 V162	E69-T158 HydrophobicContact CG-CG2 4.41Å; E69-T158 VanDerWaalsContact OE2-CA 3.25Å; E69-T158 WeakPolarHBondContact OE2-CA 3.29Å; E69-T158 VanDerWaalsContact OE2-CB 3.28Å; E69-T158 WeakPolarHBondContact OE2-CB 3.37Å; T158-S160 VanDerWaalsContact C-N 3.26Å; T158-S160 PolarHBondContact O-N 3.49Å; T158-K161 PolarHBondContact O-N 3.1Å; T158-K161 VanDerWaalsContact O-N 3.12Å; T158-K161 PolarHBondContact OG1-N 3.44Å; T158-V162 WeakPolarHBondContact O-CG2 3.36Å; T158-V162 PolarHBondContact O-N 3.1Å
159	I	98.4	Very high	97.2	Very high	1 Å²	1	47.6 Å²	47.6	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-57.6	-40.8	174.4	-65.2	-55	0	0	0	111.5	E69 I73 A83 W93 I114 F116 P125 K161 V162 L163	E69-I159 PolarHBondContact OE2-N 3.03Å; I73-I159 HydrophobicContact CD1-CG2 4.11Å; A83-I159 HydrophobicContact CB-CG2 4.44Å; W93-I159 HydrophobicContact CE3-CG2 4.37Å; W93-I159 HydrophobicContact CZ3-CB 4.4Å; W93-I159 HydrophobicContact CZ3-CG1 4.37Å; W93-I159 HydrophobicContact CZ3-CG2 4.12Å; I114-I159 HydrophobicContact CD1-CG2 3.99Å; I114-I159 HydrophobicContact CG2-CD1 3.95Å; F116-I159 HydrophobicContact CE1-CD1 3.56Å; F116-I159 HydrophobicContact CE1-CG1 3.66Å; F116-I159 HydrophobicContact CZ-CD1 3.73Å; F116-I159 HydrophobicContact CZ-CG1 3.6Å; P125-I159 HydrophobicContact CB-CD1 4.19Å; P125-I159 HydrophobicContact CG-CD1 3.74Å; I159-K161 VanDerWaalsContact C-N 3.31Å; I159-K161 PolarHBondContact O-N 3.21Å; I159-V162 PolarHBondContact O-N 2.79Å; I159-V162 VanDerWaalsContact O-N 3.16Å; I159-L163 HydrophobicContact CG2-CD1 3.86Å; I159-L163 HydrophobicContact CG2-CG 4.14Å; I159-L163 WeakPolarHBondContact O-CG 3.39Å; I159-L163 PolarHBondContact O-N 2.84Å
160	S	98.1	Very high	97.4	Very high	23 Å²	23	46.7 Å²	46.7	16%	0.161	27%	0.266	C	S	.	.	H	α-helix	trans	-55.4	-46.1	174.7	-60	0	0	0	0	111.9	T158 L163 L164	T158-S160 VanDerWaalsContact C-N 3.26Å; T158-S160 PolarHBondContact O-N 3.49Å; S160-L163 PolarHBondContact O-N 3.33Å; S160-L164 VanDerWaalsContact O-CG 3.3Å; S160-L164 WeakPolarHBondContact O-CG 3.44Å; S160-L164 PolarHBondContact O-N 3.25Å
161	K	98	Very high	97.6	Very high	106 Å²	106	44.8 Å²	44.8	46%	0.461	26%	0.263	S	S	.	.	H	α-helix	trans	-66.7	-39.8	177.1	-69.5	178.4	-178.9	175.7	0	112.3	L157 T158 I159 L164 S165	L157-K161 HydrophobicContact CD2-CB 4.39Å; L157-K161 HydrophobicContact CD2-CD 4.05Å; T158-K161 PolarHBondContact O-N 3.1Å; T158-K161 VanDerWaalsContact O-N 3.12Å; T158-K161 PolarHBondContact OG1-N 3.44Å; I159-K161 VanDerWaalsContact C-N 3.31Å; I159-K161 PolarHBondContact O-N 3.21Å; K161-L164 PolarHBondContact O-N 3.48Å; K161-S165 PolarHBondContact O-N 3.07Å; K161-S165 PolarHBondContact O-OG 2.99Å
162	V	98.5	Very high	97.8	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.006	25%	0.252	C	S	.	.	H	α-helix	trans	-60.8	-46.3	175.9	169.8	0	0	0	0	111.1	V127 I148 L149 W153 T158 I159 L164 S165 I166	V127-V162 HydrophobicContact CG2-CG1 4.17Å; I148-V162 HydrophobicContact CD1-CG2 4.14Å; L149-V162 HydrophobicContact CD2-CG1 3.86Å; L149-V162 HydrophobicContact CD2-CG2 4.31Å; W153-V162 HydrophobicContact CZ3-CG2 3.93Å; T158-V162 WeakPolarHBondContact O-CG2 3.36Å; T158-V162 PolarHBondContact O-N 3.1Å; I159-V162 PolarHBondContact O-N 2.79Å; I159-V162 VanDerWaalsContact O-N 3.16Å; V162-L164 PolarHBondContact O-N 3.4Å; V162-S165 PolarHBondContact O-N 3.34Å; V162-I166 HydrophobicContact CG1-CD1 4.02Å; V162-I166 WeakPolarHBondContact O-CG1 3.39Å; V162-I166 PolarHBondContact O-N 3Å
163	L	98.6	Very high	97.8	Very high	0 Å²	0	39 Å²	39	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-64.9	-38.9	179.1	-66.8	174.2	0	0	0	112.1	I73 C81 A83 S95 I97 I114 I159 S160 I166 C167	I73-L163 HydrophobicContact CD1-CD1 3.98Å; C81-L163 HydrophobicContact CB-CB 4.43Å; C81-L163 HydrophobicContact CB-CD1 4.29Å; A83-L163 HydrophobicContact CB-CD1 3.98Å; S95-L163 VanDerWaalsContact OG-CD2 3.3Å; S95-L163 WeakPolarHBondContact OG-CD2 3.34Å; I97-L163 HydrophobicContact CD1-CD2 4.1Å; I97-L163 HydrophobicContact CG1-CD2 4.44Å; I114-L163 HydrophobicContact CD1-CD2 4.4Å; I159-L163 HydrophobicContact CG2-CD1 3.86Å; I159-L163 HydrophobicContact CG2-CG 4.14Å; I159-L163 WeakPolarHBondContact O-CG 3.39Å; I159-L163 PolarHBondContact O-N 2.84Å; S160-L163 PolarHBondContact O-N 3.33Å; L163-I166 PolarHBondContact O-N 3.33Å; L163-C167 PolarHBondContact O-N 2.77Å; L163-C167 PolarHBondContact O-SG 2.9Å
164	L	97.6	Very high	97.6	Very high	80 Å²	80	41.1 Å²	41.1	42%	0.419	25%	0.247	S	C	.	.	H	α-helix	trans	-61.3	-43.9	172.4	-73.1	171.6	0	0	0	112	P78 S160 K161 V162 I166 C167 S168	P78-L164 HydrophobicContact CB-CD2 3.81Å; P78-L164 HydrophobicContact CB-CG 3.91Å; S160-L164 VanDerWaalsContact O-CG 3.3Å; S160-L164 WeakPolarHBondContact O-CG 3.44Å; S160-L164 PolarHBondContact O-N 3.25Å; K161-L164 PolarHBondContact O-N 3.48Å; V162-L164 PolarHBondContact O-N 3.4Å; L164-I166 VanDerWaalsContact C-N 3.31Å; L164-I166 PolarHBondContact O-N 3.18Å; L164-C167 WeakPolarHBondContact O-CB 3.27Å; L164-C167 PolarHBondContact O-N 3.06Å; L164-S168 PolarHBondContact O-N 3.03Å
165	S	98	Very high	97.6	Very high	44 Å²	44	40.1 Å²	40.1	31%	0.308	24%	0.239	S	C	.	.	H	α-helix	trans	-63.7	-36.2	175.8	-64.3	0	0	0	0	112.3	K161 V162 S168 L169	K161-S165 PolarHBondContact O-N 3.07Å; K161-S165 PolarHBondContact O-OG 2.99Å; V162-S165 PolarHBondContact O-N 3.34Å; S165-S168 WeakPolarHBondContact O-CB 3.13Å; S165-S168 PolarHBondContact O-N 3.41Å; S165-L169 WeakPolarHBondContact O-CB 3.5Å; S165-L169 PolarHBondContact O-N 2.83Å
166	I	98.5	Very high	97.5	Very high	1 Å²	1	42 Å²	42	1%	0.005	26%	0.26	C	S	.	.	H	α-helix	trans	-66.4	-42.3	173.2	-66.5	166	0	0	0	110.6	I97 L112 V127 F129 I144 L146 V162 L163 L164 S168 L169 L170	I97-I166 HydrophobicContact CD1-CB 4.14Å; I97-I166 HydrophobicContact CD1-CG2 3.65Å; L112-I166 HydrophobicContact CD2-CD1 4Å; L112-I166 HydrophobicContact CD2-CG2 4.43Å; V127-I166 HydrophobicContact CG1-CD1 3.88Å; F129-I166 HydrophobicContact CE2-CG2 3.93Å; F129-I166 HydrophobicContact CZ-CG2 3.86Å; I144-I166 HydrophobicContact CD1-CD1 3.86Å; I144-I166 HydrophobicContact CD1-CG1 4.31Å; L146-I166 HydrophobicContact CD2-CG1 3.95Å; V162-I166 HydrophobicContact CG1-CD1 4.02Å; V162-I166 WeakPolarHBondContact O-CG1 3.39Å; V162-I166 PolarHBondContact O-N 3Å; L163-I166 PolarHBondContact O-N 3.33Å; L164-I166 VanDerWaalsContact C-N 3.31Å; L164-I166 PolarHBondContact O-N 3.18Å; I166-S168 VanDerWaalsContact C-N 3.3Å; I166-S168 PolarHBondContact O-N 3.27Å; I166-L169 WeakPolarHBondContact O-CB 3.39Å; I166-L169 PolarHBondContact O-N 2.93Å; I166-L169 VanDerWaalsContact O-N 3.17Å; I166-L170 WeakPolarHBondContact O-CG 3.45Å; I166-L170 PolarHBondContact O-N 3.06Å
167	C	97.8	Very high	97.3	Very high	19 Å²	19	43.1 Å²	43.1	13%	0.128	26%	0.256	C	S	.	.	H	α-helix	trans	-61.1	-40.6	175.2	-67.2	0	0	0	0	112.2	C81 L163 L164 L170 T171	C81-C167 PolarHBondContact SG-SG 3.08Å; L163-C167 PolarHBondContact O-N 2.77Å; L163-C167 PolarHBondContact O-SG 2.9Å; L164-C167 WeakPolarHBondContact O-CB 3.27Å; L164-C167 PolarHBondContact O-N 3.06Å; C167-L170 PolarHBondContact O-N 3.15Å; C167-T171 PolarHBondContact O-N 3.27Å; C167-T171 PolarHBondContact O-OG1 3.47Å; C167-T171 VanDerWaalsContact O-OG1 3.07Å
168	S	97.2	Very high	97.2	Very high	73 Å²	73	43.7 Å²	43.7	51%	0.51	26%	0.262	S	S	.	.	H	α-helix	trans	-60.2	-46.8	173.1	-169.1	0	0	0	0	110.8	L164 S165 I166 L170 T171 D172	L164-S168 PolarHBondContact O-N 3.03Å; S165-S168 WeakPolarHBondContact O-CB 3.13Å; S165-S168 PolarHBondContact O-N 3.41Å; I166-S168 VanDerWaalsContact C-N 3.3Å; I166-S168 PolarHBondContact O-N 3.27Å; S168-L170 VanDerWaalsContact C-N 3.31Å; S168-L170 PolarHBondContact O-N 3.12Å; S168-T171 WeakPolarHBondContact O-CA 3.24Å; S168-T171 WeakPolarHBondContact O-CB 3.48Å; S168-T171 PolarHBondContact O-N 2.88Å; S168-D172 PolarHBondContact O-N 3.49Å
169	L	97.8	Very high	97.2	Very high	16 Å²	16	45.6 Å²	45.6	8%	0.084	27%	0.271	C	S	.	.	H	α-helix	trans	-60	-38	177.4	-175.1	67.1	0	0	0	112.8	H135 N137 I144 S165 I166 T171 D172 C173	H135-L169 PolarHBondContact NE2-O 2.65Å; H135-L169 VanDerWaalsContact NE2-O 3.08Å; N137-L169 HydrophobicContact CB-CD1 4.33Å; N137-L169 HydrophobicContact CB-CD2 4.17Å; I144-L169 HydrophobicContact CG2-CD2 3.87Å; S165-L169 WeakPolarHBondContact O-CB 3.5Å; S165-L169 PolarHBondContact O-N 2.83Å; I166-L169 WeakPolarHBondContact O-CB 3.39Å; I166-L169 PolarHBondContact O-N 2.93Å; I166-L169 VanDerWaalsContact O-N 3.17Å; L169-T171 PolarHBondContact O-N 3.38Å; L169-D172 CarbonylContact O-C 3.23Å; L169-D172 VanDerWaalsContact O-C 3.23Å; L169-D172 PolarHBondContact O-N 3.36Å; L169-C173 WeakPolarHBondContact O-CA 3.49Å; L169-C173 PolarHBondContact O-N 3.24Å
170	L	98.2	Very high	97.2	Very high	4 Å²	4	47 Å²	47	2%	0.021	28%	0.28	C	S	.	.	H	α-helix	trans	-67	-25.1	174.9	-67.4	-175.5	0	0	0	112.9	I97 P100 Y105 F129 I133 I138 I166 C167 S168	I97-L170 HydrophobicContact CG2-CD1 4.14Å; P100-L170 HydrophobicContact CG-CB 4.04Å; Y105-L170 HydrophobicContact CD2-CB 3.92Å; Y105-L170 HydrophobicContact CD2-CD2 4.25Å; Y105-L170 VanDerWaalsContact CD2-O 3.24Å; Y105-L170 WeakPolarHBondContact CD2-O 3.47Å; Y105-L170 HydrophobicContact CE2-CB 4.23Å; Y105-L170 HydrophobicContact CE2-CD2 4.15Å; Y105-L170 WeakPolarHBondContact CE2-O 3.48Å; F129-L170 HydrophobicContact CZ-CD1 4.41Å; F129-L170 HydrophobicContact CZ-CD2 4.21Å; I133-L170 HydrophobicContact CD1-CD2 3.54Å; I138-L170 HydrophobicContact CD1-CD2 4.02Å; I166-L170 WeakPolarHBondContact O-CG 3.45Å; I166-L170 PolarHBondContact O-N 3.06Å; C167-L170 PolarHBondContact O-N 3.15Å; S168-L170 VanDerWaalsContact C-N 3.31Å; S168-L170 PolarHBondContact O-N 3.12Å
171	T	96.6	Very high	97.2	Very high	66 Å²	66	47.8 Å²	47.8	41%	0.405	29%	0.291	S	S	.	.	H	α-helix	trans	-82.6	-46.5	175.7	-51.6	0	0	0	0	110	C167 S168 L169	C167-T171 PolarHBondContact O-N 3.27Å; C167-T171 PolarHBondContact O-OG1 3.47Å; C167-T171 VanDerWaalsContact O-OG1 3.07Å; S168-T171 WeakPolarHBondContact O-CA 3.24Å; S168-T171 WeakPolarHBondContact O-CB 3.48Å; S168-T171 PolarHBondContact O-N 2.88Å; L169-T171 PolarHBondContact O-N 3.38Å
172	D	95.6	Very high	97.2	Very high	110 Å²	110	46.8 Å²	46.8	59%	0.588	30%	0.298	S	S	*	.	S	Bend	trans	-127.4	90.3	-175.5	-63.5	-62.6	0	0	0	110.4	S168 L169	S168-D172 PolarHBondContact O-N 3.49Å; L169-D172 CarbonylContact O-C 3.23Å; L169-D172 VanDerWaalsContact O-C 3.23Å; L169-D172 PolarHBondContact O-N 3.36Å
173	C	95.9	Very high	97.2	Very high	21 Å²	21	47.3 Å²	47.3	14%	0.142	30%	0.3	C	S	.	.			trans	-69.1	157.7	177.3	76.8	0	0	0	0	111.8	H135 C136 L169 P175 Y187	H135-C173 WeakPolarHBondContact NE2-CB 3.38Å; C136-C173 VanDerWaalsContact SG-SG 3.63Å; L169-C173 WeakPolarHBondContact O-CA 3.49Å; L169-C173 PolarHBondContact O-N 3.24Å; C173-P175 WeakPolarHBondContact O-CD 3.4Å; C173-Y187 VanDerWaalsContact SG-CE2 3.5Å; C173-Y187 VanDerWaalsContact SG-CZ 3.52Å
174	N	95.9	Very high	97.2	Very high	75 Å²	75	47.5 Å²	47.5	40%	0.401	30%	0.302	S	S	.	.			trans	-106.7	91.2	175.8	-177.5	2.7	0	0	0	111.3	N137 A176 D177	N137-N174 PolarHBondContact ND2-O 3.17Å; N137-N174 PolarHBondContact OD1-N 3.04Å; N174-A176 PolarHBondContact O-N 3.41Å; N174-A176 WeakPolarHBondContact OD1-CB 3.29Å; N174-A176 PolarHBondContact OD1-N 2.84Å; N174-A176 VanDerWaalsContact OD1-N 3.11Å; N174-D177 PolarHBondContact O-N 3.01Å
175	P	96.1	Very high	97.3	Very high	28 Å²	28	47.6 Å²	47.6	18%	0.182	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-9.5	-179.7	31.2	-37.3	0	0	0	114.1	C173 P178 A184 Y187 L188	C173-P175 WeakPolarHBondContact O-CD 3.4Å; P175-P178 WeakPolarHBondContact O-CD 3.39Å; P175-A184 HydrophobicContact CB-CB 4.13Å; P175-Y187 HydrophobicContact CB-CD1 4.04Å; P175-Y187 HydrophobicContact CG-CD1 3.92Å; P175-Y187 HydrophobicContact CG-CE1 4.03Å; P175-L188 HydrophobicContact CB-CD1 4.12Å; P175-L188 HydrophobicContact CB-CD2 4.09Å; P175-L188 HydrophobicContact CB-CG 3.97Å; P175-L188 HydrophobicContact CG-CD2 3.77Å; P175-L188 HydrophobicContact CG-CG 4.23Å
176	A	95.7	Very high	97.3	Very high	93 Å²	93	47.5 Å²	47.5	77%	0.769	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-22.9	178.1	0	0	0	0	0	113.1	N174 P178	N174-A176 PolarHBondContact O-N 3.41Å; N174-A176 WeakPolarHBondContact OD1-CB 3.29Å; N174-A176 PolarHBondContact OD1-N 2.84Å; N174-A176 VanDerWaalsContact OD1-N 3.11Å; A176-P178 VanDerWaalsContact C-CD 3.48Å
177	D	94.3	Very high	97.3	Very high	90 Å²	90	49.4 Å²	49.4	48%	0.481	31%	0.308	S	S	.	.	S	Bend	trans	-127.8	67.6	173.1	-176.5	33.3	0	0	0	111.6	N137 C145 N174	N137-D177 PolarHBondContact ND2-O 3.42Å; C145-D177 PolarHBondContact SG-OD2 2.91Å; N174-D177 PolarHBondContact O-N 3.01Å
178	P	97.1	Very high	97.3	Very high	43 Å²	43	54.1 Å²	54.1	28%	0.279	33%	0.331	S	S	.	.			trans	-86.9	147.3	-174	36	-34.6	0	0	0	112.5	C136 P175 A176 A184	C136-P178 HydrophobicContact CB-CB 4.2Å; P175-P178 WeakPolarHBondContact O-CD 3.39Å; A176-P178 VanDerWaalsContact C-CD 3.48Å; P178-A184 HydrophobicContact CB-CB 3.55Å; P178-A184 HydrophobicContact CG-CB 3.76Å
179	L	97.4	Very high	97.3	Very high	63 Å²	63	55.9 Å²	55.9	33%	0.33	34%	0.339	S	S	.	.	S	Bend	trans	-82.3	-24.8	162.2	-65.6	-177	0	0	0	112.3	C136 N137 N139 V143 C145	C136-L179 PolarHBondContact O-N 2.92Å; N137-L179 WeakPolarHBondContact O-CD1 3.45Å; N139-L179 HydrophobicContact CB-CB 4.17Å; N139-L179 HydrophobicContact CB-CD1 4.37Å; V143-L179 HydrophobicContact CB-CD1 4.42Å; V143-L179 HydrophobicContact CG1-CD1 4.21Å; V143-L179 WeakPolarHBondContact O-CD1 3.47Å; C145-L179 HydrophobicContact CB-CD1 3.94Å; C145-L179 HydrophobicContact CB-CD2 3.88Å; C145-L179 HydrophobicContact CB-CG 3.63Å
180	V	98.2	Very high	97.4	Very high	32 Å²	32	58.9 Å²	58.9	19%	0.194	36%	0.355	C	S	.	.	S	Bend	trans	-124.3	89.1	-179.1	-165.8	0	0	0	0	109	C136 N139 S182 I183 A184	C136-V180 PolarHBondContact O-N 2.69Å; N139-V180 HydrophobicContact CB-CG2 4.1Å; V180-S182 VanDerWaalsContact C-N 3.27Å; V180-S182 PolarHBondContact O-N 3.02Å; V180-I183 HydrophobicContact CB-CB 4.32Å; V180-I183 HydrophobicContact CB-CD1 3.99Å; V180-I183 HydrophobicContact CB-CG1 4.09Å; V180-I183 HydrophobicContact CG1-CB 4.27Å; V180-I183 HydrophobicContact CG1-CD1 3.72Å; V180-I183 HydrophobicContact CG1-CG1 3.62Å; V180-I183 HydrophobicContact CG2-CD1 4.43Å; V180-I183 PolarHBondContact O-N 3.23Å; V180-I183 VanDerWaalsContact O-N 3.13Å; V180-A184 PolarHBondContact O-N 3.39Å
181	G	98.2	Very high	97.4	Very high	39 Å²	39	64 Å²	64	40%	0.402	37%	0.374	S	S	.	.	H	α-helix	trans	-57.5	-35.5	-174.6	0	0	0	0	0	114	I183 A184 T185	G181-I183 PolarHBondContact O-N 3.14Å; G181-A184 WeakPolarHBondContact O-CB 3.43Å; G181-A184 PolarHBondContact O-N 3.08Å; G181-T185 PolarHBondContact O-N 3.04Å; G181-T185 PolarHBondContact O-OG1 3.19Å; G181-T185 VanDerWaalsContact O-OG1 3.1Å
182	S	98.3	Very high	97.5	Very high	85 Å²	85	64.3 Å²	64.3	59%	0.594	38%	0.383	S	S	*	.	H	α-helix	trans	-63.6	-39.7	177.5	54.2	0	0	0	0	113.1	V180 Q186	V180-S182 VanDerWaalsContact C-N 3.27Å; V180-S182 PolarHBondContact O-N 3.02Å; S182-Q186 PolarHBondContact O-N 2.89Å
183	I	98.6	Very high	97.6	Very high	12 Å²	12	61.9 Å²	61.9	6%	0.062	37%	0.368	C	S	.	.	H	α-helix	trans	-67.9	-41	175.9	-58.7	-177.8	0	0	0	109.8	Y134 C136 V180 G181 Q186 Y187	Y134-I183 HydrophobicContact CD1-CD1 4.43Å; Y134-I183 HydrophobicContact CD1-CG2 4.09Å; Y134-I183 HydrophobicContact CD2-CD1 3.83Å; Y134-I183 HydrophobicContact CD2-CG1 4.41Å; Y134-I183 HydrophobicContact CE1-CB 4.44Å; Y134-I183 HydrophobicContact CE1-CD1 4.34Å; Y134-I183 HydrophobicContact CE1-CG1 4.14Å; Y134-I183 HydrophobicContact CE1-CG2 3.68Å; Y134-I183 HydrophobicContact CE2-CD1 3.71Å; Y134-I183 HydrophobicContact CE2-CG1 3.8Å; Y134-I183 HydrophobicContact CG-CD1 4.19Å; C136-I183 HydrophobicContact CB-CB 4.08Å; C136-I183 HydrophobicContact CB-CG2 3.91Å; V180-I183 HydrophobicContact CB-CB 4.32Å; V180-I183 HydrophobicContact CB-CD1 3.99Å; V180-I183 HydrophobicContact CB-CG1 4.09Å; V180-I183 HydrophobicContact CG1-CB 4.27Å; V180-I183 HydrophobicContact CG1-CD1 3.72Å; V180-I183 HydrophobicContact CG1-CG1 3.62Å; V180-I183 HydrophobicContact CG2-CD1 4.43Å; V180-I183 PolarHBondContact O-N 3.23Å; V180-I183 VanDerWaalsContact O-N 3.13Å; G181-I183 PolarHBondContact O-N 3.14Å; I183-Q186 PolarHBondContact O-N 3.05Å; I183-Y187 WeakPolarHBondContact O-CB 3.42Å; I183-Y187 PolarHBondContact O-N 2.77Å
184	A	98.5	Very high	97.8	Very high	4 Å²	4	61.1 Å²	61.1	3%	0.033	36%	0.362	C	S	.	.	H	α-helix	trans	-62.5	-46.6	176.9	0	0	0	0	0	112.3	C136 P175 P178 V180 G181 Q186 Y187 L188	C136-A184 HydrophobicContact CB-CB 3.89Å; P175-A184 HydrophobicContact CB-CB 4.13Å; P178-A184 HydrophobicContact CB-CB 3.55Å; P178-A184 HydrophobicContact CG-CB 3.76Å; V180-A184 PolarHBondContact O-N 3.39Å; G181-A184 WeakPolarHBondContact O-CB 3.43Å; G181-A184 PolarHBondContact O-N 3.08Å; A184-Q186 VanDerWaalsContact C-N 3.32Å; A184-Q186 PolarHBondContact O-N 3.22Å; A184-Y187 WeakPolarHBondContact O-CB 3.49Å; A184-Y187 PolarHBondContact O-N 3.3Å; A184-L188 WeakPolarHBondContact O-CG 3.42Å; A184-L188 PolarHBondContact O-N 2.86Å
185	T	98.5	Very high	97.9	Very high	82 Å²	82	58.6 Å²	58.6	50%	0.503	35%	0.349	S	S	.	.	H	α-helix	trans	-59.5	-44.7	175.6	-60.5	0	0	0	0	110.9	G181 L188 T189	G181-T185 PolarHBondContact O-N 3.04Å; G181-T185 PolarHBondContact O-OG1 3.19Å; G181-T185 VanDerWaalsContact O-OG1 3.1Å; T185-L188 PolarHBondContact O-N 3.44Å; T185-T189 HydrophobicContact CG2-CG2 4.25Å; T185-T189 WeakPolarHBondContact O-CB 3.39Å; T185-T189 WeakPolarHBondContact O-CG2 3.4Å; T185-T189 PolarHBondContact O-N 2.99Å; T185-T189 PolarHBondContact O-OG1 2.87Å
186	Q	98.6	Very high	98	Very high	42 Å²	42	62.7 Å²	62.7	20%	0.196	36%	0.361	C	S	.	.	H	α-helix	trans	-64.3	-41.1	176.9	-167.6	-176.6	54.2	0	0	112	Y134 S182 I183 A184 L188 T189 N190 H194	Y134-Q186 PolarHBondContact OH-OE1 2.84Å; S182-Q186 PolarHBondContact O-N 2.89Å; I183-Q186 PolarHBondContact O-N 3.05Å; A184-Q186 VanDerWaalsContact C-N 3.32Å; A184-Q186 PolarHBondContact O-N 3.22Å; Q186-L188 VanDerWaalsContact C-N 3.27Å; Q186-L188 PolarHBondContact O-N 3.07Å; Q186-T189 PolarHBondContact O-N 2.87Å; Q186-N190 CarbonylContact O-C 3.06Å; Q186-N190 WeakPolarHBondContact O-CA 3.39Å; Q186-N190 PolarHBondContact O-N 2.78Å; Q186-N190 VanDerWaalsContact O-O 3.14Å; Q186-H194 HydrophobicContact CG-CB 4.16Å
187	Y	98.4	Very high	98.2	Very high	41 Å²	41	59.4 Å²	59.4	16%	0.161	33%	0.33	C	S	.	.	H	α-helix	trans	-56.1	-42.9	175.3	-179.9	-93.3	0	0	0	111.9	C173 P175 I183 A184 R191 H194	C173-Y187 VanDerWaalsContact SG-CE2 3.5Å; C173-Y187 VanDerWaalsContact SG-CZ 3.52Å; P175-Y187 HydrophobicContact CB-CD1 4.04Å; P175-Y187 HydrophobicContact CG-CD1 3.92Å; P175-Y187 HydrophobicContact CG-CE1 4.03Å; I183-Y187 WeakPolarHBondContact O-CB 3.42Å; I183-Y187 PolarHBondContact O-N 2.77Å; A184-Y187 WeakPolarHBondContact O-CB 3.49Å; A184-Y187 PolarHBondContact O-N 3.3Å; Y187-R191 VanDerWaalsContact CE2-CZ 3.44Å; Y187-R191 VanDerWaalsContact CZ-NH1 3.32Å; Y187-R191 PolarHBondContact OH-NH1 3.49Å; Y187-H194 AromaticContact CD2-CE1 3.63Å; Y187-H194 AromaticContact CD2-ND1 3.71Å; Y187-H194 AromaticContact CD2-NE2 3.86Å
188	L	98.1	Very high	98.4	Very high	118 Å²	118	55.1 Å²	55.1	62%	0.618	31%	0.307	S	S	*	.	H	α-helix	trans	-77.4	-36.3	-178.8	-67.6	173.7	0	0	0	113.6	P175 A184 T185 Q186	P175-L188 HydrophobicContact CB-CD1 4.12Å; P175-L188 HydrophobicContact CB-CD2 4.09Å; P175-L188 HydrophobicContact CB-CG 3.97Å; P175-L188 HydrophobicContact CG-CD2 3.77Å; P175-L188 HydrophobicContact CG-CG 4.23Å; A184-L188 WeakPolarHBondContact O-CG 3.42Å; A184-L188 PolarHBondContact O-N 2.86Å; T185-L188 PolarHBondContact O-N 3.44Å; Q186-L188 VanDerWaalsContact C-N 3.27Å; Q186-L188 PolarHBondContact O-N 3.07Å
189	T	98.4	Very high	98.5	Very high	109 Å²	109	59.1 Å²	59.1	67%	0.669	32%	0.317	S	S	*	.	H	α-helix	trans	-100.9	-24.8	-170.4	58.7	0	0	0	0	113.9	T185 Q186	T185-T189 HydrophobicContact CG2-CG2 4.25Å; T185-T189 WeakPolarHBondContact O-CB 3.39Å; T185-T189 WeakPolarHBondContact O-CG2 3.4Å; T185-T189 PolarHBondContact O-N 2.99Å; T185-T189 PolarHBondContact O-OG1 2.87Å; Q186-T189 PolarHBondContact O-N 2.87Å
190	N	98.3	Very high	98.5	Very high	79 Å²	79	60.8 Å²	60.8	42%	0.422	32%	0.323	S	S	.	.			trans	-151	70.5	179.6	-170.2	-11.7	0	0	0	110.8	Q186 A192 E193 H194	Q186-N190 CarbonylContact O-C 3.06Å; Q186-N190 WeakPolarHBondContact O-CA 3.39Å; Q186-N190 PolarHBondContact O-N 2.78Å; Q186-N190 VanDerWaalsContact O-O 3.14Å; N190-A192 PolarHBondContact O-N 3.27Å; N190-E193 HydrophobicContact CB-CB 4.45Å; N190-E193 PolarHBondContact O-N 3.11Å; N190-E193 WeakPolarHBondContact OD1-CB 3.3Å; N190-E193 PolarHBondContact OD1-N 3.25Å; N190-H194 PolarHBondContact O-N 2.68Å
191	R	98.3	Very high	98.6	Very high	113 Å²	113	63.2 Å²	63.2	43%	0.426	33%	0.329	S	S	.	.	H	α-helix	trans	-56.3	-36.6	-179	-179.5	60.1	-173.8	-88.2	-0.6	113.3	Y187 H194 D195	Y187-R191 VanDerWaalsContact CE2-CZ 3.44Å; Y187-R191 VanDerWaalsContact CZ-NH1 3.32Å; Y187-R191 PolarHBondContact OH-NH1 3.49Å; R191-H194 PolarHBondContact O-N 3.4Å; R191-D195 WeakPolarHBondContact CD-OD1 3.18Å; R191-D195 IonicContact CZ-OD1 3.62Å; R191-D195 IonicContact CZ-OD2 3.45Å; R191-D195 IonicContact NE-OD1 2.77Å; R191-D195 PolarHBondContact NE-OD1 3.21Å; R191-D195 IonicContact NE-OD2 2.68Å; R191-D195 PolarHBondContact NE-OD2 3.38Å; R191-D195 IonicContact NH2-OD1 3.4Å; R191-D195 IonicContact NH2-OD2 3.62Å; R191-D195 WeakPolarHBondContact O-CB 3.19Å; R191-D195 VanDerWaalsContact O-CG 3.26Å; R191-D195 PolarHBondContact O-N 2.77Å
192	A	98.6	Very high	98.6	Very high	72 Å²	72	61.7 Å²	61.7	60%	0.595	31%	0.311	S	S	*	.	H	α-helix	trans	-62.7	-44.6	-179.8	0	0	0	0	0	112	N190 D195 R196	N190-A192 PolarHBondContact O-N 3.27Å; A192-D195 PolarHBondContact O-N 3.45Å; A192-R196 WeakPolarHBondContact O-CB 3.43Å; A192-R196 PolarHBondContact O-N 3.5Å
193	E	98.7	Very high	98.6	Very high	59 Å²	59	65.5 Å²	65.5	28%	0.276	32%	0.317	S	S	.	.	H	α-helix	trans	-71.7	-40.4	177.7	179.5	59.7	-172.2	0	0	112	N190 D195 R196 I197	N190-E193 HydrophobicContact CB-CB 4.45Å; N190-E193 PolarHBondContact O-N 3.11Å; N190-E193 WeakPolarHBondContact OD1-CB 3.3Å; N190-E193 PolarHBondContact OD1-N 3.25Å; E193-D195 VanDerWaalsContact C-N 3.29Å; E193-D195 PolarHBondContact O-N 3.45Å; E193-R196 WeakPolarHBondContact O-CB 3.49Å; E193-R196 PolarHBondContact O-N 2.82Å; E193-R196 IonicContact OE1-CZ 3.1Å; E193-R196 IonicContact OE1-NE 3.64Å; E193-R196 PolarHBondContact OE1-NE 3.43Å; E193-R196 IonicContact OE1-NH2 2.66Å; E193-R196 PolarHBondContact OE1-NH2 3.23Å; E193-R196 IonicContact OE2-CZ 2.7Å; E193-R196 IonicContact OE2-NE 2.73Å; E193-R196 PolarHBondContact OE2-NE 3.07Å; E193-R196 IonicContact OE2-NH2 2.7Å; E193-I197 HydrophobicContact CG-CD1 4Å; E193-I197 WeakPolarHBondContact O-CG1 3.42Å; E193-I197 PolarHBondContact O-N 3.18Å; E193-I197 WeakPolarHBondContact OE1-CD1 3.37Å
194	H	98.8	Very high	98.6	Very high	4 Å²	4	73.2 Å²	73.2	2%	0.019	35%	0.346	C	S	.	.	H	α-helix	trans	-51.2	-52.2	171.5	167.7	-82.2	0	0	0	110.7	Y134 Q186 Y187 N190 R191 R196 I197 A198	Y134-H194 AromaticContact CE1-CD2 3.77Å; Q186-H194 HydrophobicContact CG-CB 4.16Å; Y187-H194 AromaticContact CD2-CE1 3.63Å; Y187-H194 AromaticContact CD2-ND1 3.71Å; Y187-H194 AromaticContact CD2-NE2 3.86Å; N190-H194 PolarHBondContact O-N 2.68Å; R191-H194 PolarHBondContact O-N 3.4Å; H194-R196 VanDerWaalsContact C-N 3.32Å; H194-R196 PolarHBondContact O-N 3.01Å; H194-I197 PolarHBondContact O-N 3.25Å; H194-A198 WeakPolarHBondContact O-CB 3.47Å; H194-A198 PolarHBondContact O-N 2.84Å
195	D	98.8	Very high	98.6	Very high	22 Å²	22	76.3 Å²	76.3	12%	0.118	36%	0.357	C	S	.	.	H	α-helix	trans	-67.7	-34.6	-176.2	-72.6	3.8	0	0	0	112.1	V104 R191 A192 E193 R199	V104-D195 HydrophobicContact CG1-CB 3.65Å; V104-D195 VanDerWaalsContact CG1-CG 3.49Å; R191-D195 WeakPolarHBondContact CD-OD1 3.18Å; R191-D195 IonicContact CZ-OD1 3.62Å; R191-D195 IonicContact CZ-OD2 3.45Å; R191-D195 IonicContact NE-OD1 2.77Å; R191-D195 PolarHBondContact NE-OD1 3.21Å; R191-D195 IonicContact NE-OD2 2.68Å; R191-D195 PolarHBondContact NE-OD2 3.38Å; R191-D195 IonicContact NH2-OD1 3.4Å; R191-D195 IonicContact NH2-OD2 3.62Å; R191-D195 WeakPolarHBondContact O-CB 3.19Å; R191-D195 VanDerWaalsContact O-CG 3.26Å; R191-D195 PolarHBondContact O-N 2.77Å; A192-D195 PolarHBondContact O-N 3.45Å; E193-D195 VanDerWaalsContact C-N 3.29Å; E193-D195 PolarHBondContact O-N 3.45Å; D195-R199 WeakPolarHBondContact O-CB 3.47Å; D195-R199 WeakPolarHBondContact O-CG 3.39Å; D195-R199 PolarHBondContact O-N 2.96Å; D195-R199 PolarHBondContact O-NE 2.91Å
196	R	98.8	Very high	98.6	Very high	114 Å²	114	72.6 Å²	72.6	43%	0.43	34%	0.335	S	S	.	.	H	α-helix	trans	-61.3	-46.7	173	-167.7	-163.5	67.1	69	1.3	111	A192 E193 H194 Q200	A192-R196 WeakPolarHBondContact O-CB 3.43Å; A192-R196 PolarHBondContact O-N 3.5Å; E193-R196 WeakPolarHBondContact O-CB 3.49Å; E193-R196 PolarHBondContact O-N 2.82Å; E193-R196 IonicContact OE1-CZ 3.1Å; E193-R196 IonicContact OE1-NE 3.64Å; E193-R196 PolarHBondContact OE1-NE 3.43Å; E193-R196 IonicContact OE1-NH2 2.66Å; E193-R196 PolarHBondContact OE1-NH2 3.23Å; E193-R196 IonicContact OE2-CZ 2.7Å; E193-R196 IonicContact OE2-NE 2.73Å; E193-R196 PolarHBondContact OE2-NE 3.07Å; E193-R196 IonicContact OE2-NH2 2.7Å; H194-R196 VanDerWaalsContact C-N 3.32Å; H194-R196 PolarHBondContact O-N 3.01Å; R196-Q200 WeakPolarHBondContact O-CB 3.49Å; R196-Q200 PolarHBondContact O-N 2.94Å
197	I	98.8	Very high	98.4	Very high	25 Å²	25	77.2 Å²	77.2	13%	0.128	37%	0.366	C	S	.	.	H	α-helix	trans	-67.3	-44.2	178.9	-65.7	169.6	0	0	0	110.6	Y134 E193 H194 R199 Q200 W201	Y134-I197 HydrophobicContact CD1-CB 4.4Å; Y134-I197 HydrophobicContact CD1-CG2 3.92Å; Y134-I197 HydrophobicContact CD2-CG2 3.76Å; Y134-I197 HydrophobicContact CE1-CB 4.2Å; Y134-I197 HydrophobicContact CE1-CG2 3.87Å; Y134-I197 HydrophobicContact CE2-CG2 3.72Å; Y134-I197 HydrophobicContact CG-CG2 3.86Å; E193-I197 HydrophobicContact CG-CD1 4Å; E193-I197 WeakPolarHBondContact O-CG1 3.42Å; E193-I197 PolarHBondContact O-N 3.18Å; E193-I197 WeakPolarHBondContact OE1-CD1 3.37Å; H194-I197 PolarHBondContact O-N 3.25Å; I197-R199 PolarHBondContact O-N 3.34Å; I197-Q200 CarbonylContact O-C 3.59Å; I197-Q200 WeakPolarHBondContact O-CB 3.41Å; I197-Q200 PolarHBondContact O-N 2.84Å; I197-Q200 VanDerWaalsContact O-N 3.12Å; I197-W201 VanDerWaalsContact O-CD1 3.31Å; I197-W201 PolarHBondContact O-N 3.35Å
198	A	98.8	Very high	98.4	Very high	0 Å²	0	79.1 Å²	79.1	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-58.8	-48.5	178.8	0	0	0	0	0	111.5	V104 Y105 Y134 H194 Q200 W201 T202	V104-A198 HydrophobicContact CB-CB 3.79Å; V104-A198 HydrophobicContact CG1-CB 4.43Å; V104-A198 HydrophobicContact CG2-CB 3.54Å; Y105-A198 HydrophobicContact CE1-CB 4.33Å; Y134-A198 HydrophobicContact CD1-CB 4.18Å; H194-A198 WeakPolarHBondContact O-CB 3.47Å; H194-A198 PolarHBondContact O-N 2.84Å; A198-Q200 VanDerWaalsContact C-N 3.32Å; A198-Q200 PolarHBondContact O-N 3.03Å; A198-W201 PolarHBondContact O-N 3.31Å; A198-W201 VanDerWaalsContact O-N 3.15Å; A198-T202 PolarHBondContact O-N 3.43Å; A198-T202 PolarHBondContact O-OG1 3.45Å
199	R	98.9	Very high	98.4	Very high	127 Å²	127	77 Å²	77	48%	0.479	36%	0.364	S	S	.	.	H	α-helix	trans	-59.7	-39.9	173.2	-74.8	-176.1	-73.3	-95.6	-2.8	112.8	V104 D195 I197 W201 T202 K203	V104-R199 HydrophobicContact CB-CG 4.05Å; V104-R199 HydrophobicContact CG1-CG 4.44Å; V104-R199 WeakPolarHBondContact O-CG 3.48Å; D195-R199 WeakPolarHBondContact O-CB 3.47Å; D195-R199 WeakPolarHBondContact O-CG 3.39Å; D195-R199 PolarHBondContact O-N 2.96Å; D195-R199 PolarHBondContact O-NE 2.91Å; I197-R199 PolarHBondContact O-N 3.34Å; R199-W201 VanDerWaalsContact C-N 3.33Å; R199-W201 PolarHBondContact O-N 3.22Å; R199-T202 PolarHBondContact O-N 3.25Å; R199-K203 PolarHBondContact O-N 3.05Å
200	Q	98.8	Very high	98.4	Very high	98 Å²	98	75.2 Å²	75.2	46%	0.458	35%	0.347	S	S	.	.	H	α-helix	trans	-63.5	-39.8	176.2	-176.8	177.7	5.9	0	0	111.8	R196 I197 A198 R204	R196-Q200 WeakPolarHBondContact O-CB 3.49Å; R196-Q200 PolarHBondContact O-N 2.94Å; I197-Q200 CarbonylContact O-C 3.59Å; I197-Q200 WeakPolarHBondContact O-CB 3.41Å; I197-Q200 PolarHBondContact O-N 2.84Å; I197-Q200 VanDerWaalsContact O-N 3.12Å; A198-Q200 VanDerWaalsContact C-N 3.32Å; A198-Q200 PolarHBondContact O-N 3.03Å; Q200-R204 VanDerWaalsContact O-CB 3.29Å; Q200-R204 WeakPolarHBondContact O-CB 3.46Å; Q200-R204 PolarHBondContact O-N 3.17Å
201	W	98.8	Very high	98.4	Very high	82 Å²	82	75 Å²	75	31%	0.311	34%	0.342	S	S	.	.	H	α-helix	trans	-68.4	-43.2	175.9	-87.3	57.3	0	0	0	112	R132 Y134 I197 A198 R199 K203 R204 Y205	R132-W201 HydrophobicContact CB-CE3 4.48Å; R132-W201 HydrophobicContact CB-CZ3 4.23Å; Y134-W201 HydrophobicContact CD2-CD2 4.13Å; Y134-W201 AromaticContact CD2-CE2 3.87Å; Y134-W201 HydrophobicContact CD2-CG 4.48Å; Y134-W201 HydrophobicContact CD2-CZ2 4.12Å; Y134-W201 HydrophobicContact CG-CD2 4.42Å; Y134-W201 HydrophobicContact CG-CG 4.47Å; I197-W201 VanDerWaalsContact O-CD1 3.31Å; I197-W201 PolarHBondContact O-N 3.35Å; A198-W201 PolarHBondContact O-N 3.31Å; A198-W201 VanDerWaalsContact O-N 3.15Å; R199-W201 VanDerWaalsContact C-N 3.33Å; R199-W201 PolarHBondContact O-N 3.22Å; W201-K203 VanDerWaalsContact C-N 3.34Å; W201-K203 PolarHBondContact O-N 3.24Å; W201-R204 PolarHBondContact O-N 2.8Å; W201-R204 VanDerWaalsContact O-N 3.08Å; W201-Y205 HydrophobicContact CB-CD2 4.17Å; W201-Y205 HydrophobicContact CB-CE2 4.5Å; W201-Y205 AromaticContact CD2-CD2 3.92Å; W201-Y205 HydrophobicContact CD2-CD2 3.92Å; W201-Y205 AromaticContact CD2-CE2 3.62Å; W201-Y205 HydrophobicContact CD2-CE2 3.62Å; W201-Y205 AromaticContact CE3-CD2 3.78Å; W201-Y205 HydrophobicContact CE3-CD2 3.78Å; W201-Y205 AromaticContact CE3-CE2 3.73Å; W201-Y205 HydrophobicContact CE3-CE2 3.73Å; W201-Y205 HydrophobicContact CG-CD2 4.12Å; W201-Y205 AromaticContact CG-CE2 3.98Å; W201-Y205 HydrophobicContact CG-CE2 3.98Å; W201-Y205 HydrophobicContact CZ3-CE2 4.25Å; W201-Y205 WeakPolarHBondContact O-CD2 3.38Å; W201-Y205 PolarHBondContact O-N 3.39Å
202	T	98.8	Very high	98.4	Very high	7 Å²	7	72.6 Å²	72.6	4%	0.043	34%	0.337	C	S	.	.	H	α-helix	trans	-52.4	-53.4	173.1	-57.5	0	0	0	0	110.2	V104 Y105 F110 A198 R199 R204 A206	V104-T202 PolarHBondContact O-OG1 3.13Å; V104-T202 VanDerWaalsContact O-OG1 3.07Å; Y105-T202 WeakPolarHBondContact O-CG2 3.49Å; F110-T202 HydrophobicContact CZ-CG2 4.19Å; A198-T202 PolarHBondContact O-N 3.43Å; A198-T202 PolarHBondContact O-OG1 3.45Å; R199-T202 PolarHBondContact O-N 3.25Å; T202-R204 VanDerWaalsContact C-N 3.27Å; T202-R204 PolarHBondContact O-N 2.66Å; T202-A206 CarbonylContact O-C 3.56Å; T202-A206 WeakPolarHBondContact O-CA 3.4Å; T202-A206 WeakPolarHBondContact O-CB 3.49Å; T202-A206 PolarHBondContact O-N 2.91Å
203	K	98.7	Very high	98.4	Very high	165 Å²	165	72.7 Å²	72.7	72%	0.717	32%	0.32	S	S	*	.	H	α-helix	trans	-63.9	-27.1	178.2	-176	172.2	-178.7	175.8	0	114.2	R199 W201 T207	R199-K203 PolarHBondContact O-N 3.05Å; W201-K203 VanDerWaalsContact C-N 3.34Å; W201-K203 PolarHBondContact O-N 3.24Å; K203-T207 PolarHBondContact O-OG1 2.87Å
204	R	98.6	Very high	98.3	Very high	174 Å²	174	73.6 Å²	73.6	66%	0.657	32%	0.323	S	S	*	.	H	α-helix	trans	-87.5	-34.7	-175.8	-175.8	172.6	-179.8	175.8	1.4	113	Q200 W201 T202	Q200-R204 VanDerWaalsContact O-CB 3.29Å; Q200-R204 WeakPolarHBondContact O-CB 3.46Å; Q200-R204 PolarHBondContact O-N 3.17Å; W201-R204 PolarHBondContact O-N 2.8Å; W201-R204 VanDerWaalsContact O-N 3.08Å; T202-R204 VanDerWaalsContact C-N 3.27Å; T202-R204 PolarHBondContact O-N 2.66Å
205	Y	98.6	Very high	98.3	Very high	69 Å²	69	79 Å²	79	27%	0.271	35%	0.347	S	S	.	.	H	α-helix	trans	-120.2	-15.8	-167.3	-58.9	-60.9	0	0	0	113.9	T131 R132 W201	T131-Y205 VanDerWaalsContact CG2-O 3.28Å; T131-Y205 WeakPolarHBondContact CG2-O 3.37Å; R132-Y205 HydrophobicContact CB-CD2 4.19Å; R132-Y205 HydrophobicContact CB-CG 4.06Å; W201-Y205 HydrophobicContact CB-CD2 4.17Å; W201-Y205 HydrophobicContact CB-CE2 4.5Å; W201-Y205 AromaticContact CD2-CD2 3.92Å; W201-Y205 HydrophobicContact CD2-CD2 3.92Å; W201-Y205 AromaticContact CD2-CE2 3.62Å; W201-Y205 HydrophobicContact CD2-CE2 3.62Å; W201-Y205 AromaticContact CE3-CD2 3.78Å; W201-Y205 HydrophobicContact CE3-CD2 3.78Å; W201-Y205 AromaticContact CE3-CE2 3.73Å; W201-Y205 HydrophobicContact CE3-CE2 3.73Å; W201-Y205 HydrophobicContact CG-CD2 4.12Å; W201-Y205 AromaticContact CG-CE2 3.98Å; W201-Y205 HydrophobicContact CG-CE2 3.98Å; W201-Y205 HydrophobicContact CZ3-CE2 4.25Å; W201-Y205 WeakPolarHBondContact O-CD2 3.38Å; W201-Y205 PolarHBondContact O-N 3.39Å
206	A	98.1	Very high	98.3	Very high	5 Å²	5	83.8 Å²	83.8	4%	0.041	37%	0.366	C	S	.	.			trans	-124.2	10.3	-172.7	0	0	0	0	0	113.3	G108 V109 F110 T131 T202	G108-A206 CarbonylContact C-O 3.57Å; G108-A206 WeakPolarHBondContact CA-O 3.4Å; V109-A206 PolarHBondContact N-O 3.1Å; F110-A206 HydrophobicContact CD1-CB 4.01Å; F110-A206 HydrophobicContact CE1-CB 3.6Å; F110-A206 HydrophobicContact CE2-CB 4.28Å; F110-A206 HydrophobicContact CZ-CB 3.75Å; T131-A206 HydrophobicContact CG2-CB 3.83Å; T202-A206 CarbonylContact O-C 3.56Å; T202-A206 WeakPolarHBondContact O-CA 3.4Å; T202-A206 WeakPolarHBondContact O-CB 3.49Å; T202-A206 PolarHBondContact O-N 2.91Å
207	T	93.4	Very high	98.2	Very high	139 Å²	139	81 Å²	81	85%	0.853	36%	0.36	S	S	*	.			trans	-127.4	0	174.7	60.8	0	0	0	0	111.3	K203	K203-T207 PolarHBondContact O-OG1 2.87Å

Retrieved 207 of 207 residues in 150.3 ms (Link to these results)

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