A0A060W7G3_ONCMY Loading...

GTP cyclohydrolase 1

AlphaFold DB , UniProt , Accession A0A060W7G3, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110497538, Length 257 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.7	Very low	34.3	Very low	247 Å²	247	180.3 Å²	180.3	100%	1.217	88%	0.884	S	S	*	*				0	100.4	0	-90.3	175.7	167.5	0	0	107.4
2	E	32.9	Very low	34.2	Very low	191 Å²	191	173.7 Å²	173.7	89%	0.893	88%	0.88	S	S	*	*			trans	-67.7	146.6	-172.5	-68.7	154.2	130.2	0	0	112.2
3	R	34.3	Very low	34	Very low	248 Å²	248	172.1 Å²	172.1	94%	0.936	88%	0.875	S	S	*	*			trans	-119.5	94.6	156.5	-83.2	-172.9	172.8	-158.2	-1.8	108
4	S	33.6	Very low	34	Very low	101 Å²	101	168.1 Å²	168.1	71%	0.706	87%	0.871	S	S	*	*			trans	-66.2	129.4	165	-177.3	0	0	0	0	109.2
5	K	45.3	Very low	33.9	Very low	210 Å²	210	169.7 Å²	169.7	91%	0.913	87%	0.869	S	S	*	*			trans	-109.5	108.3	162.2	-86.3	-174.8	176.6	-178.8	0	107.3
6	Q	36	Very low	34	Very low	172 Å²	172	166.4 Å²	166.4	80%	0.804	86%	0.861	S	S	*	*			trans	-78.3	134.5	-177.1	-153.8	146.9	-10.8	0	0	109.7
7	C	32	Very low	33.7	Very low	120 Å²	120	165 Å²	165	81%	0.811	86%	0.862	S	S	*	*			trans	-73	130.9	164.9	-124.9	0	0	0	0	107.6	D9	C7-D9 PolarHBondContact O-N 2.98Å
8	H	34.2	Very low	33.6	Very low	184 Å²	184	163.1 Å²	163.1	85%	0.852	86%	0.859	S	S	*	*			trans	-76.8	113.6	-179.7	-90.3	-67.3	0	0	0	110.7
9	D	31.5	Very low	33.3	Very low	148 Å²	148	163.2 Å²	163.2	79%	0.791	86%	0.86	S	S	*	*			trans	-86.7	127.9	158.3	-67.3	-39.9	0	0	0	108.4	C7	C7-D9 PolarHBondContact O-N 2.98Å
10	N	29.9	Very low	33	Very low	166 Å²	166	163.6 Å²	163.6	89%	0.888	86%	0.857	S	S	*	*			trans	-114.9	98.4	164.9	-97.3	-9.6	0	0	0	107.6
11	E	30.4	Very low	32.7	Very low	196 Å²	196	161.6 Å²	161.6	92%	0.916	86%	0.857	S	S	*	*			trans	-111.1	113.5	170.4	-144.4	172	-161.4	0	0	106.8
12	A	32.9	Very low	32.2	Very low	101 Å²	101	159.7 Å²	159.7	84%	0.835	84%	0.837	S	S	*	*			trans	-114.3	110.5	172.8	0	0	0	0	0	108.6
13	D	31.8	Very low	32	Very low	153 Å²	153	158.2 Å²	158.2	82%	0.818	83%	0.834	S	S	*	*			trans	-71.2	125.7	-179.3	-145.1	-6.8	0	0	0	110.5
14	S	33.3	Very low	31.7	Very low	116 Å²	116	154 Å²	154	81%	0.811	83%	0.83	S	S	*	*			trans	-147.1	116.2	159.5	57.5	0	0	0	0	110.3
15	K	32.7	Very low	31.3	Very low	193 Å²	193	152.6 Å²	152.6	84%	0.839	83%	0.831	S	S	*	*			trans	-90.9	166.2	177.8	-98.1	-171.2	-177.6	175.1	0	111.7
16	P	34.8	Very low	30.4	Very low	116 Å²	116	151.2 Å²	151.2	75%	0.753	83%	0.828	S	S	*	*			trans	-98.6	157.9	-134.7	38	-36.8	0	0	0	114.2
17	T	30.3	Very low	29.9	Very low	143 Å²	143	149.7 Å²	149.7	88%	0.877	82%	0.824	S	S	*	*			trans	-114.7	131.3	160.8	45.6	0	0	0	0	110.3
18	T	30.8	Very low	29.7	Very low	130 Å²	130	150 Å²	150	80%	0.798	82%	0.822	S	S	*	*			trans	-70	136.1	177.6	46.7	0	0	0	0	111.8
19	N	27.6	Very low	29.4	Very low	165 Å²	165	149.6 Å²	149.6	88%	0.882	82%	0.818	S	S	*	*				-166.1	131.6	127.7	-113.1	-2.8	0	0	0	111.8
20	E	28.3	Very low	29.2	Very low	172 Å²	172	151.7 Å²	151.7	80%	0.804	82%	0.82	S	S	*	*			trans	-67.9	143.7	171.7	-63.8	174.9	139.8	0	0	111.2
21	S	26.5	Very low	29.1	Very low	121 Å²	121	150.7 Å²	150.7	85%	0.846	82%	0.815	S	S	*	*			trans	-162.1	121.9	134.3	44.5	0	0	0	0	110
22	Y	26.7	Very low	29.1	Very low	207 Å²	207	149.4 Å²	149.4	81%	0.812	81%	0.814	S	S	*	*			trans	-67	150.5	167.1	-76.8	-102.1	0	0	0	110.4
23	I	28.6	Very low	28.8	Very low	160 Å²	160	152.7 Å²	152.7	82%	0.821	81%	0.812	S	S	*	*				169.5	135.7	119	-83.6	159	0	0	0	111.5
24	N	27.6	Very low	28.6	Very low	161 Å²	161	152.3 Å²	152.3	86%	0.861	81%	0.808	S	S	*	*			trans	-26.5	152.4	165.3	-65.9	-41.6	0	0	0	118.8
25	G	26.6	Very low	28.4	Very low	70 Å²	70	154.3 Å²	154.3	72%	0.722	81%	0.809	S	S	*	*			trans	159.4	93.1	146.3	0	0	0	0	0	118.3
26	H	26.8	Very low	28.1	Very low	181 Å²	181	151.3 Å²	151.3	84%	0.838	81%	0.807	S	S	*	*			trans	53.1	127.6	133.2	-95.5	50.4	0	0	0	123.5
27	L	25.3	Very low	27.8	Very low	140 Å²	140	149.4 Å²	149.4	73%	0.733	81%	0.808	S	S	*	*			trans	-17.5	132.6	148.2	-80.2	107.9	0	0	0	116.9
28	V	27.3	Very low	27.6	Very low	126 Å²	126	150.8 Å²	150.8	76%	0.764	81%	0.809	S	S	*	*			trans	-133.6	104.6	143.9	179.2	0	0	0	0	108.7	K30	V28-K30 HydrophobicContact CG1-CG 4.17Å
29	K	26.9	Very low	27.6	Very low	176 Å²	176	149.4 Å²	149.4	77%	0.765	81%	0.811	S	S	*	*			trans	-68.7	135.5	154.5	-80.9	-179.7	173.3	-178.9	0	107.5
30	K	27.6	Very low	27.7	Very low	193 Å²	193	151.2 Å²	151.2	84%	0.839	81%	0.814	S	S	*	*			trans	-120.1	109.8	159.5	-91.4	-175.4	176	-179.3	0	108.7	V28	V28-K30 HydrophobicContact CG1-CG 4.17Å
31	D	28.7	Very low	27.7	Very low	145 Å²	145	146.7 Å²	146.7	78%	0.775	81%	0.814	S	S	*	*			trans	-62.4	140.5	164.3	-62.9	-52.7	0	0	0	109.9
32	N	29.6	Very low	27.8	Very low	168 Å²	168	147.8 Å²	147.8	90%	0.898	82%	0.816	S	S	*	*			trans	-140.5	86.2	161.3	-136.6	34.3	0	0	0	108.3
33	Q	27.3	Very low	27.8	Very low	170 Å²	170	141.3 Å²	141.3	79%	0.794	81%	0.811	S	S	*	*			trans	-82.5	140.9	150.5	-74.2	-177.7	-10	0	0	106.8
34	I	26.7	Very low	27.9	Very low	145 Å²	145	140.8 Å²	140.8	74%	0.744	82%	0.816	S	S	*	*				162	133.7	105.1	-78.7	173	0	0	0	102.1
35	L	29.4	Very low	28.1	Very low	158 Å²	158	138.3 Å²	138.3	83%	0.827	82%	0.818	S	S	*	*				-177	136.6	66.8	-130.3	148.4	0	0	0	108
36	V	26.6	Very low	28.2	Very low	131 Å²	131	138.5 Å²	138.5	79%	0.794	82%	0.82	S	S	*	*			trans	-81.6	119.5	169.7	176.9	0	0	0	0	108.3
37	G	28.1	Very low	28.4	Very low	75 Å²	75	138.7 Å²	138.7	77%	0.773	82%	0.821	S	S	*	*			trans	-105.6	109.6	172.8	0	0	0	0	0	111.1
38	L	27.6	Very low	28.7	Very low	173 Å²	173	138.3 Å²	138.3	91%	0.906	83%	0.827	S	S	*	*			trans	-76.8	125.8	167.3	-80.3	155.5	0	0	0	109.4
39	A	30.6	Very low	28.9	Very low	101 Å²	101	136.6 Å²	136.6	84%	0.835	82%	0.82	S	S	*	*			trans	-137.7	116.7	163.1	0	0	0	0	0	109.6
40	Q	28.5	Very low	29	Very low	203 Å²	203	133.1 Å²	133.1	95%	0.949	82%	0.818	S	S	*	*			trans	-78	137.3	168.9	-68.1	175.7	-20	0	0	109.2
41	G	29.1	Very low	29.3	Very low	77 Å²	77	132.4 Å²	132.4	79%	0.794	82%	0.818	S	S	*	*			trans	-155.6	125.1	174.3	0	0	0	0	0	110.2
42	T	28.6	Very low	29.7	Very low	144 Å²	144	131.4 Å²	131.4	88%	0.883	82%	0.817	S	S	*	*			trans	-83.4	134.7	-167.8	45.6	0	0	0	0	113.8
43	G	26.5	Very low	29.9	Very low	70 Å²	70	126.6 Å²	126.6	72%	0.722	81%	0.807	S	S	*	*			trans	60.2	117.2	141.2	0	0	0	0	0	120.6
44	T	29.8	Very low	30.3	Very low	149 Å²	149	123.9 Å²	123.9	91%	0.914	81%	0.807	S	S	*	*				-165.3	142.4	109.9	42.7	0	0	0	0	109.9	G46	T44-G46 PolarHBondContact O-N 3.48Å
45	A	33.5	Very low	30.8	Very low	110 Å²	110	119.4 Å²	119.4	91%	0.909	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-72.4	116.9	-179.8	0	0	0	0	0	110.6
46	G	28.6	Very low	31.6	Very low	74 Å²	74	116.1 Å²	116.1	76%	0.763	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-101.1	135.8	168.5	0	0	0	0	0	110.4	T44	T44-G46 PolarHBondContact O-N 3.48Å
47	E	29.9	Very low	32.4	Very low	185 Å²	185	114.1 Å²	114.1	86%	0.864	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-52.2	151.4	179.3	-63.5	171.8	150.7	0	0	113.2	S49	E47-S49 PolarHBondContact O-N 2.72Å
48	P	31.3	Very low	32.8	Very low	132 Å²	132	117.6 Å²	117.6	86%	0.857	76%	0.759	S	S	*	*			trans	-73	101	178.6	30.6	-32.1	0	0	0	109.5	S50	P48-S50 PolarHBondContact O-N 2.91Å; P48-S50 VanDerWaalsContact O-N 3.15Å
49	S	31.3	Very low	33.1	Very low	89 Å²	89	111.4 Å²	111.4	62%	0.622	74%	0.737	S	S	*	*			trans	-56.5	116.2	165.8	57.4	0	0	0	0	109.2	E47 H51	E47-S49 PolarHBondContact O-N 2.72Å; S49-H51 PolarHBondContact O-N 3.34Å
50	S	30.8	Very low	33.6	Very low	103 Å²	103	111.4 Å²	111.4	72%	0.72	72%	0.715	S	S	*	*			trans	-57.2	102.7	170.2	44.2	0	0	0	0	109	P48 T52	P48-S50 PolarHBondContact O-N 2.91Å; P48-S50 VanDerWaalsContact O-N 3.15Å; S50-T52 PolarHBondContact O-N 3.03Å
51	H	33.3	Very low	34.3	Very low	178 Å²	178	109.6 Å²	109.6	82%	0.824	70%	0.704	S	S	*	*			trans	-67.3	88.5	162.7	-76	-64.7	0	0	0	107.5	S49 G53	S49-H51 PolarHBondContact O-N 3.34Å; H51-G53 VanDerWaalsContact C-N 3.34Å; H51-G53 PolarHBondContact O-N 3.02Å
52	T	37.1	Very low	35.1	Very low	125 Å²	125	114.1 Å²	114.1	77%	0.767	70%	0.704	S	S	*	*			trans	-61.1	104.1	157.6	43.5	0	0	0	0	106.2	S50 S54	S50-T52 PolarHBondContact O-N 3.03Å; T52-S54 PolarHBondContact O-N 2.85Å
53	G	34.3	Very low	36.4	Very low	67 Å²	67	114.3 Å²	114.3	69%	0.691	70%	0.695	S	S	*	*			trans	-53	114.8	167.6	0	0	0	0	0	107.4	H51 S55	H51-G53 VanDerWaalsContact C-N 3.34Å; H51-G53 PolarHBondContact O-N 3.02Å; G53-S55 PolarHBondContact O-N 3.25Å
54	S	35.6	Very low	38.6	Very low	112 Å²	112	119.9 Å²	119.9	78%	0.783	69%	0.694	S	S	*	*			trans	-50.5	107.6	169.2	175.1	0	0	0	0	106.8	T52 V56	T52-S54 PolarHBondContact O-N 2.85Å; S54-V56 PolarHBondContact O-N 2.93Å
55	S	36.5	Very low	41.2	Very low	52 Å²	52	115 Å²	115	36%	0.364	67%	0.665	S	S	.	*			trans	-70.4	122.7	-174.1	86.3	0	0	0	0	107	G53 V57 E58	G53-S55 PolarHBondContact O-N 3.25Å; S55-V57 PolarHBondContact O-N 3.39Å; S55-V57 WeakPolarHBondContact OG-CB 3.33Å; S55-E58 PolarHBondContact O-N 2.86Å
56	V	45.8	Very low	44	Very low	89 Å²	89	112 Å²	112	54%	0.539	63%	0.63	S	S	.	*	H	α-helix	trans	-51.3	-22.4	171.7	-179.4	0	0	0	0	110.9	S54 E58 G59 W60	S54-V56 PolarHBondContact O-N 2.93Å; V56-E58 VanDerWaalsContact C-N 3.3Å; V56-E58 PolarHBondContact O-N 3.4Å; V56-G59 PolarHBondContact O-N 2.96Å; V56-G59 VanDerWaalsContact O-N 3.13Å; V56-W60 VanDerWaalsContact O-CD1 3.25Å
57	V	44.2	Very low	47	Very low	89 Å²	89	110.2 Å²	110.2	54%	0.539	61%	0.605	S	S	.	*	H	α-helix	trans	-55.5	-33	174.9	-165.7	0	0	0	0	113.8	S55	S55-V57 PolarHBondContact O-N 3.39Å; S55-V57 WeakPolarHBondContact OG-CB 3.33Å
58	E	36.5	Very low	50	Low	147 Å²	147	107 Å²	107	69%	0.687	59%	0.592	S	S	*	*	H	α-helix	trans	-79.7	-25.8	178.4	-78.6	179.1	155.8	0	0	112.8	S55 V56 W60	S55-E58 PolarHBondContact O-N 2.86Å; V56-E58 VanDerWaalsContact C-N 3.3Å; V56-E58 PolarHBondContact O-N 3.4Å; E58-W60 PolarHBondContact O-N 3.28Å
59	G	33.7	Very low	53	Low	43 Å²	43	107.3 Å²	107.3	44%	0.443	58%	0.582	S	S	.	*	H	α-helix	trans	-68.7	-33.6	-180	0	0	0	0	0	113.6	V56 K61 H62 E63	V56-G59 PolarHBondContact O-N 2.96Å; V56-G59 VanDerWaalsContact O-N 3.13Å; G59-K61 VanDerWaalsContact C-N 3.31Å; G59-K61 PolarHBondContact O-N 3.3Å; G59-H62 PolarHBondContact O-N 3.06Å; G59-E63 PolarHBondContact O-N 3.24Å
60	W	40.7	Very low	56.1	Low	102 Å²	102	104.4 Å²	104.4	39%	0.386	56%	0.559	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.2	-20.2	-173	-69.4	32.1	0	0	0	113.4	V56 E58 H62 I120 Y182 E202	V56-W60 VanDerWaalsContact O-CD1 3.25Å; E58-W60 PolarHBondContact O-N 3.28Å; W60-H62 VanDerWaalsContact C-N 3.33Å; W60-I120 HydrophobicContact CE3-CD1 4.46Å; W60-I120 HydrophobicContact CH2-CD1 3.34Å; W60-I120 HydrophobicContact CZ3-CB 3.98Å; W60-I120 HydrophobicContact CZ3-CD1 3.28Å; W60-I120 HydrophobicContact CZ3-CG1 4.12Å; W60-I120 HydrophobicContact CZ3-CG2 4.49Å; W60-Y182 WeakPolarHBondContact CH2-OH 3.41Å; W60-E202 WeakPolarHBondContact CH2-OE2 3.41Å; W60-E202 VanDerWaalsContact CZ2-OE2 3.25Å; W60-E202 WeakPolarHBondContact CZ2-OE2 3.37Å
61	K	43.5	Very low	59.2	Low	164 Å²	164	100.2 Å²	100.2	71%	0.713	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-19.8	-179.9	-72.3	-175.9	178.1	177.8	0	112.6	G59	G59-K61 VanDerWaalsContact C-N 3.31Å; G59-K61 PolarHBondContact O-N 3.3Å
62	H	46.5	Very low	62.1	Low	173 Å²	173	98.2 Å²	98.2	80%	0.801	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.8	-3.1	-168.6	-72.4	11.3	0	0	0	114.9	G59 W60 R64	G59-H62 PolarHBondContact O-N 3.06Å; W60-H62 VanDerWaalsContact C-N 3.33Å; H62-R64 PolarHBondContact O-N 3.27Å
63	E	54.8	Low	65	Low	148 Å²	148	98.1 Å²	98.1	69%	0.692	51%	0.513	S	S	*	.			trans	-77.2	119	173.5	-162	166.4	-163.2	0	0	110.5	G59 T65	G59-E63 PolarHBondContact O-N 3.24Å; E63-T65 PolarHBondContact O-N 3.37Å
64	R	73.4	Confident	68	Low	186 Å²	186	98.7 Å²	98.7	70%	0.702	50%	0.5	S	S	*	.			trans	-64.5	108.5	173.4	-179.6	-174.1	177	-139.6	-4.7	108.3	H62 D70	H62-R64 PolarHBondContact O-N 3.27Å; R64-D70 IonicContact CZ-OD1 3.63Å; R64-D70 IonicContact CZ-OD2 2.85Å; R64-D70 IonicContact NH1-OD1 3.71Å; R64-D70 IonicContact NH2-OD1 2.69Å; R64-D70 PolarHBondContact NH2-OD1 2.86Å; R64-D70 IonicContact NH2-OD2 3.05Å; R64-D70 PolarHBondContact NH2-OD2 3.21Å
65	T	84.4	Confident	71	Confident	47 Å²	47	95.1 Å²	95.1	29%	0.288	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-69	150.6	169.5	50.1	0	0	0	0	109.8	E63 S67 Y116 K119	E63-T65 PolarHBondContact O-N 3.37Å; T65-S67 PolarHBondContact O-N 3.16Å; T65-Y116 WeakPolarHBondContact CB-O 3.43Å; T65-K119 HydrophobicContact CG2-CD 4.4Å; T65-K119 HydrophobicContact CG2-CG 3.83Å
66	R	91.5	Very high	73.9	Confident	48 Å²	48	95.9 Å²	95.9	18%	0.181	48%	0.476	C	S	.	.	P	Polyproline II helix	trans	-53.5	133.3	171.9	178.2	178.7	173.3	-151.9	-13.8	109.3	D70 N71 Q110 T113 Y116 Q117	R66-D70 HydrophobicContact CG-CB 4.31Å; R66-N71 PolarHBondContact NE-OD1 2.84Å; R66-N71 VanDerWaalsContact NH2-CG 3.31Å; R66-N71 PolarHBondContact NH2-OD1 3.24Å; R66-Q110 PolarHBondContact NH1-O 3.17Å; R66-T113 PolarHBondContact NH1-O 3.05Å; R66-T113 PolarHBondContact NH1-OG1 2.83Å; R66-Y116 PolarHBondContact N-O 3.15Å; R66-Q117 HydrophobicContact CB-CB 4.3Å; R66-Q117 WeakPolarHBondContact O-CA 3.44Å; R66-Q117 WeakPolarHBondContact O-CB 3.26Å
67	S	92.9	Very high	76.4	Confident	35 Å²	35	95.9 Å²	95.9	25%	0.245	48%	0.479	C	S	.	.	P	Polyproline II helix	trans	-101.9	170.1	178.9	78.3	0	0	0	0	112.8	T65 E69 D70 N71	T65-S67 PolarHBondContact O-N 3.16Å; S67-E69 VanDerWaalsContact C-N 3.29Å; S67-E69 PolarHBondContact OG-N 3.18Å; S67-D70 PolarHBondContact N-OD2 2.63Å; S67-D70 WeakPolarHBondContact O-CB 3.41Å; S67-D70 PolarHBondContact O-N 3.25Å; S67-D70 PolarHBondContact OG-N 3.16Å; S67-D70 PolarHBondContact OG-OD2 3.02Å; S67-N71 VanDerWaalsContact O-CG 3.26Å; S67-N71 PolarHBondContact O-N 3.13Å; S67-N71 VanDerWaalsContact O-N 3.16Å; S67-N71 PolarHBondContact O-OD1 3.1Å
68	M	91.7	Very high	79	Confident	119 Å²	119	94.3 Å²	94.3	59%	0.586	47%	0.467	S	S	*	.	H	α-helix	trans	-64.1	-36	170.1	-72.1	-60.9	-64.9	0	0	111.9	D70 N71 E72	M68-D70 VanDerWaalsContact C-N 3.34Å; M68-D70 PolarHBondContact O-N 3.44Å; M68-N71 WeakPolarHBondContact O-CA 3.48Å; M68-N71 VanDerWaalsContact O-CB 3.26Å; M68-N71 WeakPolarHBondContact O-CB 3.48Å; M68-N71 PolarHBondContact O-N 3.43Å; M68-E72 PolarHBondContact O-N 2.67Å; M68-E72 VanDerWaalsContact O-N 3.08Å
69	E	95.3	Very high	82	Confident	138 Å²	138	87.5 Å²	87.5	65%	0.645	44%	0.436	S	S	*	.	H	α-helix	trans	-64	-40.4	174.7	-64.5	158.3	169.6	0	0	111	S67 N71 E72 I73	S67-E69 VanDerWaalsContact C-N 3.29Å; S67-E69 PolarHBondContact OG-N 3.18Å; E69-N71 PolarHBondContact O-N 3.12Å; E69-E72 PolarHBondContact O-N 2.98Å; E69-I73 WeakPolarHBondContact O-CB 3.44Å; E69-I73 VanDerWaalsContact O-CG1 3.26Å; E69-I73 WeakPolarHBondContact O-CG1 3.3Å; E69-I73 PolarHBondContact O-N 3.45Å
70	D	95.1	Very high	85.1	Confident	28 Å²	28	88.1 Å²	88.1	15%	0.15	44%	0.437	C	S	.	.	H	α-helix	trans	-60.2	-35.5	172.4	-65.7	-38.9	0	0	0	111.1	R64 R66 S67 M68 N74	R64-D70 IonicContact CZ-OD1 3.63Å; R64-D70 IonicContact CZ-OD2 2.85Å; R64-D70 IonicContact NH1-OD1 3.71Å; R64-D70 IonicContact NH2-OD1 2.69Å; R64-D70 PolarHBondContact NH2-OD1 2.86Å; R64-D70 IonicContact NH2-OD2 3.05Å; R64-D70 PolarHBondContact NH2-OD2 3.21Å; R66-D70 HydrophobicContact CG-CB 4.31Å; S67-D70 PolarHBondContact N-OD2 2.63Å; S67-D70 WeakPolarHBondContact O-CB 3.41Å; S67-D70 PolarHBondContact O-N 3.25Å; S67-D70 PolarHBondContact OG-N 3.16Å; S67-D70 PolarHBondContact OG-OD2 3.02Å; M68-D70 VanDerWaalsContact C-N 3.34Å; M68-D70 PolarHBondContact O-N 3.44Å; D70-N74 VanDerWaalsContact O-CB 3.24Å; D70-N74 WeakPolarHBondContact O-CB 3.49Å; D70-N74 VanDerWaalsContact O-CG 3.26Å; D70-N74 PolarHBondContact O-N 3Å; D70-N74 PolarHBondContact O-ND2 2.74Å
71	N	95.7	Very high	87.9	Confident	14 Å²	14	85.6 Å²	85.6	8%	0.075	44%	0.438	C	S	.	.	H	α-helix	trans	-64.9	-47.2	177.9	-61.2	-16.2	0	0	0	111.3	R66 S67 M68 E69 N74 L75 Q110 Q117	R66-N71 PolarHBondContact NE-OD1 2.84Å; R66-N71 VanDerWaalsContact NH2-CG 3.31Å; R66-N71 PolarHBondContact NH2-OD1 3.24Å; S67-N71 VanDerWaalsContact O-CG 3.26Å; S67-N71 PolarHBondContact O-N 3.13Å; S67-N71 VanDerWaalsContact O-N 3.16Å; S67-N71 PolarHBondContact O-OD1 3.1Å; M68-N71 WeakPolarHBondContact O-CA 3.48Å; M68-N71 VanDerWaalsContact O-CB 3.26Å; M68-N71 WeakPolarHBondContact O-CB 3.48Å; M68-N71 PolarHBondContact O-N 3.43Å; E69-N71 PolarHBondContact O-N 3.12Å; N71-N74 PolarHBondContact O-N 3.37Å; N71-L75 WeakPolarHBondContact O-CB 3.47Å; N71-L75 PolarHBondContact O-N 2.94Å; N71-Q110 PolarHBondContact O-NE2 2.85Å; N71-Q117 PolarHBondContact ND2-OE1 3.34Å
72	E	96.1	Very high	90.5	Very high	137 Å²	137	80.3 Å²	80.3	64%	0.64	41%	0.414	S	S	*	.	H	α-helix	trans	-64.3	-44.9	-179.9	-68.9	177.1	-172.6	0	0	111.5	M68 E69 N74 P76	M68-E72 PolarHBondContact O-N 2.67Å; M68-E72 VanDerWaalsContact O-N 3.08Å; E69-E72 PolarHBondContact O-N 2.98Å; E72-N74 PolarHBondContact O-N 3.38Å; E72-P76 WeakPolarHBondContact O-CD 3.45Å
73	I	96.6	Very high	93	Very high	123 Å²	123	73.5 Å²	73.5	63%	0.631	39%	0.385	S	S	*	.	H	α-helix	trans	-64.2	-40.1	179.4	-68	166.9	0	0	0	111.2	E69	E69-I73 WeakPolarHBondContact O-CB 3.44Å; E69-I73 VanDerWaalsContact O-CG1 3.26Å; E69-I73 WeakPolarHBondContact O-CG1 3.3Å; E69-I73 PolarHBondContact O-N 3.45Å
74	N	97.1	Very high	95.1	Very high	78 Å²	78	70.8 Å²	70.8	42%	0.417	38%	0.378	S	S	.	.	H	α-helix	trans	-85.6	-17.5	-175.5	-69.6	-50.4	0	0	0	114.2	D70 N71 E72 C77 L78	D70-N74 VanDerWaalsContact O-CB 3.24Å; D70-N74 WeakPolarHBondContact O-CB 3.49Å; D70-N74 VanDerWaalsContact O-CG 3.26Å; D70-N74 PolarHBondContact O-N 3Å; D70-N74 PolarHBondContact O-ND2 2.74Å; N71-N74 PolarHBondContact O-N 3.37Å; E72-N74 PolarHBondContact O-N 3.38Å; N74-C77 PolarHBondContact O-N 3.35Å; N74-L78 PolarHBondContact O-N 3.36Å
75	L	98.3	Very high	96.3	Very high	37 Å²	37	66.3 Å²	66.3	19%	0.194	37%	0.367	C	S	.	.	H	α-helix	trans	-58.2	-44.6	-175.2	-174.8	70.3	0	0	0	113.4	N71 C77 L78 A79 W103 A106	N71-L75 WeakPolarHBondContact O-CB 3.47Å; N71-L75 PolarHBondContact O-N 2.94Å; L75-C77 VanDerWaalsContact C-N 3.33Å; L75-C77 PolarHBondContact O-N 2.7Å; L75-L78 PolarHBondContact O-N 2.98Å; L75-A79 WeakPolarHBondContact O-CB 3.48Å; L75-A79 PolarHBondContact O-N 3.18Å; L75-W103 HydrophobicContact CD2-CE3 3.99Å; L75-W103 HydrophobicContact CD2-CZ3 3.95Å; L75-W103 HydrophobicContact CG-CE3 3.91Å; L75-W103 HydrophobicContact CG-CZ3 3.81Å; L75-A106 HydrophobicContact CD1-CB 3.66Å
76	P	98.5	Very high	97	Very high	68 Å²	68	65.1 Å²	65.1	44%	0.442	36%	0.359	S	S	.	.	H	α-helix	trans	-62	-38.7	176.7	-22.8	34.5	0	0	0	113.1	E72 A79 A80 W103	E72-P76 WeakPolarHBondContact O-CD 3.45Å; P76-A79 PolarHBondContact O-N 2.93Å; P76-A80 WeakPolarHBondContact O-CB 3.49Å; P76-A80 PolarHBondContact O-N 2.96Å; P76-W103 HydrophobicContact CB-CH2 4.09Å; P76-W103 HydrophobicContact CG-CH2 4.18Å; P76-W103 HydrophobicContact CG-CZ3 4.42Å
77	C	98.6	Very high	97.3	Very high	89 Å²	89	70 Å²	70	60%	0.601	38%	0.377	S	S	*	.	H	α-helix	trans	-65	-45.1	177.6	-177	0	0	0	0	111.3	N74 L75 A79 A80 A81	N74-C77 PolarHBondContact O-N 3.35Å; L75-C77 VanDerWaalsContact C-N 3.33Å; L75-C77 PolarHBondContact O-N 2.7Å; C77-A79 PolarHBondContact O-N 3.46Å; C77-A80 WeakPolarHBondContact O-CB 3.48Å; C77-A80 PolarHBondContact O-N 2.9Å; C77-A81 PolarHBondContact O-N 2.88Å
78	L	98.6	Very high	97.6	Very high	57 Å²	57	71.7 Å²	71.7	30%	0.298	40%	0.401	S	S	.	.	H	α-helix	trans	-61.9	-42.8	174.5	-72	172.5	0	0	0	111.9	N74 L75 A80 A81 Y82 A106 Q110	N74-L78 PolarHBondContact O-N 3.36Å; L75-L78 PolarHBondContact O-N 2.98Å; L78-A80 VanDerWaalsContact C-N 3.33Å; L78-A80 PolarHBondContact O-N 3.36Å; L78-A81 PolarHBondContact O-N 2.92Å; L78-Y82 VanDerWaalsContact O-CD2 3.24Å; L78-Y82 WeakPolarHBondContact O-CD2 3.34Å; L78-Y82 PolarHBondContact O-N 2.97Å; L78-A106 HydrophobicContact CB-CB 3.65Å; L78-Q110 HydrophobicContact CD1-CG 3.74Å
79	A	98.8	Very high	97.9	Very high	3 Å²	3	72.2 Å²	72.2	3%	0.025	41%	0.405	C	S	.	.	H	α-helix	trans	-63	-40.2	176.1	0	0	0	0	0	111.5	L75 P76 C77 Y82 T83 P102 W103 A106	L75-A79 WeakPolarHBondContact O-CB 3.48Å; L75-A79 PolarHBondContact O-N 3.18Å; P76-A79 PolarHBondContact O-N 2.93Å; C77-A79 PolarHBondContact O-N 3.46Å; A79-Y82 PolarHBondContact O-N 2.92Å; A79-T83 PolarHBondContact O-N 3.13Å; A79-T83 PolarHBondContact O-OG1 2.69Å; A79-P102 HydrophobicContact CB-CB 4.25Å; A79-P102 VanDerWaalsContact O-CB 3.28Å; A79-P102 WeakPolarHBondContact O-CB 3.34Å; A79-W103 HydrophobicContact CB-CD2 3.8Å; A79-W103 HydrophobicContact CB-CE3 3.88Å; A79-W103 HydrophobicContact CB-CG 4.29Å; A79-W103 HydrophobicContact CB-CH2 4.39Å; A79-W103 HydrophobicContact CB-CZ2 4.31Å; A79-W103 HydrophobicContact CB-CZ3 4.18Å; A79-A106 HydrophobicContact CB-CB 4.31Å
80	A	98.8	Very high	98.1	Very high	56 Å²	56	69.1 Å²	69.1	46%	0.463	41%	0.41	S	S	.	.	H	α-helix	trans	-60.5	-46.2	173.2	0	0	0	0	0	111.4	P76 C77 L78 Y82 T83 T84	P76-A80 WeakPolarHBondContact O-CB 3.49Å; P76-A80 PolarHBondContact O-N 2.96Å; C77-A80 WeakPolarHBondContact O-CB 3.48Å; C77-A80 PolarHBondContact O-N 2.9Å; L78-A80 VanDerWaalsContact C-N 3.33Å; L78-A80 PolarHBondContact O-N 3.36Å; A80-Y82 PolarHBondContact O-N 3.04Å; A80-T83 WeakPolarHBondContact O-CB 3.38Å; A80-T83 PolarHBondContact O-N 2.85Å; A80-T83 VanDerWaalsContact O-N 3.09Å; A80-T84 PolarHBondContact O-N 2.89Å; A80-T84 PolarHBondContact O-OG1 2.98Å
81	A	98.8	Very high	98.2	Very high	49 Å²	49	71.6 Å²	71.6	41%	0.405	42%	0.421	S	S	.	.	H	α-helix	trans	-59	-44.2	176.5	0	0	0	0	0	112.6	C77 L78 T83 T84 I85	C77-A81 PolarHBondContact O-N 2.88Å; L78-A81 PolarHBondContact O-N 2.92Å; A81-T83 VanDerWaalsContact C-N 3.31Å; A81-T83 PolarHBondContact O-N 2.82Å; A81-T84 WeakPolarHBondContact O-CB 3.47Å; A81-T84 PolarHBondContact O-N 2.8Å; A81-I85 WeakPolarHBondContact O-CG1 3.38Å; A81-I85 PolarHBondContact O-N 3.33Å
82	Y	98.8	Very high	98.4	Very high	54 Å²	54	75.1 Å²	75.1	21%	0.212	44%	0.439	C	S	.	.	H	α-helix	trans	-64.8	-34.2	175	-82	-65.1	0	0	0	112.9	L78 A79 A80 T84 I85 L86 A105 A106 M109	L78-Y82 VanDerWaalsContact O-CD2 3.24Å; L78-Y82 WeakPolarHBondContact O-CD2 3.34Å; L78-Y82 PolarHBondContact O-N 2.97Å; A79-Y82 PolarHBondContact O-N 2.92Å; A80-Y82 PolarHBondContact O-N 3.04Å; Y82-T84 VanDerWaalsContact C-N 3.33Å; Y82-I85 HydrophobicContact CD1-CD1 4.06Å; Y82-I85 HydrophobicContact CE1-CD1 4.33Å; Y82-I85 PolarHBondContact O-N 2.88Å; Y82-L86 WeakPolarHBondContact O-CG 2.87Å; Y82-L86 PolarHBondContact O-N 3.02Å; Y82-A105 HydrophobicContact CD1-CB 3.72Å; Y82-A105 HydrophobicContact CD2-CB 3.75Å; Y82-A105 HydrophobicContact CE1-CB 3.87Å; Y82-A105 VanDerWaalsContact CE2-C 3.5Å; Y82-A105 HydrophobicContact CE2-CB 3.91Å; Y82-A105 HydrophobicContact CG-CB 3.66Å; Y82-A106 HydrophobicContact CD2-CB 4.06Å; Y82-A106 HydrophobicContact CE2-CB 4.33Å; Y82-M109 HydrophobicContact CE2-CB 4.36Å; Y82-M109 WeakPolarHBondContact OH-CB 3.41Å; Y82-M109 WeakPolarHBondContact OH-CE 3.46Å
83	T	98.8	Very high	98.5	Very high	30 Å²	30	69.3 Å²	69.3	18%	0.184	41%	0.414	C	S	.	.	H	α-helix	trans	-62.8	-43	172.9	-54.5	0	0	0	0	110.9	A79 A80 A81 I85 L86 R87 P93 P102	A79-T83 PolarHBondContact O-N 3.13Å; A79-T83 PolarHBondContact O-OG1 2.69Å; A80-T83 WeakPolarHBondContact O-CB 3.38Å; A80-T83 PolarHBondContact O-N 2.85Å; A80-T83 VanDerWaalsContact O-N 3.09Å; A81-T83 VanDerWaalsContact C-N 3.31Å; A81-T83 PolarHBondContact O-N 2.82Å; T83-I85 VanDerWaalsContact C-N 3.35Å; T83-L86 PolarHBondContact O-N 3.49Å; T83-R87 PolarHBondContact O-N 2.85Å; T83-R87 VanDerWaalsContact O-N 3.13Å; T83-P93 HydrophobicContact CG2-CB 4.42Å; T83-P93 HydrophobicContact CG2-CG 4.43Å; T83-P102 VanDerWaalsContact OG1-CB 3.29Å; T83-P102 WeakPolarHBondContact OG1-CB 3.28Å; T83-P102 WeakPolarHBondContact OG1-CG 3.38Å
84	T	98.8	Very high	98.5	Very high	91 Å²	91	69.8 Å²	69.8	56%	0.558	41%	0.413	S	S	*	.	H	α-helix	trans	-62.1	-41.8	175.2	-59	0	0	0	0	111.6	A80 A81 Y82 L86 R87 G88	A80-T84 PolarHBondContact O-N 2.89Å; A80-T84 PolarHBondContact O-OG1 2.98Å; A81-T84 WeakPolarHBondContact O-CB 3.47Å; A81-T84 PolarHBondContact O-N 2.8Å; Y82-T84 VanDerWaalsContact C-N 3.33Å; T84-L86 PolarHBondContact O-N 2.89Å; T84-R87 PolarHBondContact O-N 2.78Å; T84-G88 PolarHBondContact O-N 2.86Å
85	I	98.8	Very high	98.6	Very high	92 Å²	92	71.2 Å²	71.2	47%	0.472	41%	0.413	S	S	.	.	H	α-helix	trans	-59.2	-47.4	174.5	-68.8	167.3	0	0	0	110.9	A81 Y82 T83 R87 G88 L89	A81-I85 WeakPolarHBondContact O-CG1 3.38Å; A81-I85 PolarHBondContact O-N 3.33Å; Y82-I85 HydrophobicContact CD1-CD1 4.06Å; Y82-I85 HydrophobicContact CE1-CD1 4.33Å; Y82-I85 PolarHBondContact O-N 2.88Å; T83-I85 VanDerWaalsContact C-N 3.35Å; I85-R87 VanDerWaalsContact C-N 3.34Å; I85-R87 PolarHBondContact O-N 2.82Å; I85-G88 PolarHBondContact O-N 2.96Å; I85-G88 VanDerWaalsContact O-N 3.13Å; I85-L89 HydrophobicContact CG2-CD1 3.94Å; I85-L89 HydrophobicContact CG2-CG 4.37Å; I85-L89 WeakPolarHBondContact O-CG 3.47Å; I85-L89 PolarHBondContact O-N 2.86Å
86	L	98.8	Very high	98.6	Very high	22 Å²	22	77.9 Å²	77.9	12%	0.115	44%	0.443	C	S	.	.	H	α-helix	trans	-57.5	-47	179.2	-68.8	173.5	0	0	0	111.7	Y82 T83 T84 G88 L89 G90 E91 P93 L98 T101 P102	Y82-L86 WeakPolarHBondContact O-CG 2.87Å; Y82-L86 PolarHBondContact O-N 3.02Å; T83-L86 PolarHBondContact O-N 3.49Å; T84-L86 PolarHBondContact O-N 2.89Å; L86-G88 VanDerWaalsContact C-N 3.34Å; L86-G88 PolarHBondContact O-N 2.97Å; L86-L89 PolarHBondContact O-N 3.2Å; L86-G90 PolarHBondContact O-N 3.4Å; L86-E91 WeakPolarHBondContact O-CB 3.39Å; L86-E91 PolarHBondContact O-N 3.2Å; L86-E91 VanDerWaalsContact O-N 3.13Å; L86-P93 HydrophobicContact CB-CG 4.39Å; L86-L98 HydrophobicContact CD1-CB 4.4Å; L86-L98 HydrophobicContact CD1-CD1 4.32Å; L86-L98 HydrophobicContact CD1-CD2 4.45Å; L86-L98 HydrophobicContact CD2-CD1 4.16Å; L86-L98 HydrophobicContact CD2-CD2 4.19Å; L86-T101 HydrophobicContact CD1-CG2 4.14Å; L86-T101 HydrophobicContact CD2-CG2 4.41Å; L86-P102 HydrophobicContact CD1-CG 4.02Å
87	R	98.6	Very high	98.6	Very high	149 Å²	149	76.3 Å²	76.3	56%	0.562	44%	0.439	S	S	*	.	H	α-helix	trans	-62.1	-42	175.7	-68.4	-179	-179.6	134.1	-2.3	112	T83 T84 I85 L89 G90 P93	T83-R87 PolarHBondContact O-N 2.85Å; T83-R87 VanDerWaalsContact O-N 3.13Å; T84-R87 PolarHBondContact O-N 2.78Å; I85-R87 VanDerWaalsContact C-N 3.34Å; I85-R87 PolarHBondContact O-N 2.82Å; R87-L89 PolarHBondContact O-N 2.83Å; R87-G90 PolarHBondContact O-N 2.85Å; R87-P93 HydrophobicContact CG-CG 3.63Å
88	G	98.6	Very high	98.6	Very high	72 Å²	72	72.7 Å²	72.7	74%	0.742	41%	0.413	S	S	*	.	H	α-helix	trans	-63.4	-24.4	177.5	0	0	0	0	0	113.8	T84 I85 L86 G90	T84-G88 PolarHBondContact O-N 2.86Å; I85-G88 PolarHBondContact O-N 2.96Å; I85-G88 VanDerWaalsContact O-N 3.13Å; L86-G88 VanDerWaalsContact C-N 3.34Å; L86-G88 PolarHBondContact O-N 2.97Å; G88-G90 VanDerWaalsContact C-N 3.3Å
89	L	98.6	Very high	98.6	Very high	130 Å²	130	74.3 Å²	74.3	68%	0.681	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-1.1	172.5	-65.6	171.6	0	0	0	113.4	I85 L86 R87 E91	I85-L89 HydrophobicContact CG2-CD1 3.94Å; I85-L89 HydrophobicContact CG2-CG 4.37Å; I85-L89 WeakPolarHBondContact O-CG 3.47Å; I85-L89 PolarHBondContact O-N 2.86Å; L86-L89 PolarHBondContact O-N 3.2Å; R87-L89 PolarHBondContact O-N 2.83Å; L89-E91 VanDerWaalsContact C-N 3.35Å
90	G	98.6	Very high	98.5	Very high	72 Å²	72	81.5 Å²	81.5	74%	0.742	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	80	11.8	-177.3	0	0	0	0	0	114.5	L86 R87 G88	L86-G90 PolarHBondContact O-N 3.4Å; R87-G90 PolarHBondContact O-N 2.85Å; G88-G90 VanDerWaalsContact C-N 3.3Å
91	E	98.6	Very high	98.5	Very high	80 Å²	80	80.3 Å²	80.3	37%	0.374	44%	0.44	S	S	.	.			trans	-82.6	151.1	177	-76.8	-81.3	159.2	0	0	111.7	L86 L89 P93 R95 L98	L86-E91 WeakPolarHBondContact O-CB 3.39Å; L86-E91 PolarHBondContact O-N 3.2Å; L86-E91 VanDerWaalsContact O-N 3.13Å; L89-E91 VanDerWaalsContact C-N 3.35Å; E91-P93 VanDerWaalsContact O-CD 3.27Å; E91-P93 WeakPolarHBondContact O-CD 3.29Å; E91-R95 IonicContact OE1-NH2 3.85Å; E91-R95 IonicContact OE2-CZ 3.15Å; E91-R95 VanDerWaalsContact OE2-CZ 3.24Å; E91-R95 IonicContact OE2-NE 3.55Å; E91-R95 PolarHBondContact OE2-NE 3.24Å; E91-R95 IonicContact OE2-NH2 3.32Å; E91-R95 PolarHBondContact OE2-NH2 3.18Å; E91-L98 HydrophobicContact CB-CD1 3.83Å; E91-L98 HydrophobicContact CG-CD1 4.26Å; E91-L98 VanDerWaalsContact OE2-CD1 3.31Å; E91-L98 WeakPolarHBondContact OE2-CD1 3.47Å
92	D	98.3	Very high	98.5	Very high	88 Å²	88	78.3 Å²	78.3	47%	0.471	42%	0.423	S	S	.	.			trans	-86.5	109.3	168.8	173.4	19.7	0	0	0	110.4	Q94 R95	D92-Q94 PolarHBondContact O-N 3Å; D92-Q94 VanDerWaalsContact O-N 3.14Å; D92-Q94 VanDerWaalsContact OD1-CB 3.31Å; D92-Q94 WeakPolarHBondContact OD1-CB 3.19Å; D92-Q94 PolarHBondContact OD1-N 3.37Å; D92-R95 WeakPolarHBondContact O-CG 3.32Å; D92-R95 PolarHBondContact O-N 3.03Å; D92-R95 PolarHBondContact OD2-N 3.22Å
93	P	98.3	Very high	98.5	Very high	16 Å²	16	81.8 Å²	81.8	10%	0.104	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-15.2	178.5	-19.1	34	0	0	0	113.8	T83 L86 R87 E91	T83-P93 HydrophobicContact CG2-CB 4.42Å; T83-P93 HydrophobicContact CG2-CG 4.43Å; L86-P93 HydrophobicContact CB-CG 4.39Å; R87-P93 HydrophobicContact CG-CG 3.63Å; E91-P93 VanDerWaalsContact O-CD 3.27Å; E91-P93 WeakPolarHBondContact O-CD 3.29Å
94	Q	98.2	Very high	98.5	Very high	132 Å²	132	87.2 Å²	87.2	62%	0.617	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-12.1	179.7	-59.1	-57.8	-34.4	0	0	113.4	D92 L99	D92-Q94 PolarHBondContact O-N 3Å; D92-Q94 VanDerWaalsContact O-N 3.14Å; D92-Q94 VanDerWaalsContact OD1-CB 3.31Å; D92-Q94 WeakPolarHBondContact OD1-CB 3.19Å; D92-Q94 PolarHBondContact OD1-N 3.37Å; Q94-L99 WeakPolarHBondContact O-CD2 3.47Å
95	R	98.3	Very high	98.5	Very high	108 Å²	108	84 Å²	84	41%	0.408	44%	0.436	S	S	.	.	S	Bend	trans	-63.4	144.7	176.6	79.1	-177.9	174.6	81.1	-6.1	110.8	E91 D92 G97 L98 L99	E91-R95 IonicContact OE1-NH2 3.85Å; E91-R95 IonicContact OE2-CZ 3.15Å; E91-R95 VanDerWaalsContact OE2-CZ 3.24Å; E91-R95 IonicContact OE2-NE 3.55Å; E91-R95 PolarHBondContact OE2-NE 3.24Å; E91-R95 IonicContact OE2-NH2 3.32Å; E91-R95 PolarHBondContact OE2-NH2 3.18Å; D92-R95 WeakPolarHBondContact O-CG 3.32Å; D92-R95 PolarHBondContact O-N 3.03Å; D92-R95 PolarHBondContact OD2-N 3.22Å; R95-G97 PolarHBondContact O-N 3.14Å; R95-L98 HydrophobicContact CG-CB 4.05Å; R95-L98 HydrophobicContact CG-CD1 4.09Å; R95-L98 HydrophobicContact CG-CG 3.88Å; R95-L98 VanDerWaalsContact NE-CD1 3.28Å; R95-L98 PolarHBondContact O-N 2.96Å; R95-L99 PolarHBondContact O-N 3.14Å
96	Q	98.1	Very high	98.5	Very high	178 Å²	178	79.7 Å²	79.7	83%	0.832	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.3	-38.6	-172.6	-171.8	-124.1	-19.8	0	0	113.8	L98	Q96-L98 PolarHBondContact O-N 2.91Å
97	G	98.2	Very high	98.5	Very high	34 Å²	34	82 Å²	82	35%	0.351	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-23	179.1	0	0	0	0	0	115.7	R95 T101 R104	R95-G97 PolarHBondContact O-N 3.14Å; G97-T101 PolarHBondContact O-OG1 3.27Å; G97-R104 PolarHBondContact O-NH2 3.44Å
98	L	98.6	Very high	98.5	Very high	13 Å²	13	76.6 Å²	76.6	7%	0.068	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	-13.9	-174.5	-65.5	-175.5	0	0	0	115.1	L86 E91 R95 Q96 K100 T101 P102	L86-L98 HydrophobicContact CD1-CB 4.4Å; L86-L98 HydrophobicContact CD1-CD1 4.32Å; L86-L98 HydrophobicContact CD1-CD2 4.45Å; L86-L98 HydrophobicContact CD2-CD1 4.16Å; L86-L98 HydrophobicContact CD2-CD2 4.19Å; E91-L98 HydrophobicContact CB-CD1 3.83Å; E91-L98 HydrophobicContact CG-CD1 4.26Å; E91-L98 VanDerWaalsContact OE2-CD1 3.31Å; E91-L98 WeakPolarHBondContact OE2-CD1 3.47Å; R95-L98 HydrophobicContact CG-CB 4.05Å; R95-L98 HydrophobicContact CG-CD1 4.09Å; R95-L98 HydrophobicContact CG-CG 3.88Å; R95-L98 VanDerWaalsContact NE-CD1 3.28Å; R95-L98 PolarHBondContact O-N 2.96Å; Q96-L98 PolarHBondContact O-N 2.91Å; L98-K100 PolarHBondContact O-N 2.74Å; L98-T101 WeakPolarHBondContact CA-OG1 3.4Å; L98-T101 HydrophobicContact CD2-CG2 4.06Å; L98-T101 WeakPolarHBondContact CD2-OG1 3.13Å; L98-T101 WeakPolarHBondContact O-CB 2.99Å; L98-T101 PolarHBondContact O-N 3.48Å; L98-P102 WeakPolarHBondContact O-CD 3.41Å
99	L	98.3	Very high	98.5	Very high	92 Å²	92	74.7 Å²	74.7	48%	0.482	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.5	-40.7	-178.7	-72.8	172.7	0	0	0	113.8	Q94 R95	Q94-L99 WeakPolarHBondContact O-CD2 3.47Å; R95-L99 PolarHBondContact O-N 3.14Å
100	K	98.6	Very high	98.5	Very high	154 Å²	154	69.5 Å²	69.5	67%	0.67	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104	0.7	178.2	-64.4	-168.4	177.1	-175.6	0	114	L98 W103 R104	L98-K100 PolarHBondContact O-N 2.74Å; K100-W103 PolarHBondContact O-N 3.39Å; K100-R104 WeakPolarHBondContact O-CG 3.45Å; K100-R104 PolarHBondContact O-N 3.05Å; K100-R104 PolarHBondContact O-NE 3.25Å
101	T	98.8	Very high	98.5	Very high	31 Å²	31	71.2 Å²	71.2	19%	0.19	35%	0.347	C	S	.	.	H	α-helix	trans	-59.9	-44.5	-179.1	-69.2	0	0	0	0	113.3	L86 G97 L98 W103 R104 A105	L86-T101 HydrophobicContact CD1-CG2 4.14Å; L86-T101 HydrophobicContact CD2-CG2 4.41Å; G97-T101 PolarHBondContact O-OG1 3.27Å; L98-T101 WeakPolarHBondContact CA-OG1 3.4Å; L98-T101 HydrophobicContact CD2-CG2 4.06Å; L98-T101 WeakPolarHBondContact CD2-OG1 3.13Å; L98-T101 WeakPolarHBondContact O-CB 2.99Å; L98-T101 PolarHBondContact O-N 3.48Å; T101-W103 VanDerWaalsContact C-N 3.3Å; T101-W103 PolarHBondContact O-N 2.7Å; T101-R104 PolarHBondContact O-N 3.5Å; T101-R104 PolarHBondContact OG1-NH2 2.96Å; T101-A105 VanDerWaalsContact O-CB 3.27Å; T101-A105 WeakPolarHBondContact O-CB 3.17Å; T101-A105 PolarHBondContact O-N 3.14Å
102	P	98.8	Very high	98.5	Very high	7 Å²	7	71.3 Å²	71.3	5%	0.045	35%	0.346	C	S	.	.	H	α-helix	trans	-56.7	-43.7	-179.5	-26.8	34	0	0	0	113.6	A79 T83 L86 L98 A106	A79-P102 HydrophobicContact CB-CB 4.25Å; A79-P102 VanDerWaalsContact O-CB 3.28Å; A79-P102 WeakPolarHBondContact O-CB 3.34Å; T83-P102 VanDerWaalsContact OG1-CB 3.29Å; T83-P102 WeakPolarHBondContact OG1-CB 3.28Å; T83-P102 WeakPolarHBondContact OG1-CG 3.38Å; L86-P102 HydrophobicContact CD1-CG 4.02Å; L98-P102 WeakPolarHBondContact O-CD 3.41Å; P102-A106 VanDerWaalsContact O-CB 3.28Å; P102-A106 WeakPolarHBondContact O-CB 3.46Å; P102-A106 PolarHBondContact O-N 3.47Å
103	W	98.8	Very high	98.6	Very high	127 Å²	127	67.8 Å²	67.8	48%	0.481	33%	0.328	S	S	.	.	H	α-helix	trans	-68.5	-46.1	176.3	-65.2	100	0	0	0	112.4	L75 P76 A79 K100 T101 A105 A106 T107	L75-W103 HydrophobicContact CD2-CE3 3.99Å; L75-W103 HydrophobicContact CD2-CZ3 3.95Å; L75-W103 HydrophobicContact CG-CE3 3.91Å; L75-W103 HydrophobicContact CG-CZ3 3.81Å; P76-W103 HydrophobicContact CB-CH2 4.09Å; P76-W103 HydrophobicContact CG-CH2 4.18Å; P76-W103 HydrophobicContact CG-CZ3 4.42Å; A79-W103 HydrophobicContact CB-CD2 3.8Å; A79-W103 HydrophobicContact CB-CE3 3.88Å; A79-W103 HydrophobicContact CB-CG 4.29Å; A79-W103 HydrophobicContact CB-CH2 4.39Å; A79-W103 HydrophobicContact CB-CZ2 4.31Å; A79-W103 HydrophobicContact CB-CZ3 4.18Å; K100-W103 PolarHBondContact O-N 3.39Å; T101-W103 VanDerWaalsContact C-N 3.3Å; T101-W103 PolarHBondContact O-N 2.7Å; W103-A105 VanDerWaalsContact C-N 3.32Å; W103-A105 PolarHBondContact O-N 3.06Å; W103-A106 PolarHBondContact O-N 2.97Å; W103-T107 PolarHBondContact O-N 3.33Å; W103-T107 PolarHBondContact O-OG1 3.48Å; W103-T107 VanDerWaalsContact O-OG1 3.06Å
104	R	98.8	Very high	98.5	Very high	143 Å²	143	68.7 Å²	68.7	54%	0.54	33%	0.331	S	S	.	.	H	α-helix	trans	-59.4	-43	176.9	-71.1	-179.1	-61.8	-166.9	1.6	111.9	G97 K100 T101 A108	G97-R104 PolarHBondContact O-NH2 3.44Å; K100-R104 WeakPolarHBondContact O-CG 3.45Å; K100-R104 PolarHBondContact O-N 3.05Å; K100-R104 PolarHBondContact O-NE 3.25Å; T101-R104 PolarHBondContact O-N 3.5Å; T101-R104 PolarHBondContact OG1-NH2 2.96Å; R104-A108 VanDerWaalsContact O-CB 3.25Å; R104-A108 WeakPolarHBondContact O-CB 3.35Å; R104-A108 PolarHBondContact O-N 2.92Å
105	A	98.8	Very high	98.5	Very high	25 Å²	25	62.4 Å²	62.4	21%	0.207	30%	0.301	C	S	.	.	H	α-helix	trans	-67.1	-43.8	178.9	0	0	0	0	0	111.6	Y82 T101 W103 A108 M109	Y82-A105 HydrophobicContact CD1-CB 3.72Å; Y82-A105 HydrophobicContact CD2-CB 3.75Å; Y82-A105 HydrophobicContact CE1-CB 3.87Å; Y82-A105 VanDerWaalsContact CE2-C 3.5Å; Y82-A105 HydrophobicContact CE2-CB 3.91Å; Y82-A105 HydrophobicContact CG-CB 3.66Å; T101-A105 VanDerWaalsContact O-CB 3.27Å; T101-A105 WeakPolarHBondContact O-CB 3.17Å; T101-A105 PolarHBondContact O-N 3.14Å; W103-A105 VanDerWaalsContact C-N 3.32Å; W103-A105 PolarHBondContact O-N 3.06Å; A105-A108 PolarHBondContact O-N 3.31Å; A105-M109 WeakPolarHBondContact O-CB 3.48Å; A105-M109 PolarHBondContact O-N 3.27Å
106	A	98.8	Very high	98.4	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-58.9	-51.3	175	0	0	0	0	0	111.7	L75 L78 A79 Y82 P102 W103 A108 M109 Q110	L75-A106 HydrophobicContact CD1-CB 3.66Å; L78-A106 HydrophobicContact CB-CB 3.65Å; A79-A106 HydrophobicContact CB-CB 4.31Å; Y82-A106 HydrophobicContact CD2-CB 4.06Å; Y82-A106 HydrophobicContact CE2-CB 4.33Å; P102-A106 VanDerWaalsContact O-CB 3.28Å; P102-A106 WeakPolarHBondContact O-CB 3.46Å; P102-A106 PolarHBondContact O-N 3.47Å; W103-A106 PolarHBondContact O-N 2.97Å; A106-A108 VanDerWaalsContact C-N 3.34Å; A106-A108 PolarHBondContact O-N 3.13Å; A106-M109 PolarHBondContact O-N 3.49Å; A106-Q110 WeakPolarHBondContact O-CG 3.38Å; A106-Q110 PolarHBondContact O-N 3.15Å
107	T	98.6	Very high	98.2	Very high	72 Å²	72	55.8 Å²	55.8	44%	0.442	27%	0.272	S	S	.	.	H	α-helix	trans	-61.6	-41	177.4	-56.8	0	0	0	0	112	W103 Q110 F111	W103-T107 PolarHBondContact O-N 3.33Å; W103-T107 PolarHBondContact O-OG1 3.48Å; W103-T107 VanDerWaalsContact O-OG1 3.06Å; T107-Q110 PolarHBondContact O-N 2.97Å; T107-F111 PolarHBondContact O-N 3Å
108	A	98.8	Very high	97.8	Very high	34 Å²	34	56.4 Å²	56.4	28%	0.281	27%	0.265	S	S	.	.	H	α-helix	trans	-62.3	-45.9	176.6	0	0	0	0	0	111.8	R104 A105 A106 Q110 F111 F112	R104-A108 VanDerWaalsContact O-CB 3.25Å; R104-A108 WeakPolarHBondContact O-CB 3.35Å; R104-A108 PolarHBondContact O-N 2.92Å; A105-A108 PolarHBondContact O-N 3.31Å; A106-A108 VanDerWaalsContact C-N 3.34Å; A106-A108 PolarHBondContact O-N 3.13Å; A108-Q110 VanDerWaalsContact C-N 3.31Å; A108-Q110 PolarHBondContact O-N 2.86Å; A108-F111 WeakPolarHBondContact O-CB 3.4Å; A108-F111 PolarHBondContact O-N 3.36Å; A108-F111 VanDerWaalsContact O-N 3.12Å; A108-F112 HydrophobicContact CB-CE2 3.98Å; A108-F112 HydrophobicContact CB-CZ 4.18Å; A108-F112 VanDerWaalsContact O-CD2 3.26Å; A108-F112 WeakPolarHBondContact O-CD2 3.19Å; A108-F112 WeakPolarHBondContact O-CG 3.39Å; A108-F112 PolarHBondContact O-N 3.41Å
109	M	98.8	Very high	97.3	Very high	32 Å²	32	59.6 Å²	59.6	16%	0.158	28%	0.279	C	S	.	.	H	α-helix	trans	-62.9	-39.2	177.1	-174.2	56	71	0	0	111.8	Y82 A105 A106 F111 F112 T113 M147	Y82-M109 HydrophobicContact CE2-CB 4.36Å; Y82-M109 WeakPolarHBondContact OH-CB 3.41Å; Y82-M109 WeakPolarHBondContact OH-CE 3.46Å; A105-M109 WeakPolarHBondContact O-CB 3.48Å; A105-M109 PolarHBondContact O-N 3.27Å; A106-M109 PolarHBondContact O-N 3.49Å; M109-F111 VanDerWaalsContact C-N 3.32Å; M109-F111 PolarHBondContact O-N 2.81Å; M109-F112 PolarHBondContact O-N 3.24Å; M109-T113 WeakPolarHBondContact O-CB 3.22Å; M109-T113 PolarHBondContact O-N 3.37Å; M109-T113 VanDerWaalsContact O-N 3.09Å; M109-T113 PolarHBondContact O-OG1 3.06Å; M109-T113 HydrophobicContact SD-CG2 4.19Å; M109-M147 HydrophobicContact CE-SD 4.3Å
110	Q	98.6	Very high	96.7	Very high	22 Å²	22	55.9 Å²	55.9	10%	0.103	26%	0.259	C	S	.	.	H	α-helix	trans	-60.4	-40.7	173.2	-72.5	-167	-23.9	0	0	112.1	R66 N71 L78 A106 T107 A108 T113 K114	R66-Q110 PolarHBondContact NH1-O 3.17Å; N71-Q110 PolarHBondContact O-NE2 2.85Å; L78-Q110 HydrophobicContact CD1-CG 3.74Å; A106-Q110 WeakPolarHBondContact O-CG 3.38Å; A106-Q110 PolarHBondContact O-N 3.15Å; T107-Q110 PolarHBondContact O-N 2.97Å; A108-Q110 VanDerWaalsContact C-N 3.31Å; A108-Q110 PolarHBondContact O-N 2.86Å; Q110-T113 CarbonylContact O-C 3.41Å; Q110-T113 PolarHBondContact O-N 3.41Å; Q110-T113 PolarHBondContact O-OG1 2.93Å; Q110-K114 PolarHBondContact O-N 2.89Å; Q110-K114 VanDerWaalsContact O-N 3.1Å
111	F	98.6	Very high	95.9	Very high	108 Å²	108	54.5 Å²	54.5	47%	0.474	26%	0.258	S	S	.	.	H	α-helix	trans	-67.5	-44.6	175.4	178.2	-93.6	0	0	0	112.4	T107 A108 M109 T113 K114	T107-F111 PolarHBondContact O-N 3Å; A108-F111 WeakPolarHBondContact O-CB 3.4Å; A108-F111 PolarHBondContact O-N 3.36Å; A108-F111 VanDerWaalsContact O-N 3.12Å; M109-F111 VanDerWaalsContact C-N 3.32Å; M109-F111 PolarHBondContact O-N 2.81Å; F111-T113 PolarHBondContact O-N 3.23Å; F111-T113 VanDerWaalsContact O-N 3.11Å; F111-K114 HydrophobicContact CD2-CD 4.08Å; F111-K114 HydrophobicContact CE2-CD 4Å; F111-K114 WeakPolarHBondContact O-CB 3.4Å; F111-K114 VanDerWaalsContact O-CG 3.29Å; F111-K114 WeakPolarHBondContact O-CG 3.44Å; F111-K114 PolarHBondContact O-N 2.86Å; F111-K114 VanDerWaalsContact O-N 3.12Å
112	F	98.7	Very high	95.1	Very high	81 Å²	81	58 Å²	58	36%	0.355	28%	0.275	S	S	.	.	H	α-helix	trans	-62.2	-19.8	176.7	-59.1	-31	0	0	0	112.9	A108 M109 R184 R185	A108-F112 HydrophobicContact CB-CE2 3.98Å; A108-F112 HydrophobicContact CB-CZ 4.18Å; A108-F112 VanDerWaalsContact O-CD2 3.26Å; A108-F112 WeakPolarHBondContact O-CD2 3.19Å; A108-F112 WeakPolarHBondContact O-CG 3.39Å; A108-F112 PolarHBondContact O-N 3.41Å; M109-F112 PolarHBondContact O-N 3.24Å; F112-R184 CarbonylContact O-C 3.55Å; F112-R184 WeakPolarHBondContact O-CA 3.47Å; F112-R185 PolarHBondContact O-N 3.42Å
113	T	98.4	Very high	94.2	Very high	15 Å²	15	58 Å²	58	9%	0.092	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.8	18.1	179.4	57.6	0	0	0	0	112.9	R66 M109 Q110 F111 G115 Y116 R184 L186	R66-T113 PolarHBondContact NH1-O 3.05Å; R66-T113 PolarHBondContact NH1-OG1 2.83Å; M109-T113 WeakPolarHBondContact O-CB 3.22Å; M109-T113 PolarHBondContact O-N 3.37Å; M109-T113 VanDerWaalsContact O-N 3.09Å; M109-T113 PolarHBondContact O-OG1 3.06Å; M109-T113 HydrophobicContact SD-CG2 4.19Å; Q110-T113 CarbonylContact O-C 3.41Å; Q110-T113 PolarHBondContact O-N 3.41Å; Q110-T113 PolarHBondContact O-OG1 2.93Å; F111-T113 PolarHBondContact O-N 3.23Å; F111-T113 VanDerWaalsContact O-N 3.11Å; T113-G115 PolarHBondContact O-N 3.2Å; T113-Y116 HydrophobicContact CG2-CE2 4.24Å; T113-Y116 WeakPolarHBondContact O-CD2 3.46Å; T113-Y116 PolarHBondContact O-N 3.17Å; T113-R184 CarbonylContact C-O 3.6Å; T113-R184 WeakPolarHBondContact CA-O 3.2Å; T113-L186 HydrophobicContact CG2-CD2 4.06Å; T113-L186 HydrophobicContact CG2-CG 4.36Å
114	K	97.6	Very high	93.4	Very high	34 Å²	34	52.9 Å²	52.9	15%	0.148	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-64.3	-22.8	-178.3	73.6	179.6	177.1	68.2	0	113.2	Q110 F111 Y116 Q117 E118 E180 R184	Q110-K114 PolarHBondContact O-N 2.89Å; Q110-K114 VanDerWaalsContact O-N 3.1Å; F111-K114 HydrophobicContact CD2-CD 4.08Å; F111-K114 HydrophobicContact CE2-CD 4Å; F111-K114 WeakPolarHBondContact O-CB 3.4Å; F111-K114 VanDerWaalsContact O-CG 3.29Å; F111-K114 WeakPolarHBondContact O-CG 3.44Å; F111-K114 PolarHBondContact O-N 2.86Å; F111-K114 VanDerWaalsContact O-N 3.12Å; K114-Y116 PolarHBondContact O-N 3.41Å; K114-Q117 WeakPolarHBondContact O-CG 3.36Å; K114-Q117 PolarHBondContact O-N 3.01Å; K114-E118 IonicContact NZ-OE1 3.6Å; K114-E118 PolarHBondContact NZ-OE1 2.98Å; K114-E180 IonicContact NZ-OE2 3.57Å; K114-E180 PolarHBondContact NZ-OE2 3.37Å; K114-R184 HydrophobicContact CG-CB 3.88Å; K114-R184 HydrophobicContact CG-CG 4.07Å; K114-R184 PolarHBondContact N-O 3.37Å
115	G	97.1	Very high	92	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-61.7	-15.1	-178.9	0	0	0	0	0	114.7	T113 Q117 I181 R184 R185	T113-G115 PolarHBondContact O-N 3.2Å; G115-Q117 VanDerWaalsContact C-N 3.28Å; G115-I181 CarbonylContact C-O 3.58Å; G115-I181 WeakPolarHBondContact CA-O 3.19Å; G115-R184 VanDerWaalsContact CA-O 3.31Å; G115-R184 WeakPolarHBondContact CA-O 3.33Å; G115-R184 PolarHBondContact N-O 2.8Å; G115-R185 PolarHBondContact O-NE 3.38Å; G115-R185 PolarHBondContact O-NH2 2.71Å
116	Y	96.6	Very high	90.7	Very high	90 Å²	90	57.5 Å²	57.5	35%	0.353	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-73.2	-15.5	171	-64.8	-64.7	0	0	0	114.1	T65 R66 T113 K114 R185 L186	T65-Y116 WeakPolarHBondContact CB-O 3.43Å; R66-Y116 PolarHBondContact N-O 3.15Å; T113-Y116 HydrophobicContact CG2-CE2 4.24Å; T113-Y116 WeakPolarHBondContact O-CD2 3.46Å; T113-Y116 PolarHBondContact O-N 3.17Å; K114-Y116 PolarHBondContact O-N 3.41Å; Y116-R185 HydrophobicContact CD1-CG 4.02Å; Y116-R185 HydrophobicContact CD2-CG 4.33Å; Y116-R185 HydrophobicContact CE1-CB 4Å; Y116-R185 HydrophobicContact CE1-CG 3.82Å; Y116-R185 HydrophobicContact CE2-CB 3.98Å; Y116-R185 HydrophobicContact CE2-CG 4.13Å; Y116-R185 HydrophobicContact CG-CG 4.26Å; Y116-L186 PolarHBondContact OH-N 3.34Å; Y116-L186 PolarHBondContact OH-O 2.91Å
117	Q	94.2	Very high	90	Very high	58 Å²	58	58 Å²	58	27%	0.271	29%	0.294	S	S	.	.	S	Bend	trans	-94.7	-12.8	177.7	86.1	-156.5	7.3	0	0	112.8	R66 N71 K114 G115	R66-Q117 HydrophobicContact CB-CB 4.3Å; R66-Q117 WeakPolarHBondContact O-CA 3.44Å; R66-Q117 WeakPolarHBondContact O-CB 3.26Å; N71-Q117 PolarHBondContact ND2-OE1 3.34Å; K114-Q117 WeakPolarHBondContact O-CG 3.36Å; K114-Q117 PolarHBondContact O-N 3.01Å; G115-Q117 VanDerWaalsContact C-N 3.28Å
118	E	90.6	Very high	89.3	Confident	46 Å²	46	57.2 Å²	57.2	22%	0.215	29%	0.286	C	S	.	.			trans	-97	133.9	-172	-60	-175.9	-154.7	0	0	111	K114 I181	K114-E118 IonicContact NZ-OE1 3.6Å; K114-E118 PolarHBondContact NZ-OE1 2.98Å; E118-I181 HydrophobicContact CB-CG1 3.92Å; E118-I181 HydrophobicContact CB-CG2 4.43Å; E118-I181 WeakPolarHBondContact OE2-CG1 3.19Å
119	K	87.3	Confident	88.8	Confident	81 Å²	81	60.5 Å²	60.5	35%	0.352	29%	0.294	S	S	.	.			trans	-104.7	143	171.5	-59.2	179.6	-179.9	-179.3	0	109.7	T65 I121 D122 V123	T65-K119 HydrophobicContact CG2-CD 4.4Å; T65-K119 HydrophobicContact CG2-CG 3.83Å; K119-I121 VanDerWaalsContact C-N 3.28Å; K119-I121 HydrophobicContact CB-CG2 4.07Å; K119-I121 PolarHBondContact O-N 2.96Å; K119-D122 PolarHBondContact O-N 3.04Å; K119-V123 PolarHBondContact O-N 3.4Å
120	I	85	Confident	88.1	Confident	14 Å²	14	65.5 Å²	65.5	7%	0.072	32%	0.322	C	S	.	.	H	α-helix	trans	-61	-39.5	178.9	-77.5	163.6	0	0	0	111.7	W60 D122 V123 L124 I181 Y182 A199	W60-I120 HydrophobicContact CE3-CD1 4.46Å; W60-I120 HydrophobicContact CH2-CD1 3.34Å; W60-I120 HydrophobicContact CZ3-CB 3.98Å; W60-I120 HydrophobicContact CZ3-CD1 3.28Å; W60-I120 HydrophobicContact CZ3-CG1 4.12Å; W60-I120 HydrophobicContact CZ3-CG2 4.49Å; I120-D122 VanDerWaalsContact C-N 3.27Å; I120-D122 PolarHBondContact O-N 3.04Å; I120-V123 WeakPolarHBondContact O-CA 3.38Å; I120-V123 WeakPolarHBondContact O-CB 3.14Å; I120-V123 PolarHBondContact O-N 2.91Å; I120-L124 HydrophobicContact CG2-CD1 3.7Å; I120-L124 HydrophobicContact CG2-CG 3.97Å; I120-L124 WeakPolarHBondContact O-CG 3.35Å; I120-L124 PolarHBondContact O-N 2.7Å; I120-I181 HydrophobicContact CG1-CD1 3.74Å; I120-Y182 HydrophobicContact CD1-CE2 3.89Å; I120-Y182 WeakPolarHBondContact CD1-OH 3.4Å; I120-A199 HydrophobicContact CD1-CB 3.43Å; I120-A199 VanDerWaalsContact CD1-CB 3.43Å
121	I	82.9	Confident	87.2	Confident	124 Å²	124	69.9 Å²	69.9	64%	0.636	34%	0.342	S	S	*	.	H	α-helix	trans	-56.5	-41.6	-179.6	-164	74.9	0	0	0	112	K119 V123 L124 N125	K119-I121 VanDerWaalsContact C-N 3.28Å; K119-I121 HydrophobicContact CB-CG2 4.07Å; K119-I121 PolarHBondContact O-N 2.96Å; I121-V123 VanDerWaalsContact C-N 3.28Å; I121-V123 PolarHBondContact O-N 2.91Å; I121-L124 PolarHBondContact O-N 2.82Å; I121-N125 PolarHBondContact O-N 2.9Å
122	D	82.5	Confident	86.7	Confident	104 Å²	104	71.4 Å²	71.4	56%	0.556	36%	0.355	S	S	*	.	H	α-helix	trans	-70.6	-27.4	179.2	-55	-26.7	0	0	0	111.7	K119 I120	K119-D122 PolarHBondContact O-N 3.04Å; I120-D122 VanDerWaalsContact C-N 3.27Å; I120-D122 PolarHBondContact O-N 3.04Å
123	V	79.2	Confident	86.3	Confident	9 Å²	9	70.7 Å²	70.7	6%	0.055	35%	0.353	C	S	.	.	H	α-helix	trans	-75.8	-40.7	176.6	165.2	0	0	0	0	111.3	K119 I120 I121 K174 R177 I181	K119-V123 PolarHBondContact O-N 3.4Å; I120-V123 WeakPolarHBondContact O-CA 3.38Å; I120-V123 WeakPolarHBondContact O-CB 3.14Å; I120-V123 PolarHBondContact O-N 2.91Å; I121-V123 VanDerWaalsContact C-N 3.28Å; I121-V123 PolarHBondContact O-N 2.91Å; V123-K174 VanDerWaalsContact O-CD 3.24Å; V123-K174 WeakPolarHBondContact O-CD 3.45Å; V123-K174 VanDerWaalsContact O-CE 3.28Å; V123-K174 WeakPolarHBondContact O-CE 3.33Å; V123-K174 PolarHBondContact O-NZ 3.31Å; V123-R177 HydrophobicContact CG1-CB 3.42Å; V123-R177 VanDerWaalsContact CG1-CB 3.42Å; V123-R177 HydrophobicContact CG1-CG 4.4Å; V123-I181 HydrophobicContact CB-CD1 3.93Å; V123-I181 HydrophobicContact CG1-CD1 4.23Å; V123-I181 HydrophobicContact CG2-CD1 3.5Å; V123-I181 HydrophobicContact CG2-CG1 4.09Å
124	L	81.1	Confident	85.9	Confident	18 Å²	18	75.9 Å²	75.9	9%	0.094	38%	0.38	C	S	.	.	H	α-helix	trans	-64.8	-44.9	-177.3	-65.8	173.1	0	0	0	111.9	I120 I121 D126 A127 L170 A203	I120-L124 HydrophobicContact CG2-CD1 3.7Å; I120-L124 HydrophobicContact CG2-CG 3.97Å; I120-L124 WeakPolarHBondContact O-CG 3.35Å; I120-L124 PolarHBondContact O-N 2.7Å; I121-L124 PolarHBondContact O-N 2.82Å; L124-D126 PolarHBondContact O-N 2.97Å; L124-A127 VanDerWaalsContact O-CB 3.29Å; L124-A127 WeakPolarHBondContact O-CB 3.47Å; L124-A127 PolarHBondContact O-N 3.4Å; L124-L170 HydrophobicContact CD2-CD1 3.68Å; L124-L170 HydrophobicContact CD2-CD2 4.32Å; L124-A203 HydrophobicContact CD1-CB 3.54Å; L124-A203 HydrophobicContact CD2-CB 3.84Å; L124-A203 HydrophobicContact CG-CB 4.32Å
125	N	71	Confident	85.8	Confident	113 Å²	113	80.5 Å²	80.5	60%	0.604	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	35.1	60.6	170	-166.9	82.1	0	0	0	114.4	I121 A127	I121-N125 PolarHBondContact O-N 2.9Å; N125-A127 PolarHBondContact O-N 3.35Å
126	D	70.9	Confident	85.8	Confident	153 Å²	153	82 Å²	82	82%	0.818	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.4	18.5	177.8	-53.9	-35.7	0	0	0	116.1	L124 I128	L124-D126 PolarHBondContact O-N 2.97Å; D126-I128 PolarHBondContact O-N 3.15Å; D126-I128 VanDerWaalsContact O-N 3.11Å
127	A	83.5	Confident	85.9	Confident	11 Å²	11	78.9 Å²	78.9	9%	0.091	40%	0.4	C	S	.	.			trans	-85.7	34.2	176.9	0	0	0	0	0	112.7	L124 N125 F129 G171 K174	L124-A127 VanDerWaalsContact O-CB 3.29Å; L124-A127 WeakPolarHBondContact O-CB 3.47Å; L124-A127 PolarHBondContact O-N 3.4Å; N125-A127 PolarHBondContact O-N 3.35Å; A127-F129 HydrophobicContact CB-CE2 4.33Å; A127-F129 HydrophobicContact CB-CZ 4.46Å; A127-F129 WeakPolarHBondContact O-CE2 3.44Å; A127-G171 PolarHBondContact O-N 2.8Å; A127-K174 HydrophobicContact CB-CD 4.33Å; A127-K174 VanDerWaalsContact CB-CE 3.41Å; A127-K174 HydrophobicContact CB-CG 3.91Å
128	I	84.7	Confident	86.1	Confident	55 Å²	55	78.4 Å²	78.4	28%	0.282	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	122.4	172.3	-59.7	176.9	0	0	0	106.3	D126 R168 V169 L170 L204	D126-I128 PolarHBondContact O-N 3.15Å; D126-I128 VanDerWaalsContact O-N 3.11Å; I128-R168 HydrophobicContact CG2-CB 3.88Å; I128-R168 HydrophobicContact CG2-CG 4.24Å; I128-V169 WeakPolarHBondContact CA-O 3.43Å; I128-L170 HydrophobicContact CG1-CD1 4.1Å; I128-L204 HydrophobicContact CD1-CD2 4.13Å; I128-L204 HydrophobicContact CG1-CD2 4.03Å; I128-L204 HydrophobicContact CG2-CD2 4.29Å
129	F	87.1	Confident	86.4	Confident	102 Å²	102	77.6 Å²	77.6	45%	0.447	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	134.1	-175.8	-52.7	-80.9	0	0	0	109.2	A127 E131 R168 V169	A127-F129 HydrophobicContact CB-CE2 4.33Å; A127-F129 HydrophobicContact CB-CZ 4.46Å; A127-F129 WeakPolarHBondContact O-CE2 3.44Å; F129-E131 HydrophobicContact CB-CG 4.05Å; F129-E131 PolarHBondContact O-N 2.86Å; F129-R168 WeakPolarHBondContact O-CA 3.39Å; F129-V169 PolarHBondContact N-O 3.18Å; F129-V169 PolarHBondContact O-N 3.29Å
130	D	84.9	Confident	86.9	Confident	138 Å²	138	77 Å²	77	74%	0.738	39%	0.394	S	S	*	.			trans	-79.6	78.7	171	-65	-55.3	0	0	0	108.8	K167 R168	D130-K167 WeakPolarHBondContact CA-O 3.38Å; D130-R168 WeakPolarHBondContact OD1-CG 3.27Å
131	E	80.3	Confident	87.5	Confident	113 Å²	113	79.1 Å²	79.1	53%	0.528	41%	0.406	S	S	.	.			trans	-97.1	124.4	169.7	-63	-69.3	161.3	0	0	106.4	F129 H133 K167 V169	F129-E131 HydrophobicContact CB-CG 4.05Å; F129-E131 PolarHBondContact O-N 2.86Å; E131-H133 HydrophobicContact CB-CB 4.39Å; E131-H133 PolarHBondContact O-N 3.49Å; E131-K167 PolarHBondContact N-O 2.82Å; E131-K167 CarbonylContact O-C 3.08Å; E131-K167 VanDerWaalsContact O-C 3.23Å; E131-K167 WeakPolarHBondContact O-CA 3.45Å; E131-V169 HydrophobicContact CB-CB 4.34Å; E131-V169 HydrophobicContact CB-CG2 3.8Å; E131-V169 HydrophobicContact CG-CB 4.41Å; E131-V169 HydrophobicContact CG-CG2 4.38Å
132	D	86.8	Confident	88.3	Confident	140 Å²	140	74.1 Å²	74.1	75%	0.749	38%	0.38	S	S	*	.			trans	-71.7	59	178	-164.2	37.3	0	0	0	110.7
133	H	89.6	Confident	89.1	Confident	67 Å²	67	74.4 Å²	74.4	31%	0.31	38%	0.381	S	S	.	.			trans	-116.1	125.7	-176.2	-164.3	65.6	0	0	0	108.7	E131 E135 P165 V169	E131-H133 HydrophobicContact CB-CB 4.39Å; E131-H133 PolarHBondContact O-N 3.49Å; H133-E135 IonicContact CE1-OE2 2.68Å; H133-P165 WeakPolarHBondContact O-CB 3.4Å; H133-V169 HydrophobicContact CB-CG2 4.19Å
134	D	91.4	Very high	90	Very high	123 Å²	123	74 Å²	74	66%	0.658	38%	0.379	S	S	*	.			trans	-124.6	4.6	-176.8	61.6	-12.9	0	0	0	112.9	L164	D134-L164 WeakPolarHBondContact O-CD2 3.3Å
135	E	95.8	Very high	90.8	Very high	132 Å²	132	78.1 Å²	78.1	62%	0.617	40%	0.396	S	S	*	.	S	Bend	trans	-90.2	164.3	175.9	-60.7	-169.7	114	0	0	112.7	H133 V137 P165	H133-E135 IonicContact CE1-OE2 2.68Å; E135-V137 PolarHBondContact O-N 2.78Å; E135-P165 WeakPolarHBondContact O-CD 3.01Å
136	M	97.4	Very high	92.2	Very high	32 Å²	32	73.1 Å²	73.1	16%	0.158	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-67.2	125.9	-175	-171.4	-176.5	-56.1	0	0	111.9	I138 L164 F241 T247 E250 F251	M136-I138 HydrophobicContact CG-CD1 4.43Å; M136-I138 HydrophobicContact CG-CG1 4Å; M136-I138 HydrophobicContact SD-CD1 3.72Å; M136-I138 HydrophobicContact SD-CG1 3.87Å; M136-L164 HydrophobicContact CB-CD2 4.11Å; M136-F241 HydrophobicContact CE-CE1 4.23Å; M136-F241 HydrophobicContact CE-CZ 3.92Å; M136-F241 HydrophobicContact CG-CZ 4.04Å; M136-F241 HydrophobicContact SD-CE1 4.23Å; M136-F241 HydrophobicContact SD-CZ 3.94Å; M136-T247 HydrophobicContact CE-CG2 3.66Å; M136-T247 WeakPolarHBondContact CE-O 3.19Å; M136-E250 HydrophobicContact CE-CB 4.34Å; M136-E250 HydrophobicContact CE-CG 4.28Å; M136-F251 HydrophobicContact CE-CB 4.04Å; M136-F251 HydrophobicContact SD-CB 3.8Å; M136-F251 HydrophobicContact SD-CD2 4.3Å; M136-F251 HydrophobicContact SD-CG 4.5Å
137	V	97.5	Very high	93.5	Very high	23 Å²	23	66.2 Å²	66.2	14%	0.139	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	127.9	171.1	179.4	0	0	0	0	109.3	E135 G162 Y163 P165 L172	E135-V137 PolarHBondContact O-N 2.78Å; V137-G162 CarbonylContact O-C 3.59Å; V137-G162 VanDerWaalsContact O-CA 3.29Å; V137-G162 WeakPolarHBondContact O-CA 3.48Å; V137-Y163 HydrophobicContact CB-CD1 4.14Å; V137-Y163 HydrophobicContact CB-CE1 3.65Å; V137-Y163 HydrophobicContact CG1-CD1 4.46Å; V137-Y163 HydrophobicContact CG1-CE1 3.68Å; V137-Y163 HydrophobicContact CG2-CE1 4.48Å; V137-Y163 PolarHBondContact N-O 2.69Å; V137-Y163 PolarHBondContact O-N 3.23Å; V137-P165 HydrophobicContact CG2-CG 3.92Å; V137-L172 HydrophobicContact CG1-CD2 4.19Å
138	I	98.1	Very high	94.2	Very high	49 Å²	49	66 Å²	66	25%	0.251	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	129.3	178.5	-59.7	177.6	0	0	0	110.8	M136 K140 I161 F251 L254 I255	M136-I138 HydrophobicContact CG-CD1 4.43Å; M136-I138 HydrophobicContact CG-CG1 4Å; M136-I138 HydrophobicContact SD-CD1 3.72Å; M136-I138 HydrophobicContact SD-CG1 3.87Å; I138-K140 HydrophobicContact CG2-CB 4.13Å; I138-K140 HydrophobicContact CG2-CG 4.49Å; I138-I161 CarbonylContact C-O 3.6Å; I138-I161 WeakPolarHBondContact CA-O 3.37Å; I138-F251 HydrophobicContact CD1-CD2 4Å; I138-F251 HydrophobicContact CG1-CD2 4.24Å; I138-L254 HydrophobicContact CD1-CB 3.5Å; I138-L254 HydrophobicContact CD1-CD1 3.55Å; I138-L254 HydrophobicContact CD1-CG 4.18Å; I138-I255 HydrophobicContact CG2-CG2 4.09Å
139	V	98.2	Very high	94.9	Very high	28 Å²	28	66.3 Å²	66.3	17%	0.17	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	110.4	162.2	-174.9	0	0	0	0	107.8	I142 I161 L172 L175	V139-I142 HydrophobicContact CB-CD1 4.31Å; V139-I142 HydrophobicContact CG1-CD1 3.75Å; V139-I142 HydrophobicContact CG1-CG1 3.81Å; V139-I161 PolarHBondContact N-O 2.85Å; V139-I161 PolarHBondContact O-N 3.32Å; V139-L172 HydrophobicContact CG2-CB 4.39Å; V139-L172 HydrophobicContact CG2-CD2 3.8Å; V139-L175 HydrophobicContact CB-CD1 4.09Å; V139-L175 HydrophobicContact CG2-CD1 3.56Å
140	K	97.7	Very high	95.4	Very high	68 Å²	68	67.6 Å²	67.6	30%	0.296	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	164.2	-178.4	62.7	173.3	-178.4	179.1	0	111.9	I138 I142 H160 L254 S257	I138-K140 HydrophobicContact CG2-CB 4.13Å; I138-K140 HydrophobicContact CG2-CG 4.49Å; K140-I142 VanDerWaalsContact C-N 3.3Å; K140-I142 PolarHBondContact O-N 3.4Å; K140-H160 HydrophobicContact CB-CB 4.33Å; K140-H160 WeakPolarHBondContact CB-ND1 3.23Å; K140-L254 PolarHBondContact NZ-O 2.84Å; K140-S257 PolarHBondContact NZ-O 2.97Å; K140-S257 PolarHBondContact NZ-OG 3.28Å
141	D	97.9	Very high	96	Very high	60 Å²	60	65 Å²	65	32%	0.321	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	60.4	36.9	178.5	-58	-59.7	0	0	0	114	D143 R158 V159 H160	D141-D143 PolarHBondContact O-N 3.48Å; D141-R158 WeakPolarHBondContact OD1-CD 3.3Å; D141-R158 IonicContact OD1-CZ 2.67Å; D141-R158 IonicContact OD1-NE 3.18Å; D141-R158 IonicContact OD1-NH1 3.37Å; D141-R158 PolarHBondContact OD1-NH1 2.96Å; D141-V159 PolarHBondContact N-O 2.94Å; D141-H160 PolarHBondContact N-ND1 2.85Å; D141-H160 IonicContact OD1-CE1 4Å; D141-H160 PolarHBondContact OD1-CE1 3.25Å
142	I	98.5	Very high	96.9	Very high	19 Å²	19	64 Å²	64	10%	0.097	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	109.2	170.9	-52.1	174.2	0	0	0	107.6	V139 K140 M144 R158 V159 I161 A176 V179	V139-I142 HydrophobicContact CB-CD1 4.31Å; V139-I142 HydrophobicContact CG1-CD1 3.75Å; V139-I142 HydrophobicContact CG1-CG1 3.81Å; K140-I142 VanDerWaalsContact C-N 3.3Å; K140-I142 PolarHBondContact O-N 3.4Å; I142-M144 PolarHBondContact O-N 3.47Å; I142-R158 CarbonylContact O-C 3.23Å; I142-R158 WeakPolarHBondContact O-CA 3.39Å; I142-V159 HydrophobicContact CB-CB 4.28Å; I142-V159 WeakPolarHBondContact CB-O 3.47Å; I142-V159 PolarHBondContact N-O 3Å; I142-V159 PolarHBondContact O-N 2.96Å; I142-I161 HydrophobicContact CD1-CD1 3.78Å; I142-I161 HydrophobicContact CD1-CG1 4.16Å; I142-A176 HydrophobicContact CG2-CB 4Å; I142-V179 HydrophobicContact CD1-CG2 4.25Å; I142-V179 HydrophobicContact CG2-CB 4.38Å; I142-V179 HydrophobicContact CG2-CG1 4.38Å; I142-V179 HydrophobicContact CG2-CG2 4.3Å
143	D	98.6	Very high	97.5	Very high	109 Å²	109	58.6 Å²	58.6	58%	0.583	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.7	133.4	174.1	-72.6	-42.7	0	0	0	110.8	D141 F145	D141-D143 PolarHBondContact O-N 3.48Å; D143-F145 HydrophobicContact CB-CE2 4.44Å
144	M	98.6	Very high	97.9	Very high	1 Å²	1	58.2 Å²	58.2	1%	0.005	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	135.3	-176.7	178.9	-81	-68.6	0	0	110.8	I142 F156 G157 V159 V179 L192 I213 A215	I142-M144 PolarHBondContact O-N 3.47Å; M144-F156 CarbonylContact O-C 3.02Å; M144-F156 VanDerWaalsContact O-CA 3.23Å; M144-F156 WeakPolarHBondContact O-CA 3.34Å; M144-G157 PolarHBondContact N-O 3.01Å; M144-G157 PolarHBondContact O-N 3.11Å; M144-V159 HydrophobicContact CB-CG2 3.71Å; M144-V159 HydrophobicContact CG-CG2 3.98Å; M144-V179 HydrophobicContact CB-CG1 4.12Å; M144-V179 HydrophobicContact CG-CG1 3.96Å; M144-L192 HydrophobicContact CE-CD2 3.97Å; M144-L192 HydrophobicContact CG-CD2 4.41Å; M144-L192 HydrophobicContact SD-CD2 3.89Å; M144-I213 HydrophobicContact CE-CG2 3.61Å; M144-A215 HydrophobicContact CE-CB 4.07Å
145	F	98.8	Very high	98.2	Very high	104 Å²	104	52.5 Å²	52.5	46%	0.456	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	125.7	172.7	-59	-88.3	0	0	0	109.2	D143 F156 S183	D143-F145 HydrophobicContact CB-CE2 4.44Å; F145-F156 HydrophobicContact CD1-CB 3.64Å; F145-F156 HydrophobicContact CE1-CB 3.96Å; F145-F156 HydrophobicContact CG-CB 4.49Å; F145-S183 WeakPolarHBondContact O-CB 3.47Å
146	S	98.8	Very high	98.4	Very high	8 Å²	8	50 Å²	50	6%	0.056	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	176.9	179.2	-163.5	0	0	0	0	112	P154 I155 S183 Q187	S146-P154 WeakPolarHBondContact O-CA 3.4Å; S146-I155 PolarHBondContact N-O 3.19Å; S146-I155 PolarHBondContact O-N 3.17Å; S146-S183 WeakPolarHBondContact CA-O 3.34Å; S146-S183 WeakPolarHBondContact CB-O 3.42Å; S146-S183 PolarHBondContact OG-O 3.09Å; S146-Q187 WeakPolarHBondContact OG-CB 3.36Å
147	M	98.8	Very high	98.4	Very high	9 Å²	9	49.3 Å²	49.3	4%	0.044	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	123.3	-179.7	-162.7	93.2	-39.7	0	0	111.2	M109 E149 L152 P154 L186 Q187	M109-M147 HydrophobicContact CE-SD 4.3Å; M147-E149 PolarHBondContact O-N 3.28Å; M147-L152 VanDerWaalsContact SD-O 3.41Å; M147-P154 VanDerWaalsContact CE-CA 3.4Å; M147-P154 HydrophobicContact CE-CB 4.07Å; M147-P154 HydrophobicContact CE-CG 3.76Å; M147-P154 VanDerWaalsContact CE-N 3.32Å; M147-L186 HydrophobicContact CB-CD2 3.85Å; M147-L186 HydrophobicContact CG-CD2 3.73Å; M147-Q187 PolarHBondContact O-N 3.36Å
148	C	98.6	Very high	98.5	Very high	7 Å²	7	54.2 Å²	54.2	5%	0.047	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	117.6	173	-177.7	0	0	0	0	109.5	H150 H151 L152 V153 I155	C148-H150 PolarHBondContact O-N 2.96Å; C148-H151 PolarHBondContact O-N 2.79Å; C148-L152 WeakPolarHBondContact O-CA 3.38Å; C148-L152 PolarHBondContact O-N 3.18Å; C148-V153 VanDerWaalsContact CB-O 3.32Å; C148-V153 WeakPolarHBondContact CB-O 3.42Å; C148-V153 PolarHBondContact N-O 2.87Å; C148-I155 HydrophobicContact CB-CD1 3.78Å; C148-I155 HydrophobicContact CB-CG1 3.91Å
149	E	98.5	Very high	98.5	Very high	60 Å²	60	51.9 Å²	51.9	28%	0.28	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-26.9	-177.5	68.2	-170.4	-157.5	0	0	113.4	M147 H151 L186 Q187 V188 R191	M147-E149 PolarHBondContact O-N 3.28Å; E149-H151 VanDerWaalsContact C-N 3.35Å; E149-H151 PolarHBondContact O-N 3.15Å; E149-L186 HydrophobicContact CB-CB 3.82Å; E149-Q187 PolarHBondContact N-O 2.86Å; E149-V188 HydrophobicContact CG-CG2 3.9Å; E149-V188 VanDerWaalsContact OE1-CG2 3.29Å; E149-V188 WeakPolarHBondContact OE1-CG2 3.28Å; E149-R191 IonicContact OE1-CZ 3.24Å; E149-R191 IonicContact OE1-NH1 3.89Å; E149-R191 PolarHBondContact OE1-NH1 3.46Å; E149-R191 IonicContact OE1-NH2 2.9Å; E149-R191 PolarHBondContact OE1-NH2 3.36Å; E149-R191 IonicContact OE2-CZ 3.74Å; E149-R191 IonicContact OE2-NH1 2.71Å; E149-R191 PolarHBondContact OE2-NH1 3.45Å; E149-R191 IonicContact OE2-NH2 2.79Å
150	H	98.4	Very high	98.5	Very high	129 Å²	129	51.1 Å²	51.1	60%	0.597	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-26	-179.4	-54.9	114.8	0	0	0	114.1	C148	C148-H150 PolarHBondContact O-N 2.96Å
151	H	98.5	Very high	98.6	Very high	85 Å²	85	47.9 Å²	47.9	39%	0.394	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-136.1	-6.4	-169.8	-56.4	106.7	0	0	0	114.2	C148 E149 V153 C219 R223	C148-H151 PolarHBondContact O-N 2.79Å; E149-H151 VanDerWaalsContact C-N 3.35Å; E149-H151 PolarHBondContact O-N 3.15Å; H151-V153 VanDerWaalsContact C-N 3.26Å; H151-V153 HydrophobicContact CB-CB 4.25Å; H151-V153 HydrophobicContact CB-CG2 4.27Å; H151-V153 WeakPolarHBondContact O-CG2 3.5Å; H151-V153 PolarHBondContact O-N 3.04Å; H151-C219 HydrophobicContact CB-CB 4.35Å; H151-R223 PolarHBondContact CD2-NH1 3.47Å; H151-R223 PolarHBondContact NE2-NH1 3.21Å
152	L	98.6	Very high	98.6	Very high	91 Å²	91	45 Å²	45	48%	0.476	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.6	42.3	-174.3	-49.8	-177.5	0	0	0	112.5	M147 C148 L186	M147-L152 VanDerWaalsContact SD-O 3.41Å; C148-L152 WeakPolarHBondContact O-CA 3.38Å; C148-L152 PolarHBondContact O-N 3.18Å; L152-L186 HydrophobicContact CD2-CD1 3.86Å; L152-L186 HydrophobicContact CD2-CD2 3.69Å; L152-L186 HydrophobicContact CD2-CG 4.41Å
153	V	98.6	Very high	98.6	Very high	26 Å²	26	44.1 Å²	44.1	16%	0.158	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	143.6	-175.4	162.4	0	0	0	0	109.7	C148 H151 M218 C219 M222	C148-V153 VanDerWaalsContact CB-O 3.32Å; C148-V153 WeakPolarHBondContact CB-O 3.42Å; C148-V153 PolarHBondContact N-O 2.87Å; H151-V153 VanDerWaalsContact C-N 3.26Å; H151-V153 HydrophobicContact CB-CB 4.25Å; H151-V153 HydrophobicContact CB-CG2 4.27Å; H151-V153 WeakPolarHBondContact O-CG2 3.5Å; H151-V153 PolarHBondContact O-N 3.04Å; V153-M218 HydrophobicContact CG1-CB 3.34Å; V153-C219 HydrophobicContact CG1-CB 4.34Å; V153-M222 HydrophobicContact CG1-SD 4.32Å
154	P	98.6	Very high	98.5	Very high	59 Å²	59	40.1 Å²	40.1	38%	0.383	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-55	138.5	-175.1	-28.8	34.3	0	0	0	116.1	S146 M147 F156 M218	S146-P154 WeakPolarHBondContact O-CA 3.4Å; M147-P154 VanDerWaalsContact CE-CA 3.4Å; M147-P154 HydrophobicContact CE-CB 4.07Å; M147-P154 HydrophobicContact CE-CG 3.76Å; M147-P154 VanDerWaalsContact CE-N 3.32Å; P154-F156 HydrophobicContact CB-CD1 4.46Å; P154-M218 HydrophobicContact CB-CG 4.23Å; P154-M218 WeakPolarHBondContact O-CB 3.29Å; P154-M218 PolarHBondContact O-N 3.39Å
155	I	98.6	Very high	98.4	Very high	4 Å²	4	40.3 Å²	40.3	2%	0.021	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	128.9	159	-55.3	169.5	0	0	0	105.5	S146 C148 A215 T216	S146-I155 PolarHBondContact N-O 3.19Å; S146-I155 PolarHBondContact O-N 3.17Å; C148-I155 HydrophobicContact CB-CD1 3.78Å; C148-I155 HydrophobicContact CB-CG1 3.91Å; I155-A215 HydrophobicContact CG2-CB 3.7Å; I155-T216 WeakPolarHBondContact CA-O 3.45Å
156	F	98.6	Very high	98	Very high	79 Å²	79	40.2 Å²	40.2	35%	0.346	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	150.5	177.8	61.5	-92.9	0	0	0	111.1	M144 F145 P154 A215 T216 M218	M144-F156 CarbonylContact O-C 3.02Å; M144-F156 VanDerWaalsContact O-CA 3.23Å; M144-F156 WeakPolarHBondContact O-CA 3.34Å; F145-F156 HydrophobicContact CD1-CB 3.64Å; F145-F156 HydrophobicContact CE1-CB 3.96Å; F145-F156 HydrophobicContact CG-CB 4.49Å; P154-F156 HydrophobicContact CB-CD1 4.46Å; F156-A215 CarbonylContact O-C 3.57Å; F156-A215 WeakPolarHBondContact O-CA 3.47Å; F156-A215 WeakPolarHBondContact O-CB 3.27Å; F156-T216 HydrophobicContact CZ-CG2 4.17Å; F156-T216 PolarHBondContact N-O 3.48Å; F156-T216 PolarHBondContact O-N 3.25Å; F156-M218 HydrophobicContact CD1-CG 4.34Å; F156-M218 HydrophobicContact CE1-CG 3.7Å; F156-M218 HydrophobicContact CE1-SD 3.8Å; F156-M218 HydrophobicContact CZ-SD 4.34Å
157	G	98.5	Very high	97.4	Very high	18 Å²	18	45.9 Å²	45.9	19%	0.186	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	172	-151.8	-173.4	0	0	0	0	0	112.2	M144 E214	M144-G157 PolarHBondContact N-O 3.01Å; M144-G157 PolarHBondContact O-N 3.11Å; G157-E214 CarbonylContact C-O 3.57Å; G157-E214 VanDerWaalsContact CA-O 3.22Å; G157-E214 WeakPolarHBondContact CA-O 3.42Å
158	R	98.6	Very high	96.8	Very high	125 Å²	125	49.3 Å²	49.3	47%	0.472	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	147.5	-178.2	-63	-173.3	-177.8	177.8	3.1	111.4	D141 I142 I213 E214	D141-R158 WeakPolarHBondContact OD1-CD 3.3Å; D141-R158 IonicContact OD1-CZ 2.67Å; D141-R158 IonicContact OD1-NE 3.18Å; D141-R158 IonicContact OD1-NH1 3.37Å; D141-R158 PolarHBondContact OD1-NH1 2.96Å; I142-R158 CarbonylContact O-C 3.23Å; I142-R158 WeakPolarHBondContact O-CA 3.39Å; R158-I213 WeakPolarHBondContact O-CA 3.21Å; R158-E214 PolarHBondContact N-O 3.19Å; R158-E214 PolarHBondContact O-N 2.94Å
159	V	98.8	Very high	96.4	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	134.8	170.9	-174	0	0	0	0	108.6	D141 I142 M144 I161 V179 I196 V211 V212 I213	D141-V159 PolarHBondContact N-O 2.94Å; I142-V159 HydrophobicContact CB-CB 4.28Å; I142-V159 WeakPolarHBondContact CB-O 3.47Å; I142-V159 PolarHBondContact N-O 3Å; I142-V159 PolarHBondContact O-N 2.96Å; M144-V159 HydrophobicContact CB-CG2 3.71Å; M144-V159 HydrophobicContact CG-CG2 3.98Å; V159-I161 HydrophobicContact CG1-CD1 4.08Å; V159-I161 HydrophobicContact CG1-CG1 3.77Å; V159-V179 HydrophobicContact CB-CG1 4.42Å; V159-V179 HydrophobicContact CB-CG2 4.18Å; V159-V179 HydrophobicContact CG1-CG2 3.97Å; V159-V179 HydrophobicContact CG2-CG1 3.82Å; V159-V179 HydrophobicContact CG2-CG2 4.35Å; V159-I196 HydrophobicContact CG1-CD1 4.48Å; V159-V211 HydrophobicContact CG1-CG1 3.93Å; V159-V212 WeakPolarHBondContact CA-O 3.47Å; V159-I213 HydrophobicContact CB-CG1 4.46Å; V159-I213 HydrophobicContact CG1-CG1 4.13Å; V159-I213 HydrophobicContact CG2-CD1 3.99Å; V159-I213 HydrophobicContact CG2-CG1 3.92Å; V159-I213 HydrophobicContact CG2-CG2 4.4Å
160	H	98.8	Very high	96	Very high	12 Å²	12	47.3 Å²	47.3	6%	0.056	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	128.2	173.4	-47.2	-94.9	0	0	0	108	K140 D141 V211 V212 I255	K140-H160 HydrophobicContact CB-CB 4.33Å; K140-H160 WeakPolarHBondContact CB-ND1 3.23Å; D141-H160 PolarHBondContact N-ND1 2.85Å; D141-H160 IonicContact OD1-CE1 4Å; D141-H160 PolarHBondContact OD1-CE1 3.25Å; H160-V211 WeakPolarHBondContact O-CA 3.34Å; H160-V212 HydrophobicContact CB-CB 4.44Å; H160-V212 PolarHBondContact N-O 3.41Å; H160-V212 PolarHBondContact O-N 3.01Å; H160-I255 HydrophobicContact CB-CB 4.11Å; H160-I255 HydrophobicContact CB-CD1 4.2Å; H160-I255 HydrophobicContact CB-CG2 3.81Å
161	I	98.7	Very high	95.7	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	126.4	-174.6	-54.6	-178.3	0	0	0	108	I138 V139 I142 V159 L175 V179 I196 I200 G210 V211	I138-I161 CarbonylContact C-O 3.6Å; I138-I161 WeakPolarHBondContact CA-O 3.37Å; V139-I161 PolarHBondContact N-O 2.85Å; V139-I161 PolarHBondContact O-N 3.32Å; I142-I161 HydrophobicContact CD1-CD1 3.78Å; I142-I161 HydrophobicContact CD1-CG1 4.16Å; V159-I161 HydrophobicContact CG1-CD1 4.08Å; V159-I161 HydrophobicContact CG1-CG1 3.77Å; I161-L175 HydrophobicContact CD1-CB 4.25Å; I161-L175 HydrophobicContact CG2-CD1 4.43Å; I161-L175 HydrophobicContact CG2-CD2 4.19Å; I161-V179 HydrophobicContact CD1-CG2 3.75Å; I161-I196 HydrophobicContact CD1-CG2 3.91Å; I161-I200 HydrophobicContact CD1-CD1 4.1Å; I161-I200 HydrophobicContact CG2-CD1 3.54Å; I161-G210 WeakPolarHBondContact CA-O 3.42Å; I161-V211 HydrophobicContact CG1-CG2 4.48Å; I161-V211 HydrophobicContact CG2-CG2 4.44Å
162	G	98.3	Very high	95.4	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	144.2	168.7	0	0	0	0	0	110	V137 V209 G210	V137-G162 CarbonylContact O-C 3.59Å; V137-G162 VanDerWaalsContact O-CA 3.29Å; V137-G162 WeakPolarHBondContact O-CA 3.48Å; G162-V209 CarbonylContact O-C 3.59Å; G162-V209 WeakPolarHBondContact O-CA 3.33Å; G162-G210 PolarHBondContact N-O 3.13Å; G162-G210 PolarHBondContact O-N 3.13Å
163	Y	98.2	Very high	95.1	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	154.5	168.2	72.8	-79.9	0	0	0	111.2	V137 P165 V169 L170 L175 L204 P206 G208	V137-Y163 HydrophobicContact CB-CD1 4.14Å; V137-Y163 HydrophobicContact CB-CE1 3.65Å; V137-Y163 HydrophobicContact CG1-CD1 4.46Å; V137-Y163 HydrophobicContact CG1-CE1 3.68Å; V137-Y163 HydrophobicContact CG2-CE1 4.48Å; V137-Y163 PolarHBondContact N-O 2.69Å; V137-Y163 PolarHBondContact O-N 3.23Å; Y163-P165 HydrophobicContact CD2-CB 4.39Å; Y163-P165 HydrophobicContact CD2-CG 4.14Å; Y163-P165 HydrophobicContact CE2-CB 3.91Å; Y163-P165 HydrophobicContact CE2-CG 3.66Å; Y163-V169 WeakPolarHBondContact OH-CG1 3.43Å; Y163-L170 PolarHBondContact OH-N 2.87Å; Y163-L175 HydrophobicContact CD1-CD1 4.47Å; Y163-L175 HydrophobicContact CE1-CD1 4.09Å; Y163-L204 HydrophobicContact CD2-CD1 4.24Å; Y163-L204 HydrophobicContact CE2-CD1 3.98Å; Y163-P206 HydrophobicContact CD2-CB 4.1Å; Y163-G208 VanDerWaalsContact CA-O 3.26Å; Y163-G208 WeakPolarHBondContact CA-O 3.4Å; Y163-G208 WeakPolarHBondContact CB-O 3.47Å
164	L	97.5	Very high	94.9	Very high	25 Å²	25	42 Å²	42	13%	0.131	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	105.4	173	-84.5	166.2	0	0	0	108.5	D134 M136 P206 A207 G208 V240 F241 T247	D134-L164 WeakPolarHBondContact O-CD2 3.3Å; M136-L164 HydrophobicContact CB-CD2 4.11Å; L164-P206 CarbonylContact O-C 3.49Å; L164-P206 WeakPolarHBondContact O-CB 3.43Å; L164-A207 HydrophobicContact CB-CB 4.03Å; L164-A207 PolarHBondContact O-N 3.36Å; L164-G208 PolarHBondContact N-O 2.94Å; L164-V240 HydrophobicContact CD1-CB 3.97Å; L164-V240 HydrophobicContact CD1-CG1 3.79Å; L164-F241 HydrophobicContact CB-CE2 4.37Å; L164-F241 HydrophobicContact CD1-CE2 4.17Å; L164-F241 HydrophobicContact CG-CE2 4.01Å; L164-T247 HydrophobicContact CD1-CG2 3.65Å
165	P	95.3	Very high	94.7	Very high	6 Å²	6	39.2 Å²	39.2	4%	0.039	20%	0.198	C	C	.	.			trans	-62.5	154.8	-177.4	-8.6	20.5	0	0	0	111.7	H133 E135 V137 Y163 R168 V169	H133-P165 WeakPolarHBondContact O-CB 3.4Å; E135-P165 WeakPolarHBondContact O-CD 3.01Å; V137-P165 HydrophobicContact CG2-CG 3.92Å; Y163-P165 HydrophobicContact CD2-CB 4.39Å; Y163-P165 HydrophobicContact CD2-CG 4.14Å; Y163-P165 HydrophobicContact CE2-CB 3.91Å; Y163-P165 HydrophobicContact CE2-CG 3.66Å; P165-R168 WeakPolarHBondContact CB-O 3.23Å; P165-V169 HydrophobicContact CB-CG2 4.21Å; P165-V169 HydrophobicContact CG-CG2 4.24Å
166	N	90.8	Very high	94.6	Very high	101 Å²	101	40.8 Å²	40.8	54%	0.54	21%	0.211	S	C	.	.	S	Bend	trans	-115.6	71.8	167.2	-176.9	16.4	0	0	0	107.8	R168	N166-R168 PolarHBondContact O-N 3.45Å
167	K	86.6	Confident	94.5	Very high	127 Å²	127	42.9 Å²	42.9	55%	0.552	22%	0.217	S	C	*	.	S	Bend	trans	62.9	1.4	-175.2	-50.8	-176.5	174.3	-169.1	0	116.4	D130 E131	D130-K167 WeakPolarHBondContact CA-O 3.38Å; E131-K167 PolarHBondContact N-O 2.82Å; E131-K167 CarbonylContact O-C 3.08Å; E131-K167 VanDerWaalsContact O-C 3.23Å; E131-K167 WeakPolarHBondContact O-CA 3.45Å
168	R	86.8	Confident	94.4	Very high	81 Å²	81	42 Å²	42	31%	0.306	21%	0.208	S	C	.	.			trans	-123.8	122.5	179.8	-67.4	-169.4	-57.4	-179.4	-1	110.3	I128 F129 D130 P165 N166 L204	I128-R168 HydrophobicContact CG2-CB 3.88Å; I128-R168 HydrophobicContact CG2-CG 4.24Å; F129-R168 WeakPolarHBondContact O-CA 3.39Å; D130-R168 WeakPolarHBondContact OD1-CG 3.27Å; P165-R168 WeakPolarHBondContact CB-O 3.23Å; N166-R168 PolarHBondContact O-N 3.45Å; R168-L204 PolarHBondContact NH2-O 3.49Å
169	V	89.9	Confident	94.4	Very high	24 Å²	24	36.1 Å²	36.1	15%	0.145	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	141	-178.4	179.8	0	0	0	0	109.3	I128 F129 E131 H133 Y163 P165	I128-V169 WeakPolarHBondContact CA-O 3.43Å; F129-V169 PolarHBondContact N-O 3.18Å; F129-V169 PolarHBondContact O-N 3.29Å; E131-V169 HydrophobicContact CB-CB 4.34Å; E131-V169 HydrophobicContact CB-CG2 3.8Å; E131-V169 HydrophobicContact CG-CB 4.41Å; E131-V169 HydrophobicContact CG-CG2 4.38Å; H133-V169 HydrophobicContact CB-CG2 4.19Å; Y163-V169 WeakPolarHBondContact OH-CG1 3.43Å; P165-V169 HydrophobicContact CB-CG2 4.21Å; P165-V169 HydrophobicContact CG-CG2 4.24Å
170	L	89.9	Confident	94.3	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.005	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	138.3	175.9	-170.1	62.6	0	0	0	110.2	L124 I128 Y163 L172 K174 L175 I178 L204	L124-L170 HydrophobicContact CD2-CD1 3.68Å; L124-L170 HydrophobicContact CD2-CD2 4.32Å; I128-L170 HydrophobicContact CG1-CD1 4.1Å; Y163-L170 PolarHBondContact OH-N 2.87Å; L170-L172 PolarHBondContact O-N 2.68Å; L170-K174 HydrophobicContact CD1-CB 3.94Å; L170-K174 HydrophobicContact CD1-CG 4.14Å; L170-K174 HydrophobicContact CD2-CB 3.8Å; L170-K174 HydrophobicContact CG-CB 3.77Å; L170-K174 HydrophobicContact CG-CG 4.31Å; L170-L175 HydrophobicContact CD2-CD2 3.79Å; L170-L175 HydrophobicContact CD2-CG 4.07Å; L170-I178 HydrophobicContact CD2-CD1 4.13Å; L170-L204 HydrophobicContact CB-CD1 3.64Å; L170-L204 HydrophobicContact CB-CD2 3.79Å; L170-L204 HydrophobicContact CB-CG 4.22Å; L170-L204 HydrophobicContact CD1-CD2 4.13Å; L170-L204 HydrophobicContact CD2-CD1 4.12Å; L170-L204 HydrophobicContact CG-CD1 4.41Å; L170-L204 HydrophobicContact CG-CD2 4.39Å
171	G	91.8	Very high	94.2	Very high	16 Å²	16	37.9 Å²	37.9	17%	0.165	19%	0.194	C	C	.	.			trans	-52.7	124.4	168.7	0	0	0	0	0	111.1	A127 S173 K174	A127-G171 PolarHBondContact O-N 2.8Å; G171-S173 PolarHBondContact O-N 3.13Å; G171-K174 VanDerWaalsContact O-CB 3.27Å; G171-K174 WeakPolarHBondContact O-CB 3.29Å; G171-K174 WeakPolarHBondContact O-CG 3.48Å; G171-K174 PolarHBondContact O-N 3.5Å
172	L	91.9	Very high	94.2	Very high	104 Å²	104	38.4 Å²	38.4	55%	0.545	20%	0.196	S	C	.	.	H	α-helix	trans	-53.9	-36.1	-169.1	-57.2	177.2	0	0	0	113.5	V137 V139 L170 K174 L175	V137-L172 HydrophobicContact CG1-CD2 4.19Å; V139-L172 HydrophobicContact CG2-CB 4.39Å; V139-L172 HydrophobicContact CG2-CD2 3.8Å; L170-L172 PolarHBondContact O-N 2.68Å; L172-K174 PolarHBondContact O-N 2.94Å; L172-L175 PolarHBondContact O-N 3.04Å
173	S	92.3	Very high	94.2	Very high	78 Å²	78	38.4 Å²	38.4	55%	0.545	20%	0.196	S	C	.	.	H	α-helix	trans	-63.4	-22	177.9	64.9	0	0	0	0	113.8	G171 R177	G171-S173 PolarHBondContact O-N 3.13Å; S173-R177 WeakPolarHBondContact O-CG 3.44Å; S173-R177 PolarHBondContact O-N 2.88Å
174	K	94.3	Very high	94.2	Very high	23 Å²	23	39.7 Å²	39.7	10%	0.1	20%	0.201	C	C	.	.	H	α-helix	trans	-75.2	-29.9	178.9	-53.7	-51.4	-167.5	160.6	0	112.3	V123 A127 L170 G171 L172 R177 I178	V123-K174 VanDerWaalsContact O-CD 3.24Å; V123-K174 WeakPolarHBondContact O-CD 3.45Å; V123-K174 VanDerWaalsContact O-CE 3.28Å; V123-K174 WeakPolarHBondContact O-CE 3.33Å; V123-K174 PolarHBondContact O-NZ 3.31Å; A127-K174 HydrophobicContact CB-CD 4.33Å; A127-K174 VanDerWaalsContact CB-CE 3.41Å; A127-K174 HydrophobicContact CB-CG 3.91Å; L170-K174 HydrophobicContact CD1-CB 3.94Å; L170-K174 HydrophobicContact CD1-CG 4.14Å; L170-K174 HydrophobicContact CD2-CB 3.8Å; L170-K174 HydrophobicContact CG-CB 3.77Å; L170-K174 HydrophobicContact CG-CG 4.31Å; G171-K174 VanDerWaalsContact O-CB 3.27Å; G171-K174 WeakPolarHBondContact O-CB 3.29Å; G171-K174 WeakPolarHBondContact O-CG 3.48Å; G171-K174 PolarHBondContact O-N 3.5Å; L172-K174 PolarHBondContact O-N 2.94Å; K174-R177 PolarHBondContact O-N 3.21Å; K174-I178 WeakPolarHBondContact O-CG1 3.32Å; K174-I178 PolarHBondContact O-N 2.9Å
175	L	95.7	Very high	94.3	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-61.4	-45.8	173.1	-69.2	175	0	0	0	110.9	V139 I161 Y163 L170 L172 R177 I178 V179 I200	V139-L175 HydrophobicContact CB-CD1 4.09Å; V139-L175 HydrophobicContact CG2-CD1 3.56Å; I161-L175 HydrophobicContact CD1-CB 4.25Å; I161-L175 HydrophobicContact CG2-CD1 4.43Å; I161-L175 HydrophobicContact CG2-CD2 4.19Å; Y163-L175 HydrophobicContact CD1-CD1 4.47Å; Y163-L175 HydrophobicContact CE1-CD1 4.09Å; L170-L175 HydrophobicContact CD2-CD2 3.79Å; L170-L175 HydrophobicContact CD2-CG 4.07Å; L172-L175 PolarHBondContact O-N 3.04Å; L175-R177 VanDerWaalsContact C-N 3.31Å; L175-R177 PolarHBondContact O-N 3.01Å; L175-I178 PolarHBondContact O-N 3.47Å; L175-V179 WeakPolarHBondContact O-CG2 3.48Å; L175-V179 PolarHBondContact O-N 3.02Å; L175-V179 VanDerWaalsContact O-N 3.09Å; L175-I200 HydrophobicContact CD2-CD1 3.78Å; L175-I200 HydrophobicContact CD2-CG1 3.88Å; L175-I200 HydrophobicContact CD2-CG2 4.4Å
176	A	96.1	Very high	94.5	Very high	37 Å²	37	42.9 Å²	42.9	31%	0.306	21%	0.214	S	C	.	.	H	α-helix	trans	-62.6	-36.6	173.8	0	0	0	0	0	112.5	I142 V179 E180	I142-A176 HydrophobicContact CG2-CB 4Å; A176-V179 WeakPolarHBondContact O-CB 3.32Å; A176-V179 PolarHBondContact O-N 3.24Å; A176-E180 PolarHBondContact O-N 3.18Å
177	R	95.4	Very high	94.8	Very high	122 Å²	122	38.2 Å²	38.2	46%	0.46	19%	0.189	S	C	.	.	H	α-helix	trans	-67	-37.8	174.9	-72	173.9	133.3	-149.9	2.2	112.7	V123 S173 K174 L175 V179 E180 I181	V123-R177 HydrophobicContact CG1-CB 3.42Å; V123-R177 VanDerWaalsContact CG1-CB 3.42Å; V123-R177 HydrophobicContact CG1-CG 4.4Å; S173-R177 WeakPolarHBondContact O-CG 3.44Å; S173-R177 PolarHBondContact O-N 2.88Å; K174-R177 PolarHBondContact O-N 3.21Å; L175-R177 VanDerWaalsContact C-N 3.31Å; L175-R177 PolarHBondContact O-N 3.01Å; R177-V179 VanDerWaalsContact C-N 3.3Å; R177-V179 PolarHBondContact O-N 3Å; R177-E180 WeakPolarHBondContact O-CB 3.45Å; R177-E180 PolarHBondContact O-N 2.77Å; R177-I181 WeakPolarHBondContact O-CG1 3.44Å; R177-I181 PolarHBondContact O-N 2.98Å
178	I	96.5	Very high	95.4	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-61	-41.6	172.5	-68.6	166.1	0	0	0	110.3	L170 K174 L175 E180 I181 Y182 I196 A199 I200	L170-I178 HydrophobicContact CD2-CD1 4.13Å; K174-I178 WeakPolarHBondContact O-CG1 3.32Å; K174-I178 PolarHBondContact O-N 2.9Å; L175-I178 PolarHBondContact O-N 3.47Å; I178-E180 VanDerWaalsContact C-N 3.33Å; I178-E180 PolarHBondContact O-N 2.84Å; I178-I181 PolarHBondContact O-N 3.42Å; I178-Y182 HydrophobicContact CG2-CD2 4.18Å; I178-Y182 HydrophobicContact CG2-CE2 4.07Å; I178-Y182 WeakPolarHBondContact O-CD2 3.3Å; I178-Y182 PolarHBondContact O-N 2.83Å; I178-I196 HydrophobicContact CG2-CG2 4.27Å; I178-A199 HydrophobicContact CG2-CB 3.89Å; I178-I200 HydrophobicContact CD1-CG1 3.98Å; I178-I200 HydrophobicContact CG2-CG1 4.45Å
179	V	98.2	Very high	96	Very high	2 Å²	2	30 Å²	30	1%	0.012	16%	0.158	C	C	.	.	H	α-helix	trans	-57.9	-45.8	173.3	175.2	0	0	0	0	111.1	I142 M144 V159 I161 L175 A176 R177 Y182 S183 I196	I142-V179 HydrophobicContact CD1-CG2 4.25Å; I142-V179 HydrophobicContact CG2-CB 4.38Å; I142-V179 HydrophobicContact CG2-CG1 4.38Å; I142-V179 HydrophobicContact CG2-CG2 4.3Å; M144-V179 HydrophobicContact CB-CG1 4.12Å; M144-V179 HydrophobicContact CG-CG1 3.96Å; V159-V179 HydrophobicContact CB-CG1 4.42Å; V159-V179 HydrophobicContact CB-CG2 4.18Å; V159-V179 HydrophobicContact CG1-CG2 3.97Å; V159-V179 HydrophobicContact CG2-CG1 3.82Å; V159-V179 HydrophobicContact CG2-CG2 4.35Å; I161-V179 HydrophobicContact CD1-CG2 3.75Å; L175-V179 WeakPolarHBondContact O-CG2 3.48Å; L175-V179 PolarHBondContact O-N 3.02Å; L175-V179 VanDerWaalsContact O-N 3.09Å; A176-V179 WeakPolarHBondContact O-CB 3.32Å; A176-V179 PolarHBondContact O-N 3.24Å; R177-V179 VanDerWaalsContact C-N 3.3Å; R177-V179 PolarHBondContact O-N 3Å; V179-Y182 PolarHBondContact O-N 2.84Å; V179-S183 WeakPolarHBondContact O-CB 3.25Å; V179-S183 PolarHBondContact O-N 3.4Å; V179-S183 PolarHBondContact O-OG 3.28Å; V179-I196 HydrophobicContact CB-CD1 4.48Å; V179-I196 HydrophobicContact CG1-CD1 4.42Å; V179-I196 HydrophobicContact CG2-CD1 4.13Å; V179-I196 HydrophobicContact CG2-CG2 4.35Å
180	E	97.5	Very high	96.4	Very high	47 Å²	47	34.3 Å²	34.3	22%	0.22	18%	0.177	C	C	.	.	H	α-helix	trans	-62	-41.8	178.2	-85.8	-78.8	147.3	0	0	113.3	K114 A176 R177 I178 Y182 S183 R184	K114-E180 IonicContact NZ-OE2 3.57Å; K114-E180 PolarHBondContact NZ-OE2 3.37Å; A176-E180 PolarHBondContact O-N 3.18Å; R177-E180 WeakPolarHBondContact O-CB 3.45Å; R177-E180 PolarHBondContact O-N 2.77Å; I178-E180 VanDerWaalsContact C-N 3.33Å; I178-E180 PolarHBondContact O-N 2.84Å; E180-Y182 PolarHBondContact O-N 3.37Å; E180-S183 WeakPolarHBondContact CA-OG 3.04Å; E180-S183 PolarHBondContact O-N 3.36Å; E180-R184 VanDerWaalsContact O-CB 3.29Å; E180-R184 WeakPolarHBondContact O-CB 3.4Å; E180-R184 VanDerWaalsContact O-CG 3.23Å; E180-R184 WeakPolarHBondContact O-CG 3.2Å; E180-R184 PolarHBondContact O-N 3.29Å; E180-R184 IonicContact OE1-CZ 3.61Å; E180-R184 IonicContact OE1-NE 2.77Å; E180-R184 PolarHBondContact OE1-NE 2.97Å; E180-R184 VanDerWaalsContact OE1-NE 3.15Å; E180-R184 IonicContact OE1-NH2 3.77Å; E180-R184 PolarHBondContact OE1-NH2 3.47Å; E180-R184 WeakPolarHBondContact OE2-CG 3.49Å; E180-R184 IonicContact OE2-CZ 2.74Å; E180-R184 IonicContact OE2-NE 3.73Å; E180-R184 PolarHBondContact OE2-NE 3.18Å; E180-R184 IonicContact OE2-NH2 3.38Å
181	I	97	Very high	96.8	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-54.5	-43	178.2	-68	163.9	0	0	0	111.4	G115 E118 I120 V123 R177 I178 R185	G115-I181 CarbonylContact C-O 3.58Å; G115-I181 WeakPolarHBondContact CA-O 3.19Å; E118-I181 HydrophobicContact CB-CG1 3.92Å; E118-I181 HydrophobicContact CB-CG2 4.43Å; E118-I181 WeakPolarHBondContact OE2-CG1 3.19Å; I120-I181 HydrophobicContact CG1-CD1 3.74Å; V123-I181 HydrophobicContact CB-CD1 3.93Å; V123-I181 HydrophobicContact CG1-CD1 4.23Å; V123-I181 HydrophobicContact CG2-CD1 3.5Å; V123-I181 HydrophobicContact CG2-CG1 4.09Å; R177-I181 WeakPolarHBondContact O-CG1 3.44Å; R177-I181 PolarHBondContact O-N 2.98Å; I178-I181 PolarHBondContact O-N 3.42Å; I181-R185 PolarHBondContact O-NE 2.9Å
182	Y	98.3	Very high	97.1	Very high	11 Å²	11	38.7 Å²	38.7	4%	0.043	19%	0.189	C	C	.	.	H	α-helix	trans	-91.4	-34.8	-176.3	-66.2	-66.3	0	0	0	113.4	W60 I120 I178 V179 E180 R185 Q187 L192 Q195 I196 A199	W60-Y182 WeakPolarHBondContact CH2-OH 3.41Å; I120-Y182 HydrophobicContact CD1-CE2 3.89Å; I120-Y182 WeakPolarHBondContact CD1-OH 3.4Å; I178-Y182 HydrophobicContact CG2-CD2 4.18Å; I178-Y182 HydrophobicContact CG2-CE2 4.07Å; I178-Y182 WeakPolarHBondContact O-CD2 3.3Å; I178-Y182 PolarHBondContact O-N 2.83Å; V179-Y182 PolarHBondContact O-N 2.84Å; E180-Y182 PolarHBondContact O-N 3.37Å; Y182-R185 WeakPolarHBondContact O-CB 3.35Å; Y182-Q187 WeakPolarHBondContact O-CG 3.43Å; Y182-Q187 PolarHBondContact O-NE2 3.44Å; Y182-L192 VanDerWaalsContact C-CD1 3.48Å; Y182-L192 VanDerWaalsContact CB-CD1 3.44Å; Y182-Q195 HydrophobicContact CD1-CB 3.63Å; Y182-Q195 HydrophobicContact CD1-CG 4.11Å; Y182-Q195 HydrophobicContact CD2-CB 4.13Å; Y182-Q195 HydrophobicContact CE1-CB 3.73Å; Y182-Q195 HydrophobicContact CE1-CG 4.09Å; Y182-Q195 HydrophobicContact CE2-CB 4.21Å; Y182-Q195 HydrophobicContact CG-CB 3.82Å; Y182-I196 HydrophobicContact CD2-CG1 3.98Å; Y182-A199 HydrophobicContact CE2-CB 3.57Å
183	S	98.6	Very high	97.5	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-71.4	-31.3	-179.7	59.1	0	0	0	0	112	F145 S146 V179 E180 R185	F145-S183 WeakPolarHBondContact O-CB 3.47Å; S146-S183 WeakPolarHBondContact CA-O 3.34Å; S146-S183 WeakPolarHBondContact CB-O 3.42Å; S146-S183 PolarHBondContact OG-O 3.09Å; V179-S183 WeakPolarHBondContact O-CB 3.25Å; V179-S183 PolarHBondContact O-N 3.4Å; V179-S183 PolarHBondContact O-OG 3.28Å; E180-S183 WeakPolarHBondContact CA-OG 3.04Å; E180-S183 PolarHBondContact O-N 3.36Å; S183-R185 PolarHBondContact O-N 3.46Å
184	R	98.6	Very high	97.8	Very high	27 Å²	27	36.3 Å²	36.3	10%	0.102	16%	0.164	C	C	.	.	S	Bend	trans	-79.3	50.9	174.4	-58.4	-64	-179	-172.4	-7	112.9	F112 T113 K114 G115 E180	F112-R184 CarbonylContact O-C 3.55Å; F112-R184 WeakPolarHBondContact O-CA 3.47Å; T113-R184 CarbonylContact C-O 3.6Å; T113-R184 WeakPolarHBondContact CA-O 3.2Å; K114-R184 HydrophobicContact CG-CB 3.88Å; K114-R184 HydrophobicContact CG-CG 4.07Å; K114-R184 PolarHBondContact N-O 3.37Å; G115-R184 VanDerWaalsContact CA-O 3.31Å; G115-R184 WeakPolarHBondContact CA-O 3.33Å; G115-R184 PolarHBondContact N-O 2.8Å; E180-R184 VanDerWaalsContact O-CB 3.29Å; E180-R184 WeakPolarHBondContact O-CB 3.4Å; E180-R184 VanDerWaalsContact O-CG 3.23Å; E180-R184 WeakPolarHBondContact O-CG 3.2Å; E180-R184 PolarHBondContact O-N 3.29Å; E180-R184 IonicContact OE1-CZ 3.61Å; E180-R184 IonicContact OE1-NE 2.77Å; E180-R184 PolarHBondContact OE1-NE 2.97Å; E180-R184 VanDerWaalsContact OE1-NE 3.15Å; E180-R184 IonicContact OE1-NH2 3.77Å; E180-R184 PolarHBondContact OE1-NH2 3.47Å; E180-R184 WeakPolarHBondContact OE2-CG 3.49Å; E180-R184 IonicContact OE2-CZ 2.74Å; E180-R184 IonicContact OE2-NE 3.73Å; E180-R184 PolarHBondContact OE2-NE 3.18Å; E180-R184 IonicContact OE2-NH2 3.38Å
185	R	98.6	Very high	98	Very high	46 Å²	46	37.6 Å²	37.6	17%	0.174	17%	0.17	C	C	.	.	S	Bend	trans	-142.1	169	178.4	-62.3	-177	-173.8	-158.5	-5.6	109	F112 G115 Y116 I181 Y182 S183 Q187	F112-R185 PolarHBondContact O-N 3.42Å; G115-R185 PolarHBondContact O-NE 3.38Å; G115-R185 PolarHBondContact O-NH2 2.71Å; Y116-R185 HydrophobicContact CD1-CG 4.02Å; Y116-R185 HydrophobicContact CD2-CG 4.33Å; Y116-R185 HydrophobicContact CE1-CB 4Å; Y116-R185 HydrophobicContact CE1-CG 3.82Å; Y116-R185 HydrophobicContact CE2-CB 3.98Å; Y116-R185 HydrophobicContact CE2-CG 4.13Å; Y116-R185 HydrophobicContact CG-CG 4.26Å; I181-R185 PolarHBondContact O-NE 2.9Å; Y182-R185 WeakPolarHBondContact O-CB 3.35Å; S183-R185 PolarHBondContact O-N 3.46Å; R185-Q187 HydrophobicContact CB-CG 4.05Å
186	L	98.7	Very high	98.1	Very high	52 Å²	52	37.6 Å²	37.6	27%	0.272	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	127.1	161.3	-54.6	-174.1	0	0	0	107.8	T113 Y116 M147 E149 L152	T113-L186 HydrophobicContact CG2-CD2 4.06Å; T113-L186 HydrophobicContact CG2-CG 4.36Å; Y116-L186 PolarHBondContact OH-N 3.34Å; Y116-L186 PolarHBondContact OH-O 2.91Å; M147-L186 HydrophobicContact CB-CD2 3.85Å; M147-L186 HydrophobicContact CG-CD2 3.73Å; E149-L186 HydrophobicContact CB-CB 3.82Å; L152-L186 HydrophobicContact CD2-CD1 3.86Å; L152-L186 HydrophobicContact CD2-CD2 3.69Å; L152-L186 HydrophobicContact CD2-CG 4.41Å
187	Q	98.6	Very high	98.2	Very high	4 Å²	4	35.8 Å²	35.8	2%	0.019	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	160.8	-164.6	-78.3	-69	10.9	0	0	114.9	S146 M147 E149 Y182 R185 L192	S146-Q187 WeakPolarHBondContact OG-CB 3.36Å; M147-Q187 PolarHBondContact O-N 3.36Å; E149-Q187 PolarHBondContact N-O 2.86Å; Y182-Q187 WeakPolarHBondContact O-CG 3.43Å; Y182-Q187 PolarHBondContact O-NE2 3.44Å; R185-Q187 HydrophobicContact CB-CG 4.05Å; Q187-L192 HydrophobicContact CG-CB 4.4Å
188	V	98.6	Very high	98.3	Very high	31 Å²	31	32 Å²	32	19%	0.188	15%	0.146	C	C	.	.			trans	-116.9	136.1	159.5	172.2	0	0	0	0	107.1	E149 E190 R191 L192	E149-V188 HydrophobicContact CG-CG2 3.9Å; E149-V188 VanDerWaalsContact OE1-CG2 3.29Å; E149-V188 WeakPolarHBondContact OE1-CG2 3.28Å; V188-E190 VanDerWaalsContact C-N 3.29Å; V188-E190 HydrophobicContact CG1-CB 4.34Å; V188-E190 WeakPolarHBondContact CG1-OE2 3.39Å; V188-E190 PolarHBondContact O-N 2.96Å; V188-R191 HydrophobicContact CB-CB 4.36Å; V188-R191 WeakPolarHBondContact O-CB 3.29Å; V188-R191 PolarHBondContact O-N 3.09Å; V188-L192 PolarHBondContact O-N 3.26Å
189	Q	98.8	Very high	98.3	Very high	3 Å²	3	32 Å²	32	1%	0.014	15%	0.146	C	C	.	.	H	α-helix	trans	-61.8	-37.4	-168.7	-170.7	-178.5	-41.9	0	0	112.4	R191 L192 T193 I213 H217 T232 T234	Q189-R191 VanDerWaalsContact C-N 3.34Å; Q189-R191 PolarHBondContact O-N 3.29Å; Q189-L192 PolarHBondContact O-N 3.12Å; Q189-T193 WeakPolarHBondContact O-CB 3.24Å; Q189-T193 PolarHBondContact O-N 2.99Å; Q189-T193 PolarHBondContact O-OG1 3.42Å; Q189-I213 HydrophobicContact CG-CB 4.45Å; Q189-I213 HydrophobicContact CG-CG2 4.07Å; Q189-I213 PolarHBondContact NE2-O 3.37Å; Q189-I213 VanDerWaalsContact NE2-O 3.13Å; Q189-H217 PolarHBondContact OE1-NE2 3.06Å; Q189-T232 PolarHBondContact NE2-O 3.39Å; Q189-T234 HydrophobicContact CB-CG2 4.37Å; Q189-T234 HydrophobicContact CG-CG2 4.04Å; Q189-T234 WeakPolarHBondContact CG-OG1 3.38Å; Q189-T234 PolarHBondContact NE2-OG1 2.82Å
190	E	98.8	Very high	98.2	Very high	115 Å²	115	31.9 Å²	31.9	54%	0.537	15%	0.145	S	C	.	.	H	α-helix	trans	-59.8	-44.7	175.7	-62.8	89.5	145.2	0	0	111	V188 T193 K194 T234	V188-E190 VanDerWaalsContact C-N 3.29Å; V188-E190 HydrophobicContact CG1-CB 4.34Å; V188-E190 WeakPolarHBondContact CG1-OE2 3.39Å; V188-E190 PolarHBondContact O-N 2.96Å; E190-T193 PolarHBondContact O-N 3.34Å; E190-K194 PolarHBondContact O-N 2.67Å; E190-K194 VanDerWaalsContact O-N 3.14Å; E190-T234 HydrophobicContact CG-CG2 3.98Å
191	R	98.8	Very high	98.1	Very high	108 Å²	108	31.8 Å²	31.8	41%	0.408	15%	0.148	S	C	.	.	H	α-helix	trans	-67.3	-46.7	178.2	-167.1	-172.6	-55.1	138.3	5.9	111	E149 V188 Q189 T193 K194 Q195	E149-R191 IonicContact OE1-CZ 3.24Å; E149-R191 IonicContact OE1-NH1 3.89Å; E149-R191 PolarHBondContact OE1-NH1 3.46Å; E149-R191 IonicContact OE1-NH2 2.9Å; E149-R191 PolarHBondContact OE1-NH2 3.36Å; E149-R191 IonicContact OE2-CZ 3.74Å; E149-R191 IonicContact OE2-NH1 2.71Å; E149-R191 PolarHBondContact OE2-NH1 3.45Å; E149-R191 IonicContact OE2-NH2 2.79Å; V188-R191 HydrophobicContact CB-CB 4.36Å; V188-R191 WeakPolarHBondContact O-CB 3.29Å; V188-R191 PolarHBondContact O-N 3.09Å; Q189-R191 VanDerWaalsContact C-N 3.34Å; Q189-R191 PolarHBondContact O-N 3.29Å; R191-T193 VanDerWaalsContact C-N 3.31Å; R191-T193 PolarHBondContact O-N 3.12Å; R191-K194 PolarHBondContact O-N 3.43Å; R191-Q195 HydrophobicContact CG-CG 4.4Å; R191-Q195 WeakPolarHBondContact O-CB 3.37Å; R191-Q195 WeakPolarHBondContact O-CG 3Å; R191-Q195 PolarHBondContact O-N 3.1Å
192	L	98.8	Very high	97.8	Very high	2 Å²	2	35 Å²	35	1%	0.01	16%	0.163	C	C	.	.	H	α-helix	trans	-54.3	-48.3	175.9	173.7	59.1	0	0	0	111.3	M144 Y182 Q187 V188 Q189 K194 Q195 I196 I213	M144-L192 HydrophobicContact CE-CD2 3.97Å; M144-L192 HydrophobicContact CG-CD2 4.41Å; M144-L192 HydrophobicContact SD-CD2 3.89Å; Y182-L192 VanDerWaalsContact C-CD1 3.48Å; Y182-L192 VanDerWaalsContact CB-CD1 3.44Å; Q187-L192 HydrophobicContact CG-CB 4.4Å; V188-L192 PolarHBondContact O-N 3.26Å; Q189-L192 PolarHBondContact O-N 3.12Å; L192-K194 PolarHBondContact O-N 3.22Å; L192-Q195 PolarHBondContact O-N 2.98Å; L192-I196 HydrophobicContact CD1-CD1 3.74Å; L192-I196 HydrophobicContact CD1-CG1 4.28Å; L192-I196 HydrophobicContact CG-CD1 4.03Å; L192-I196 WeakPolarHBondContact O-CG1 3.34Å; L192-I196 PolarHBondContact O-N 3.32Å; L192-I196 VanDerWaalsContact O-N 3.13Å; L192-I213 HydrophobicContact CD2-CD1 4.02Å; L192-I213 HydrophobicContact CG-CD1 3.8Å
193	T	98.9	Very high	97.3	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.006	17%	0.168	C	C	.	.	H	α-helix	trans	-58.9	-47.4	179.6	-51.2	0	0	0	0	111.4	Q189 E190 R191 A197 V211 I213 T234	Q189-T193 WeakPolarHBondContact O-CB 3.24Å; Q189-T193 PolarHBondContact O-N 2.99Å; Q189-T193 PolarHBondContact O-OG1 3.42Å; E190-T193 PolarHBondContact O-N 3.34Å; R191-T193 VanDerWaalsContact C-N 3.31Å; R191-T193 PolarHBondContact O-N 3.12Å; T193-A197 PolarHBondContact O-N 3.02Å; T193-V211 HydrophobicContact CG2-CB 4.32Å; T193-V211 HydrophobicContact CG2-CG1 4.03Å; T193-I213 HydrophobicContact CG2-CD1 4.48Å; T193-I213 HydrophobicContact CG2-CG1 4.2Å; T193-I213 WeakPolarHBondContact OG1-CD1 3.31Å; T193-T234 WeakPolarHBondContact OG1-CB 3.34Å; T193-T234 PolarHBondContact OG1-OG1 3.27Å
194	K	98.8	Very high	96.9	Very high	130 Å²	130	35.4 Å²	35.4	57%	0.565	17%	0.168	S	C	*	.	H	α-helix	trans	-65.6	-42.6	179.7	-174.7	178	179.4	-177.6	0	112.1	E190 R191 L192 I196 A197 V198 T236	E190-K194 PolarHBondContact O-N 2.67Å; E190-K194 VanDerWaalsContact O-N 3.14Å; R191-K194 PolarHBondContact O-N 3.43Å; L192-K194 PolarHBondContact O-N 3.22Å; K194-I196 PolarHBondContact O-N 3.11Å; K194-A197 PolarHBondContact O-N 3.32Å; K194-V198 HydrophobicContact CG-CG2 4.24Å; K194-V198 WeakPolarHBondContact O-CB 3.47Å; K194-V198 VanDerWaalsContact O-CG2 3.32Å; K194-V198 WeakPolarHBondContact O-CG2 3.12Å; K194-V198 PolarHBondContact O-N 3.37Å; K194-T236 HydrophobicContact CG-CG2 4.49Å
195	Q	98.6	Very high	96.7	Very high	50 Å²	50	40.4 Å²	40.4	23%	0.234	19%	0.193	C	C	.	.	H	α-helix	trans	-60.8	-43.3	-179.7	-78.8	177.7	-35.8	0	0	112.2	Y182 R191 L192 V198 A199	Y182-Q195 HydrophobicContact CD1-CB 3.63Å; Y182-Q195 HydrophobicContact CD1-CG 4.11Å; Y182-Q195 HydrophobicContact CD2-CB 4.13Å; Y182-Q195 HydrophobicContact CE1-CB 3.73Å; Y182-Q195 HydrophobicContact CE1-CG 4.09Å; Y182-Q195 HydrophobicContact CE2-CB 4.21Å; Y182-Q195 HydrophobicContact CG-CB 3.82Å; R191-Q195 HydrophobicContact CG-CG 4.4Å; R191-Q195 WeakPolarHBondContact O-CB 3.37Å; R191-Q195 WeakPolarHBondContact O-CG 3Å; R191-Q195 PolarHBondContact O-N 3.1Å; L192-Q195 PolarHBondContact O-N 2.98Å; Q195-V198 PolarHBondContact O-N 2.92Å; Q195-A199 VanDerWaalsContact O-CB 3.3Å; Q195-A199 WeakPolarHBondContact O-CB 3.46Å; Q195-A199 PolarHBondContact O-N 3.33Å
196	I	98.4	Very high	96.5	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-61.7	-47.8	176.7	-66.8	160.7	0	0	0	110.5	V159 I161 I178 V179 Y182 L192 K194 V198 A199 I200 V211 I213	V159-I196 HydrophobicContact CG1-CD1 4.48Å; I161-I196 HydrophobicContact CD1-CG2 3.91Å; I178-I196 HydrophobicContact CG2-CG2 4.27Å; V179-I196 HydrophobicContact CB-CD1 4.48Å; V179-I196 HydrophobicContact CG1-CD1 4.42Å; V179-I196 HydrophobicContact CG2-CD1 4.13Å; V179-I196 HydrophobicContact CG2-CG2 4.35Å; Y182-I196 HydrophobicContact CD2-CG1 3.98Å; L192-I196 HydrophobicContact CD1-CD1 3.74Å; L192-I196 HydrophobicContact CD1-CG1 4.28Å; L192-I196 HydrophobicContact CG-CD1 4.03Å; L192-I196 WeakPolarHBondContact O-CG1 3.34Å; L192-I196 PolarHBondContact O-N 3.32Å; L192-I196 VanDerWaalsContact O-N 3.13Å; K194-I196 PolarHBondContact O-N 3.11Å; I196-V198 PolarHBondContact O-N 2.94Å; I196-A199 PolarHBondContact O-N 3.19Å; I196-I200 HydrophobicContact CG2-CD1 3.89Å; I196-I200 WeakPolarHBondContact O-CD1 3.31Å; I196-I200 VanDerWaalsContact O-CG1 3.3Å; I196-I200 WeakPolarHBondContact O-CG1 3.15Å; I196-I200 PolarHBondContact O-N 2.91Å; I196-I200 VanDerWaalsContact O-N 3.17Å; I196-V211 HydrophobicContact CB-CG1 4.36Å; I196-V211 HydrophobicContact CG2-CG1 4.11Å; I196-V211 HydrophobicContact CG2-CG2 3.99Å; I196-I213 HydrophobicContact CD1-CD1 4.03Å
197	A	98.5	Very high	96.5	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-61.2	-46.7	-179.6	0	0	0	0	0	112	T193 K194 I200 T201 V209 V211 T236 L238	T193-A197 PolarHBondContact O-N 3.02Å; K194-A197 PolarHBondContact O-N 3.32Å; A197-I200 PolarHBondContact O-N 2.82Å; A197-T201 PolarHBondContact O-N 2.88Å; A197-T201 PolarHBondContact O-OG1 3.43Å; A197-V209 HydrophobicContact CB-CG1 4.39Å; A197-V211 HydrophobicContact CB-CB 4.24Å; A197-V211 HydrophobicContact CB-CG2 3.67Å; A197-T236 HydrophobicContact CB-CG2 3.61Å; A197-L238 HydrophobicContact CB-CD1 3.89Å; A197-L238 HydrophobicContact CB-CG 4.45Å
198	V	97.9	Very high	96.5	Very high	42 Å²	42	38.7 Å²	38.7	26%	0.255	20%	0.195	S	C	.	.	H	α-helix	trans	-62.3	-44.9	179.2	169.8	0	0	0	0	111.2	K194 Q195 I196 I200 T201 E202 L238	K194-V198 HydrophobicContact CG-CG2 4.24Å; K194-V198 WeakPolarHBondContact O-CB 3.47Å; K194-V198 VanDerWaalsContact O-CG2 3.32Å; K194-V198 WeakPolarHBondContact O-CG2 3.12Å; K194-V198 PolarHBondContact O-N 3.37Å; Q195-V198 PolarHBondContact O-N 2.92Å; I196-V198 PolarHBondContact O-N 2.94Å; V198-I200 VanDerWaalsContact C-N 3.31Å; V198-I200 PolarHBondContact O-N 3.48Å; V198-T201 WeakPolarHBondContact O-CB 3.29Å; V198-T201 PolarHBondContact O-N 3.28Å; V198-T201 VanDerWaalsContact O-N 3.15Å; V198-E202 HydrophobicContact CG1-CG 4.21Å; V198-E202 WeakPolarHBondContact CG1-OE1 3.19Å; V198-E202 WeakPolarHBondContact O-CG 3.26Å; V198-E202 PolarHBondContact O-N 2.97Å; V198-L238 HydrophobicContact CG2-CD1 4.3Å
199	A	95.6	Very high	96.5	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-59.3	-40.7	178.8	0	0	0	0	0	113.2	I120 I178 Y182 Q195 I196 A203	I120-A199 HydrophobicContact CD1-CB 3.43Å; I120-A199 VanDerWaalsContact CD1-CB 3.43Å; I178-A199 HydrophobicContact CG2-CB 3.89Å; Y182-A199 HydrophobicContact CE2-CB 3.57Å; Q195-A199 VanDerWaalsContact O-CB 3.3Å; Q195-A199 WeakPolarHBondContact O-CB 3.46Å; Q195-A199 PolarHBondContact O-N 3.33Å; I196-A199 PolarHBondContact O-N 3.19Å; A199-A203 WeakPolarHBondContact O-CB 3.23Å; A199-A203 PolarHBondContact O-N 3.13Å
200	I	95.1	Very high	96.5	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-66.5	-43.7	176.7	-64.8	162.7	0	0	0	110.1	I161 L175 I178 I196 A197 V198 E202 A203 L204 V209 V211	I161-I200 HydrophobicContact CD1-CD1 4.1Å; I161-I200 HydrophobicContact CG2-CD1 3.54Å; L175-I200 HydrophobicContact CD2-CD1 3.78Å; L175-I200 HydrophobicContact CD2-CG1 3.88Å; L175-I200 HydrophobicContact CD2-CG2 4.4Å; I178-I200 HydrophobicContact CD1-CG1 3.98Å; I178-I200 HydrophobicContact CG2-CG1 4.45Å; I196-I200 HydrophobicContact CG2-CD1 3.89Å; I196-I200 WeakPolarHBondContact O-CD1 3.31Å; I196-I200 VanDerWaalsContact O-CG1 3.3Å; I196-I200 WeakPolarHBondContact O-CG1 3.15Å; I196-I200 PolarHBondContact O-N 2.91Å; I196-I200 VanDerWaalsContact O-N 3.17Å; A197-I200 PolarHBondContact O-N 2.82Å; V198-I200 VanDerWaalsContact C-N 3.31Å; V198-I200 PolarHBondContact O-N 3.48Å; I200-E202 PolarHBondContact O-N 3.36Å; I200-A203 PolarHBondContact O-N 2.88Å; I200-L204 HydrophobicContact CG2-CD1 4.02Å; I200-L204 PolarHBondContact O-N 3.47Å; I200-V209 HydrophobicContact CB-CG1 4.21Å; I200-V209 HydrophobicContact CB-CG2 4.29Å; I200-V209 HydrophobicContact CD1-CG1 4.23Å; I200-V209 HydrophobicContact CG2-CG1 4.08Å; I200-V209 HydrophobicContact CG2-CG2 3.75Å; I200-V211 HydrophobicContact CD1-CG2 4.41Å
201	T	95.4	Very high	96.5	Very high	45 Å²	45	31.6 Å²	31.6	28%	0.276	16%	0.16	S	C	.	.	H	α-helix	trans	-59.8	-45.8	176.5	-62.1	0	0	0	0	111.7	A197 V198 Q205 V209 L238	A197-T201 PolarHBondContact O-N 2.88Å; A197-T201 PolarHBondContact O-OG1 3.43Å; V198-T201 WeakPolarHBondContact O-CB 3.29Å; V198-T201 PolarHBondContact O-N 3.28Å; V198-T201 VanDerWaalsContact O-N 3.15Å; T201-Q205 VanDerWaalsContact O-CA 3.23Å; T201-Q205 WeakPolarHBondContact O-CA 3.14Å; T201-Q205 PolarHBondContact O-N 3.39Å; T201-V209 WeakPolarHBondContact OG1-CG2 3.19Å; T201-L238 WeakPolarHBondContact OG1-CD1 3.49Å
202	E	91.5	Very high	96.5	Very high	69 Å²	69	27 Å²	27	32%	0.322	14%	0.144	S	C	.	.	H	α-helix	trans	-66.8	-38.7	179.4	-71.6	174.8	170.6	0	0	112.1	W60 V198 I200	W60-E202 WeakPolarHBondContact CH2-OE2 3.41Å; W60-E202 VanDerWaalsContact CZ2-OE2 3.25Å; W60-E202 WeakPolarHBondContact CZ2-OE2 3.37Å; V198-E202 HydrophobicContact CG1-CG 4.21Å; V198-E202 WeakPolarHBondContact CG1-OE1 3.19Å; V198-E202 WeakPolarHBondContact O-CG 3.26Å; V198-E202 PolarHBondContact O-N 2.97Å; I200-E202 PolarHBondContact O-N 3.36Å
203	A	88.6	Confident	96.5	Very high	17 Å²	17	26.9 Å²	26.9	14%	0.14	14%	0.143	C	C	.	.	H	α-helix	trans	-69.2	-43	-179.6	0	0	0	0	0	113.4	L124 A199 I200	L124-A203 HydrophobicContact CD1-CB 3.54Å; L124-A203 HydrophobicContact CD2-CB 3.84Å; L124-A203 HydrophobicContact CG-CB 4.32Å; A199-A203 WeakPolarHBondContact O-CB 3.23Å; A199-A203 PolarHBondContact O-N 3.13Å; I200-A203 PolarHBondContact O-N 2.88Å
204	L	90	Very high	96.5	Very high	2 Å²	2	30 Å²	30	1%	0.01	16%	0.158	C	C	.	.	H	α-helix	trans	-109.1	-21.8	-169.1	-65.3	171.7	0	0	0	114.2	I128 Y163 R168 L170 I200 P206	I128-L204 HydrophobicContact CD1-CD2 4.13Å; I128-L204 HydrophobicContact CG1-CD2 4.03Å; I128-L204 HydrophobicContact CG2-CD2 4.29Å; Y163-L204 HydrophobicContact CD2-CD1 4.24Å; Y163-L204 HydrophobicContact CE2-CD1 3.98Å; R168-L204 PolarHBondContact NH2-O 3.49Å; L170-L204 HydrophobicContact CB-CD1 3.64Å; L170-L204 HydrophobicContact CB-CD2 3.79Å; L170-L204 HydrophobicContact CB-CG 4.22Å; L170-L204 HydrophobicContact CD1-CD2 4.13Å; L170-L204 HydrophobicContact CD2-CD1 4.12Å; L170-L204 HydrophobicContact CG-CD1 4.41Å; L170-L204 HydrophobicContact CG-CD2 4.39Å; I200-L204 HydrophobicContact CG2-CD1 4.02Å; I200-L204 PolarHBondContact O-N 3.47Å; L204-P206 VanDerWaalsContact C-N 3.32Å; L204-P206 HydrophobicContact CB-CG 4.45Å
205	Q	93	Very high	96.5	Very high	132 Å²	132	23.9 Å²	23.9	62%	0.617	13%	0.131	S	C	*	.			trans	46	53.8	-167.2	-55.8	170.7	13.3	0	0	111.8	T201	T201-Q205 VanDerWaalsContact O-CA 3.23Å; T201-Q205 WeakPolarHBondContact O-CA 3.14Å; T201-Q205 PolarHBondContact O-N 3.39Å
206	P	96.1	Very high	96.5	Very high	17 Å²	17	22.8 Å²	22.8	11%	0.11	13%	0.128	C	C	.	.			trans	-72.9	166.9	179.8	35.1	-33.6	0	0	0	110.3	Y163 L164 L204 G208 V209	Y163-P206 HydrophobicContact CD2-CB 4.1Å; L164-P206 CarbonylContact O-C 3.49Å; L164-P206 WeakPolarHBondContact O-CB 3.43Å; L204-P206 VanDerWaalsContact C-N 3.32Å; L204-P206 HydrophobicContact CB-CG 4.45Å; P206-G208 PolarHBondContact O-N 3.32Å; P206-V209 HydrophobicContact CG-CG2 3.39Å
207	A	97.4	Very high	96.5	Very high	48 Å²	48	24 Å²	24	40%	0.397	13%	0.134	S	C	.	.	S	Bend	trans	-63.2	-29.8	172.6	0	0	0	0	0	112	L164 G239 V240	L164-A207 HydrophobicContact CB-CB 4.03Å; L164-A207 PolarHBondContact O-N 3.36Å; A207-G239 WeakPolarHBondContact O-CA 3.32Å; A207-V240 HydrophobicContact CB-CG2 4.04Å; A207-V240 WeakPolarHBondContact O-CG2 3.42Å; A207-V240 PolarHBondContact O-N 2.98Å
208	G	98.1	Very high	96.5	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.01	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169.9	163.3	172.9	0	0	0	0	0	113.1	Y163 L164 P206 L238	Y163-G208 VanDerWaalsContact CA-O 3.26Å; Y163-G208 WeakPolarHBondContact CA-O 3.4Å; Y163-G208 WeakPolarHBondContact CB-O 3.47Å; L164-G208 PolarHBondContact N-O 2.94Å; P206-G208 PolarHBondContact O-N 3.32Å; G208-L238 CarbonylContact C-O 3.47Å; G208-L238 WeakPolarHBondContact CA-O 3.04Å
209	V	98.7	Very high	96.5	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	135.5	178.4	-177.2	0	0	0	0	109.4	G162 A197 I200 T201 P206 V211 M237 L238	G162-V209 CarbonylContact O-C 3.59Å; G162-V209 WeakPolarHBondContact O-CA 3.33Å; A197-V209 HydrophobicContact CB-CG1 4.39Å; I200-V209 HydrophobicContact CB-CG1 4.21Å; I200-V209 HydrophobicContact CB-CG2 4.29Å; I200-V209 HydrophobicContact CD1-CG1 4.23Å; I200-V209 HydrophobicContact CG2-CG1 4.08Å; I200-V209 HydrophobicContact CG2-CG2 3.75Å; T201-V209 WeakPolarHBondContact OG1-CG2 3.19Å; P206-V209 HydrophobicContact CG-CG2 3.39Å; V209-V211 HydrophobicContact CG1-CG2 4.06Å; V209-M237 CarbonylContact O-C 3.56Å; V209-M237 WeakPolarHBondContact O-CA 3.35Å; V209-L238 PolarHBondContact N-O 3.31Å; V209-L238 PolarHBondContact O-N 3.06Å
210	G	98.8	Very high	96.6	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	129.6	167.6	0	0	0	0	0	110.8	I161 G162 M237	I161-G210 WeakPolarHBondContact CA-O 3.42Å; G162-G210 PolarHBondContact N-O 3.13Å; G162-G210 PolarHBondContact O-N 3.13Å; G210-M237 VanDerWaalsContact CA-SD 3.55Å
211	V	98.9	Very high	96.7	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	130.8	172.7	-179	0	0	0	0	108.8	V159 H160 I161 T193 I196 A197 I200 V209 I213 S235 T236	V159-V211 HydrophobicContact CG1-CG1 3.93Å; H160-V211 WeakPolarHBondContact O-CA 3.34Å; I161-V211 HydrophobicContact CG1-CG2 4.48Å; I161-V211 HydrophobicContact CG2-CG2 4.44Å; T193-V211 HydrophobicContact CG2-CB 4.32Å; T193-V211 HydrophobicContact CG2-CG1 4.03Å; I196-V211 HydrophobicContact CB-CG1 4.36Å; I196-V211 HydrophobicContact CG2-CG1 4.11Å; I196-V211 HydrophobicContact CG2-CG2 3.99Å; A197-V211 HydrophobicContact CB-CB 4.24Å; A197-V211 HydrophobicContact CB-CG2 3.67Å; I200-V211 HydrophobicContact CD1-CG2 4.41Å; V209-V211 HydrophobicContact CG1-CG2 4.06Å; V211-I213 HydrophobicContact CG1-CG1 4.32Å; V211-S235 CarbonylContact O-C 3.54Å; V211-S235 WeakPolarHBondContact O-CA 3.28Å; V211-T236 PolarHBondContact N-O 3.3Å; V211-T236 PolarHBondContact O-N 3.03Å
212	V	98.9	Very high	96.8	Very high	11 Å²	11	32.3 Å²	32.3	7%	0.067	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	132.3	172.5	179	0	0	0	0	108.6	V159 H160 V233 T234 M237 F251 L252 I255	V159-V212 WeakPolarHBondContact CA-O 3.47Å; H160-V212 HydrophobicContact CB-CB 4.44Å; H160-V212 PolarHBondContact N-O 3.41Å; H160-V212 PolarHBondContact O-N 3.01Å; V212-V233 HydrophobicContact CG1-CG1 3.92Å; V212-T234 CarbonylContact C-O 3.57Å; V212-T234 WeakPolarHBondContact CA-O 3.2Å; V212-M237 HydrophobicContact CG2-CE 4.25Å; V212-F251 HydrophobicContact CG2-CE1 3.75Å; V212-F251 HydrophobicContact CG2-CZ 4.12Å; V212-L252 HydrophobicContact CG2-CD2 3.95Å; V212-I255 HydrophobicContact CB-CD1 3.96Å; V212-I255 HydrophobicContact CG1-CD1 4.23Å; V212-I255 HydrophobicContact CG2-CD1 3.78Å
213	I	98.9	Very high	97.1	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	126.5	172.8	-54.5	-168.7	0	0	0	108.4	M144 R158 V159 Q189 L192 T193 I196 V211 A215 V233 T234	M144-I213 HydrophobicContact CE-CG2 3.61Å; R158-I213 WeakPolarHBondContact O-CA 3.21Å; V159-I213 HydrophobicContact CB-CG1 4.46Å; V159-I213 HydrophobicContact CG1-CG1 4.13Å; V159-I213 HydrophobicContact CG2-CD1 3.99Å; V159-I213 HydrophobicContact CG2-CG1 3.92Å; V159-I213 HydrophobicContact CG2-CG2 4.4Å; Q189-I213 HydrophobicContact CG-CB 4.45Å; Q189-I213 HydrophobicContact CG-CG2 4.07Å; Q189-I213 PolarHBondContact NE2-O 3.37Å; Q189-I213 VanDerWaalsContact NE2-O 3.13Å; L192-I213 HydrophobicContact CD2-CD1 4.02Å; L192-I213 HydrophobicContact CG-CD1 3.8Å; T193-I213 HydrophobicContact CG2-CD1 4.48Å; T193-I213 HydrophobicContact CG2-CG1 4.2Å; T193-I213 WeakPolarHBondContact OG1-CD1 3.31Å; I196-I213 HydrophobicContact CD1-CD1 4.03Å; V211-I213 HydrophobicContact CG1-CG1 4.32Å; I213-A215 HydrophobicContact CG2-CB 4.26Å; I213-V233 CarbonylContact O-C 3.57Å; I213-V233 VanDerWaalsContact O-CA 3.28Å; I213-V233 WeakPolarHBondContact O-CA 3.24Å; I213-T234 PolarHBondContact N-O 3.28Å; I213-T234 PolarHBondContact O-N 3.49Å
214	E	98.7	Very high	97.4	Very high	67 Å²	67	36.4 Å²	36.4	31%	0.313	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	119.3	167.6	178.2	-177.9	163.7	0	0	108.3	G157 R158 K231 T232 V233	G157-E214 CarbonylContact C-O 3.57Å; G157-E214 VanDerWaalsContact CA-O 3.22Å; G157-E214 WeakPolarHBondContact CA-O 3.42Å; R158-E214 PolarHBondContact N-O 3.19Å; R158-E214 PolarHBondContact O-N 2.94Å; E214-K231 HydrophobicContact CG-CB 4.39Å; E214-K231 HydrophobicContact CG-CD 4Å; E214-K231 WeakPolarHBondContact OE1-CD 3.27Å; E214-K231 WeakPolarHBondContact OE1-CE 3.45Å; E214-K231 IonicContact OE1-NZ 2.84Å; E214-K231 PolarHBondContact OE1-NZ 3.43Å; E214-T232 WeakPolarHBondContact CA-O 3.37Å; E214-V233 HydrophobicContact CB-CG2 4.18Å; E214-V233 HydrophobicContact CG-CG2 4Å
215	A	98.6	Very high	97.7	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.008	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	153.7	-176	0	0	0	0	0	114.4	M144 I155 F156 I213 T232	M144-A215 HydrophobicContact CE-CB 4.07Å; I155-A215 HydrophobicContact CG2-CB 3.7Å; F156-A215 CarbonylContact O-C 3.57Å; F156-A215 WeakPolarHBondContact O-CA 3.47Å; F156-A215 WeakPolarHBondContact O-CB 3.27Å; I213-A215 HydrophobicContact CG2-CB 4.26Å; A215-T232 PolarHBondContact N-O 2.96Å; A215-T232 PolarHBondContact O-N 3.18Å
216	T	98.7	Very high	97.9	Very high	27 Å²	27	40.4 Å²	40.4	17%	0.166	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	134.8	171.7	-57.3	0	0	0	0	109.2	I155 F156 V221	I155-T216 WeakPolarHBondContact CA-O 3.45Å; F156-T216 HydrophobicContact CZ-CG2 4.17Å; F156-T216 PolarHBondContact N-O 3.48Å; F156-T216 PolarHBondContact O-N 3.25Å; T216-V221 HydrophobicContact CG2-CG2 3.63Å
217	H	98.7	Very high	97.9	Very high	25 Å²	25	45.7 Å²	45.7	12%	0.116	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	112.4	-178.7	-72.1	-113.2	0	0	0	109.6	Q189 C219 M220 V221	Q189-H217 PolarHBondContact OE1-NE2 3.06Å; H217-C219 PolarHBondContact O-N 3.24Å; H217-C219 VanDerWaalsContact O-N 3.14Å; H217-M220 HydrophobicContact CB-CB 4.44Å; H217-M220 HydrophobicContact CB-CG 4.21Å; H217-M220 HydrophobicContact CB-SD 4.34Å; H217-M220 PolarHBondContact O-N 3.49Å; H217-V221 PolarHBondContact O-N 3.01Å
218	M	98.4	Very high	97.7	Very high	46 Å²	46	49.7 Å²	49.7	23%	0.227	26%	0.258	C	S	.	.	H	α-helix	trans	-63.2	-25.6	-178.9	-72.7	-61.4	-73.3	0	0	112.1	V153 P154 F156 M220 V221 M222	V153-M218 HydrophobicContact CG1-CB 3.34Å; P154-M218 HydrophobicContact CB-CG 4.23Å; P154-M218 WeakPolarHBondContact O-CB 3.29Å; P154-M218 PolarHBondContact O-N 3.39Å; F156-M218 HydrophobicContact CD1-CG 4.34Å; F156-M218 HydrophobicContact CE1-CG 3.7Å; F156-M218 HydrophobicContact CE1-SD 3.8Å; F156-M218 HydrophobicContact CZ-SD 4.34Å; M218-M220 PolarHBondContact O-N 3.14Å; M218-V221 PolarHBondContact O-N 2.85Å; M218-V221 VanDerWaalsContact O-N 3.14Å; M218-V221 HydrophobicContact SD-CB 4.19Å; M218-V221 HydrophobicContact SD-CG1 4.3Å; M218-M222 HydrophobicContact CB-SD 4.1Å; M218-M222 HydrophobicContact CE-CB 3.91Å; M218-M222 HydrophobicContact CE-CG 4.27Å; M218-M222 HydrophobicContact CE-SD 3.81Å; M218-M222 VanDerWaalsContact O-CG 3.3Å; M218-M222 WeakPolarHBondContact O-CG 3.41Å; M218-M222 PolarHBondContact O-N 3.29Å
219	C	97.8	Very high	97.6	Very high	18 Å²	18	57 Å²	57	12%	0.122	30%	0.297	C	S	.	.	H	α-helix	trans	-63.1	-18.7	172.7	64.2	0	0	0	0	114.2	H151 V153 H217 R223	H151-C219 HydrophobicContact CB-CB 4.35Å; V153-C219 HydrophobicContact CG1-CB 4.34Å; H217-C219 PolarHBondContact O-N 3.24Å; H217-C219 VanDerWaalsContact O-N 3.14Å; C219-R223 WeakPolarHBondContact O-CG 3.34Å
220	M	98.1	Very high	97.4	Very high	62 Å²	62	58.9 Å²	58.9	31%	0.305	31%	0.31	S	S	.	.	H	α-helix	trans	-99.5	-21.6	173	-64.5	-178	67.4	0	0	113.3	H217 M218 V225 Q226 K227	H217-M220 HydrophobicContact CB-CB 4.44Å; H217-M220 HydrophobicContact CB-CG 4.21Å; H217-M220 HydrophobicContact CB-SD 4.34Å; H217-M220 PolarHBondContact O-N 3.49Å; M218-M220 PolarHBondContact O-N 3.14Å; M220-V225 HydrophobicContact CB-CG2 4.21Å; M220-V225 HydrophobicContact CE-CG2 4.25Å; M220-V225 HydrophobicContact CG-CG2 4.5Å; M220-Q226 CarbonylContact O-C 3.57Å; M220-Q226 WeakPolarHBondContact O-CA 3.09Å; M220-Q226 PolarHBondContact O-N 2.98Å; M220-K227 PolarHBondContact O-N 2.88Å
221	V	97.9	Very high	97.4	Very high	16 Å²	16	64.7 Å²	64.7	10%	0.097	34%	0.335	C	S	.	.	H	α-helix	trans	-92.6	-55.9	-174.4	175.3	0	0	0	0	111.5	T216 H217 M218 Q226 M228	T216-V221 HydrophobicContact CG2-CG2 3.63Å; H217-V221 PolarHBondContact O-N 3.01Å; M218-V221 PolarHBondContact O-N 2.85Å; M218-V221 VanDerWaalsContact O-N 3.14Å; M218-V221 HydrophobicContact SD-CB 4.19Å; M218-V221 HydrophobicContact SD-CG1 4.3Å; V221-Q226 WeakPolarHBondContact O-CA 3.48Å; V221-M228 HydrophobicContact CG1-CE 3.96Å; V221-M228 HydrophobicContact CG1-SD 3.61Å
222	M	97.2	Very high	97.3	Very high	119 Å²	119	66.8 Å²	66.8	59%	0.586	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-10.2	-172.6	77.7	-169.6	-79	0	0	113.8	V153 M218	V153-M222 HydrophobicContact CG1-SD 4.32Å; M218-M222 HydrophobicContact CB-SD 4.1Å; M218-M222 HydrophobicContact CE-CB 3.91Å; M218-M222 HydrophobicContact CE-CG 4.27Å; M218-M222 HydrophobicContact CE-SD 3.81Å; M218-M222 VanDerWaalsContact O-CG 3.3Å; M218-M222 WeakPolarHBondContact O-CG 3.41Å; M218-M222 PolarHBondContact O-N 3.29Å
223	R	97.1	Very high	97.3	Very high	111 Å²	111	70.6 Å²	70.6	42%	0.419	37%	0.371	S	S	.	.	S	Bend	trans	-150.8	176.8	-179.4	66	172.1	-73.5	-95.8	7.7	111.1	H151 C219 V225 Q226	H151-R223 PolarHBondContact CD2-NH1 3.47Å; H151-R223 PolarHBondContact NE2-NH1 3.21Å; C219-R223 WeakPolarHBondContact O-CG 3.34Å; R223-V225 PolarHBondContact O-N 2.81Å; R223-Q226 PolarHBondContact O-N 3.33Å
224	G	96.4	Very high	97.3	Very high	62 Å²	62	71.5 Å²	71.5	64%	0.639	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.7	-118.1	176.1	0	0	0	0	0	111.4	Q226	G224-Q226 VanDerWaalsContact C-N 3.32Å; G224-Q226 PolarHBondContact O-N 3.4Å
225	V	96.3	Very high	97.3	Very high	87 Å²	87	71.8 Å²	71.8	53%	0.527	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-14.1	-176.1	-63.5	0	0	0	0	114.9	M220 R223 K227	M220-V225 HydrophobicContact CB-CG2 4.21Å; M220-V225 HydrophobicContact CE-CG2 4.25Å; M220-V225 HydrophobicContact CG-CG2 4.5Å; R223-V225 PolarHBondContact O-N 2.81Å; V225-K227 HydrophobicContact CB-CG 4.3Å; V225-K227 HydrophobicContact CG2-CG 4.07Å; V225-K227 WeakPolarHBondContact O-CE 3.25Å; V225-K227 PolarHBondContact O-N 2.93Å
226	Q	95.8	Very high	97.4	Very high	130 Å²	130	73 Å²	73	61%	0.607	39%	0.394	S	S	*	.			trans	50.3	50.9	173.8	-59.3	-179.4	-78.8	0	0	114.6	M220 V221 R223 G224	M220-Q226 CarbonylContact O-C 3.57Å; M220-Q226 WeakPolarHBondContact O-CA 3.09Å; M220-Q226 PolarHBondContact O-N 2.98Å; V221-Q226 WeakPolarHBondContact O-CA 3.48Å; R223-Q226 PolarHBondContact O-N 3.33Å; G224-Q226 VanDerWaalsContact C-N 3.32Å; G224-Q226 PolarHBondContact O-N 3.4Å
227	K	96.9	Very high	97.3	Very high	128 Å²	128	72.9 Å²	72.9	56%	0.557	39%	0.391	S	S	*	.			trans	-98.3	91.3	179.5	-59.2	-54.7	177.2	-169.8	0	111.1	M220 V225 N229 S230	M220-K227 PolarHBondContact O-N 2.88Å; V225-K227 HydrophobicContact CB-CG 4.3Å; V225-K227 HydrophobicContact CG2-CG 4.07Å; V225-K227 WeakPolarHBondContact O-CE 3.25Å; V225-K227 PolarHBondContact O-N 2.93Å; K227-N229 VanDerWaalsContact C-N 3.27Å; K227-N229 PolarHBondContact O-N 3.42Å; K227-S230 WeakPolarHBondContact O-CB 3.43Å; K227-S230 PolarHBondContact O-N 2.7Å; K227-S230 VanDerWaalsContact O-N 3.13Å
228	M	93.1	Very high	97.3	Very high	132 Å²	132	73.6 Å²	73.6	65%	0.65	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	-39.3	-174.9	-64.5	-58.6	-61.9	0	0	114.8	V221	V221-M228 HydrophobicContact CG1-CE 3.96Å; V221-M228 HydrophobicContact CG1-SD 3.61Å
229	N	95.4	Very high	97.3	Very high	154 Å²	154	72.8 Å²	72.8	82%	0.824	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.6	3.3	-173.5	-57.7	-27.4	0	0	0	113	K227 K231	K227-N229 VanDerWaalsContact C-N 3.27Å; K227-N229 PolarHBondContact O-N 3.42Å; N229-K231 PolarHBondContact O-N 2.64Å
230	S	95.6	Very high	97.3	Very high	40 Å²	40	74 Å²	74	28%	0.28	41%	0.406	S	S	.	.			trans	-70.1	129	-178.7	-172.1	0	0	0	0	110	K227	K227-S230 WeakPolarHBondContact O-CB 3.43Å; K227-S230 PolarHBondContact O-N 2.7Å; K227-S230 VanDerWaalsContact O-N 3.13Å
231	K	97.5	Very high	97.4	Very high	123 Å²	123	71 Å²	71	54%	0.535	39%	0.392	S	S	.	.			trans	-127.1	143.5	172.9	-60.8	-168.9	-173.4	-176.8	0	110	E214 N229	E214-K231 HydrophobicContact CG-CB 4.39Å; E214-K231 HydrophobicContact CG-CD 4Å; E214-K231 WeakPolarHBondContact OE1-CD 3.27Å; E214-K231 WeakPolarHBondContact OE1-CE 3.45Å; E214-K231 IonicContact OE1-NZ 2.84Å; E214-K231 PolarHBondContact OE1-NZ 3.43Å; N229-K231 PolarHBondContact O-N 2.64Å
232	T	98.4	Very high	97.4	Very high	43 Å²	43	78.6 Å²	78.6	26%	0.264	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	125.7	176.1	-58.3	0	0	0	0	108.5	Q189 E214 A215 T234	Q189-T232 PolarHBondContact NE2-O 3.39Å; E214-T232 WeakPolarHBondContact CA-O 3.37Å; A215-T232 PolarHBondContact N-O 2.96Å; A215-T232 PolarHBondContact O-N 3.18Å; T232-T234 HydrophobicContact CG2-CG2 4.26Å
233	V	98.7	Very high	97.4	Very high	92 Å²	92	80.4 Å²	80.4	56%	0.558	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.2	126.7	174.1	-175.4	0	0	0	0	108.9	V212 I213 E214	V212-V233 HydrophobicContact CG1-CG1 3.92Å; I213-V233 CarbonylContact O-C 3.57Å; I213-V233 VanDerWaalsContact O-CA 3.28Å; I213-V233 WeakPolarHBondContact O-CA 3.24Å; E214-V233 HydrophobicContact CB-CG2 4.18Å; E214-V233 HydrophobicContact CG-CG2 4Å
234	T	98.9	Very high	97.5	Very high	19 Å²	19	77.7 Å²	77.7	12%	0.117	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	148.3	175.1	50.4	0	0	0	0	109.3	Q189 E190 T193 V212 I213 T232	Q189-T234 HydrophobicContact CB-CG2 4.37Å; Q189-T234 HydrophobicContact CG-CG2 4.04Å; Q189-T234 WeakPolarHBondContact CG-OG1 3.38Å; Q189-T234 PolarHBondContact NE2-OG1 2.82Å; E190-T234 HydrophobicContact CG-CG2 3.98Å; T193-T234 WeakPolarHBondContact OG1-CB 3.34Å; T193-T234 PolarHBondContact OG1-OG1 3.27Å; V212-T234 CarbonylContact C-O 3.57Å; V212-T234 WeakPolarHBondContact CA-O 3.2Å; I213-T234 PolarHBondContact N-O 3.28Å; I213-T234 PolarHBondContact O-N 3.49Å; T232-T234 HydrophobicContact CG2-CG2 4.26Å
235	S	98.8	Very high	97.6	Very high	73 Å²	73	77.8 Å²	77.8	51%	0.51	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	148.2	178.1	62.3	0	0	0	0	112.2	V211	V211-S235 CarbonylContact O-C 3.54Å; V211-S235 WeakPolarHBondContact O-CA 3.28Å
236	T	98.9	Very high	97.7	Very high	26 Å²	26	81.6 Å²	81.6	16%	0.16	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	127.2	168.8	-66	0	0	0	0	109	K194 A197 V211 L238	K194-T236 HydrophobicContact CG-CG2 4.49Å; A197-T236 HydrophobicContact CB-CG2 3.61Å; V211-T236 PolarHBondContact N-O 3.3Å; V211-T236 PolarHBondContact O-N 3.03Å; T236-L238 HydrophobicContact CG2-CD2 4.31Å; T236-L238 HydrophobicContact CG2-CG 4.2Å
237	M	98.6	Very high	97.8	Very high	25 Å²	25	76.1 Å²	76.1	12%	0.123	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	131.1	179.5	-56	-64.2	178.1	0	0	108.9	V209 G210 V212 F241 R242 R248 F251 L252	V209-M237 CarbonylContact O-C 3.56Å; V209-M237 WeakPolarHBondContact O-CA 3.35Å; G210-M237 VanDerWaalsContact CA-SD 3.55Å; V212-M237 HydrophobicContact CG2-CE 4.25Å; M237-F241 HydrophobicContact CB-CB 4.07Å; M237-F241 HydrophobicContact SD-CB 4.05Å; M237-F241 HydrophobicContact SD-CD1 4.04Å; M237-R242 HydrophobicContact CB-CB 4.24Å; M237-R248 HydrophobicContact CE-CG 4.15Å; M237-R248 HydrophobicContact SD-CG 4.44Å; M237-F251 HydrophobicContact CE-CD1 3.87Å; M237-F251 HydrophobicContact CE-CE1 3.79Å; M237-F251 HydrophobicContact SD-CD1 4.26Å; M237-F251 HydrophobicContact SD-CE1 4.24Å; M237-L252 HydrophobicContact CE-CD2 4.01Å; M237-L252 HydrophobicContact CE-CG 4.45Å
238	L	98.6	Very high	97.8	Very high	39 Å²	39	73.3 Å²	73.3	20%	0.204	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	150.7	-179	-59.3	176.8	0	0	0	110.1	A197 V198 T201 G208 V209 T236 F241	A197-L238 HydrophobicContact CB-CD1 3.89Å; A197-L238 HydrophobicContact CB-CG 4.45Å; V198-L238 HydrophobicContact CG2-CD1 4.3Å; T201-L238 WeakPolarHBondContact OG1-CD1 3.49Å; G208-L238 CarbonylContact C-O 3.47Å; G208-L238 WeakPolarHBondContact CA-O 3.04Å; V209-L238 PolarHBondContact N-O 3.31Å; V209-L238 PolarHBondContact O-N 3.06Å; T236-L238 HydrophobicContact CG2-CD2 4.31Å; T236-L238 HydrophobicContact CG2-CG 4.2Å; L238-F241 PolarHBondContact O-N 3.09Å
239	G	98.3	Very high	98.1	Very high	30 Å²	30	71.4 Å²	71.4	31%	0.309	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	57.5	-136.1	-178.5	0	0	0	0	0	112.5	A207 F241 R242 E243	A207-G239 WeakPolarHBondContact O-CA 3.32Å; G239-F241 PolarHBondContact O-N 3.26Å; G239-F241 VanDerWaalsContact O-N 3.1Å; G239-R242 WeakPolarHBondContact O-CA 3.28Å; G239-R242 WeakPolarHBondContact O-CB 3.49Å; G239-R242 PolarHBondContact O-N 2.96Å; G239-E243 PolarHBondContact O-N 2.95Å; G239-E243 VanDerWaalsContact O-N 3.12Å
240	V	97.9	Very high	98.2	Very high	43 Å²	43	68.9 Å²	68.9	26%	0.261	36%	0.355	S	S	.	.	H	α-helix	trans	-54.4	-33.4	-177.2	179.7	0	0	0	0	113	L164 A207 R242 E243 D244 T247	L164-V240 HydrophobicContact CD1-CB 3.97Å; L164-V240 HydrophobicContact CD1-CG1 3.79Å; A207-V240 HydrophobicContact CB-CG2 4.04Å; A207-V240 WeakPolarHBondContact O-CG2 3.42Å; A207-V240 PolarHBondContact O-N 2.98Å; V240-R242 PolarHBondContact O-N 2.88Å; V240-E243 PolarHBondContact O-N 3.25Å; V240-D244 HydrophobicContact CG1-CB 4.01Å; V240-D244 PolarHBondContact O-N 2.89Å; V240-T247 HydrophobicContact CG1-CG2 4.09Å
241	F	98.4	Very high	98.4	Very high	0 Å²	0	67 Å²	67	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-64.2	-26.2	176.2	-77.5	-112.7	0	0	0	113.3	M136 L164 M237 L238 G239 T247 R248 F251	M136-F241 HydrophobicContact CE-CE1 4.23Å; M136-F241 HydrophobicContact CE-CZ 3.92Å; M136-F241 HydrophobicContact CG-CZ 4.04Å; M136-F241 HydrophobicContact SD-CE1 4.23Å; M136-F241 HydrophobicContact SD-CZ 3.94Å; L164-F241 HydrophobicContact CB-CE2 4.37Å; L164-F241 HydrophobicContact CD1-CE2 4.17Å; L164-F241 HydrophobicContact CG-CE2 4.01Å; M237-F241 HydrophobicContact CB-CB 4.07Å; M237-F241 HydrophobicContact SD-CB 4.05Å; M237-F241 HydrophobicContact SD-CD1 4.04Å; L238-F241 PolarHBondContact O-N 3.09Å; G239-F241 PolarHBondContact O-N 3.26Å; G239-F241 VanDerWaalsContact O-N 3.1Å; F241-T247 HydrophobicContact CD2-CG2 4.04Å; F241-T247 HydrophobicContact CE2-CG2 4.08Å; F241-T247 HydrophobicContact CG-CG2 4.27Å; F241-T247 HydrophobicContact CZ-CG2 4.37Å; F241-R248 WeakPolarHBondContact O-CB 3.33Å; F241-R248 PolarHBondContact O-NH1 3.01Å; F241-F251 HydrophobicContact CD1-CB 4.14Å; F241-F251 AromaticContact CD1-CD1 3.94Å; F241-F251 HydrophobicContact CD1-CD1 3.94Å; F241-F251 HydrophobicContact CD1-CG 4.12Å; F241-F251 HydrophobicContact CE1-CB 3.58Å; F241-F251 AromaticContact CE1-CD1 3.79Å; F241-F251 HydrophobicContact CE1-CD1 3.79Å; F241-F251 HydrophobicContact CE1-CD2 4.01Å; F241-F251 HydrophobicContact CE1-CE1 4.45Å; F241-F251 AromaticContact CE1-CG 3.53Å; F241-F251 HydrophobicContact CE1-CG 3.53Å
242	R	98.1	Very high	98.4	Very high	174 Å²	174	63.5 Å²	63.5	66%	0.657	33%	0.329	S	S	*	.	H	α-helix	trans	-85.9	-43.6	176.3	-173.1	174.1	-178.6	156.5	-0.8	111.1	M237 G239 V240 R248	M237-R242 HydrophobicContact CB-CB 4.24Å; G239-R242 WeakPolarHBondContact O-CA 3.28Å; G239-R242 WeakPolarHBondContact O-CB 3.49Å; G239-R242 PolarHBondContact O-N 2.96Å; V240-R242 PolarHBondContact O-N 2.88Å; R242-R248 PolarHBondContact O-NH1 3.46Å
243	E	98.3	Very high	98.4	Very high	157 Å²	157	65.9 Å²	65.9	73%	0.734	34%	0.343	S	S	*	.	H	α-helix	trans	-82.2	-39.4	-169.8	-66	171.6	-171.1	0	0	113	G239 V240 P245	G239-E243 PolarHBondContact O-N 2.95Å; G239-E243 VanDerWaalsContact O-N 3.12Å; V240-E243 PolarHBondContact O-N 3.25Å; E243-P245 WeakPolarHBondContact O-CD 3.48Å
244	D	98.4	Very high	98.4	Very high	55 Å²	55	65 Å²	65	29%	0.294	34%	0.336	S	S	.	.			trans	-101.7	112.5	178.5	-175	8.1	0	0	0	111.5	V240 K246 T247 R248	V240-D244 HydrophobicContact CG1-CB 4.01Å; V240-D244 PolarHBondContact O-N 2.89Å; D244-K246 VanDerWaalsContact C-N 3.25Å; D244-K246 PolarHBondContact O-N 3.36Å; D244-K246 WeakPolarHBondContact OD1-CB 3.24Å; D244-K246 PolarHBondContact OD1-N 3.02Å; D244-T247 PolarHBondContact OD2-OG1 3.19Å; D244-R248 PolarHBondContact O-N 3.43Å
245	P	97.9	Very high	98.3	Very high	64 Å²	64	65.1 Å²	65.1	42%	0.416	34%	0.335	S	S	.	.	H	α-helix	trans	-58.6	-33	173.1	-22.4	33.6	0	0	0	113.9	E243 R248 D249	E243-P245 WeakPolarHBondContact O-CD 3.48Å; P245-R248 PolarHBondContact O-N 2.77Å; P245-D249 WeakPolarHBondContact O-CB 3.29Å; P245-D249 PolarHBondContact O-N 3.04Å
246	K	98.3	Very high	97.9	Very high	166 Å²	166	71.5 Å²	71.5	72%	0.722	35%	0.348	S	S	*	.	H	α-helix	trans	-67.1	-48.2	-176.1	-65.9	177.8	-179.2	176.2	0	111.4	D244 R248 D249 E250	D244-K246 VanDerWaalsContact C-N 3.25Å; D244-K246 PolarHBondContact O-N 3.36Å; D244-K246 WeakPolarHBondContact OD1-CB 3.24Å; D244-K246 PolarHBondContact OD1-N 3.02Å; K246-R248 VanDerWaalsContact C-N 3.28Å; K246-R248 PolarHBondContact O-N 2.86Å; K246-D249 PolarHBondContact O-N 3.46Å; K246-E250 WeakPolarHBondContact O-CB 3.31Å; K246-E250 PolarHBondContact O-N 3.31Å
247	T	98.1	Very high	95.8	Very high	16 Å²	16	76.5 Å²	76.5	10%	0.098	38%	0.384	C	S	.	.	H	α-helix	trans	-57.1	-42.8	172.7	-58.5	0	0	0	0	111.6	M136 L164 V240 F241 D244 F251	M136-T247 HydrophobicContact CE-CG2 3.66Å; M136-T247 WeakPolarHBondContact CE-O 3.19Å; L164-T247 HydrophobicContact CD1-CG2 3.65Å; V240-T247 HydrophobicContact CG1-CG2 4.09Å; F241-T247 HydrophobicContact CD2-CG2 4.04Å; F241-T247 HydrophobicContact CE2-CG2 4.08Å; F241-T247 HydrophobicContact CG-CG2 4.27Å; F241-T247 HydrophobicContact CZ-CG2 4.37Å; D244-T247 PolarHBondContact OD2-OG1 3.19Å; T247-F251 PolarHBondContact O-N 3.48Å
248	R	98.5	Very high	95.7	Very high	69 Å²	69	79.1 Å²	79.1	26%	0.26	40%	0.397	S	S	.	.	H	α-helix	trans	-63.8	-43.9	178.2	-176.7	170.9	54.8	-110.5	2.7	112.2	M237 F241 R242 D244 P245 K246 F251 L252	M237-R248 HydrophobicContact CE-CG 4.15Å; M237-R248 HydrophobicContact SD-CG 4.44Å; F241-R248 WeakPolarHBondContact O-CB 3.33Å; F241-R248 PolarHBondContact O-NH1 3.01Å; R242-R248 PolarHBondContact O-NH1 3.46Å; D244-R248 PolarHBondContact O-N 3.43Å; P245-R248 PolarHBondContact O-N 2.77Å; K246-R248 VanDerWaalsContact C-N 3.28Å; K246-R248 PolarHBondContact O-N 2.86Å; R248-F251 PolarHBondContact O-N 3.37Å; R248-L252 HydrophobicContact CG-CD1 4.06Å; R248-L252 HydrophobicContact CG-CG 4.4Å; R248-L252 WeakPolarHBondContact O-CB 3.47Å; R248-L252 VanDerWaalsContact O-CG 3.3Å; R248-L252 WeakPolarHBondContact O-CG 3.26Å; R248-L252 PolarHBondContact O-N 2.94Å
249	D	98.3	Very high	95.5	Very high	92 Å²	92	81.2 Å²	81.2	49%	0.492	41%	0.407	S	S	.	.	H	α-helix	trans	-68.6	-38.1	-178.9	-70.3	-14.5	0	0	0	111.6	P245 K246 L252 T253	P245-D249 WeakPolarHBondContact O-CB 3.29Å; P245-D249 PolarHBondContact O-N 3.04Å; K246-D249 PolarHBondContact O-N 3.46Å; D249-L252 PolarHBondContact O-N 3.32Å; D249-T253 WeakPolarHBondContact O-CB 3.47Å; D249-T253 PolarHBondContact O-N 3.06Å; D249-T253 PolarHBondContact O-OG1 3.16Å
250	E	98.4	Very high	95.4	Very high	101 Å²	101	84.1 Å²	84.1	47%	0.472	41%	0.413	S	S	.	.	H	α-helix	trans	-56.9	-53.3	171	-176.5	-175	154.8	0	0	110.8	M136 K246 L252 T253 L254	M136-E250 HydrophobicContact CE-CB 4.34Å; M136-E250 HydrophobicContact CE-CG 4.28Å; K246-E250 WeakPolarHBondContact O-CB 3.31Å; K246-E250 PolarHBondContact O-N 3.31Å; E250-L252 PolarHBondContact O-N 2.94Å; E250-T253 WeakPolarHBondContact O-CB 3.37Å; E250-T253 PolarHBondContact O-N 3.05Å; E250-T253 VanDerWaalsContact O-N 3.16Å; E250-L254 HydrophobicContact CG-CD1 3.91Å; E250-L254 WeakPolarHBondContact O-CG 3.34Å; E250-L254 PolarHBondContact O-N 3.06Å
251	F	98.6	Very high	95.2	Very high	0 Å²	0	86.5 Å²	86.5	0%	0	42%	0.422	C	S	.	.	H	α-helix	trans	-56.5	-51	177.5	168.7	-123.2	0	0	0	112.6	M136 I138 V212 M237 F241 T247 R248 T253 L254 I255	M136-F251 HydrophobicContact CE-CB 4.04Å; M136-F251 HydrophobicContact SD-CB 3.8Å; M136-F251 HydrophobicContact SD-CD2 4.3Å; M136-F251 HydrophobicContact SD-CG 4.5Å; I138-F251 HydrophobicContact CD1-CD2 4Å; I138-F251 HydrophobicContact CG1-CD2 4.24Å; V212-F251 HydrophobicContact CG2-CE1 3.75Å; V212-F251 HydrophobicContact CG2-CZ 4.12Å; M237-F251 HydrophobicContact CE-CD1 3.87Å; M237-F251 HydrophobicContact CE-CE1 3.79Å; M237-F251 HydrophobicContact SD-CD1 4.26Å; M237-F251 HydrophobicContact SD-CE1 4.24Å; F241-F251 HydrophobicContact CD1-CB 4.14Å; F241-F251 AromaticContact CD1-CD1 3.94Å; F241-F251 HydrophobicContact CD1-CD1 3.94Å; F241-F251 HydrophobicContact CD1-CG 4.12Å; F241-F251 HydrophobicContact CE1-CB 3.58Å; F241-F251 AromaticContact CE1-CD1 3.79Å; F241-F251 HydrophobicContact CE1-CD1 3.79Å; F241-F251 HydrophobicContact CE1-CD2 4.01Å; F241-F251 HydrophobicContact CE1-CE1 4.45Å; F241-F251 AromaticContact CE1-CG 3.53Å; F241-F251 HydrophobicContact CE1-CG 3.53Å; T247-F251 PolarHBondContact O-N 3.48Å; R248-F251 PolarHBondContact O-N 3.37Å; F251-T253 PolarHBondContact O-N 2.69Å; F251-L254 PolarHBondContact O-N 3.34Å; F251-I255 HydrophobicContact CD2-CG2 3.82Å; F251-I255 HydrophobicContact CE1-CD1 4.4Å; F251-I255 HydrophobicContact CE2-CG2 3.43Å; F251-I255 VanDerWaalsContact CE2-CG2 3.43Å; F251-I255 HydrophobicContact CZ-CD1 4.22Å; F251-I255 HydrophobicContact CZ-CG2 4.07Å; F251-I255 WeakPolarHBondContact O-CG2 3.48Å; F251-I255 PolarHBondContact O-N 3.5Å; F251-I255 VanDerWaalsContact O-N 3.16Å
252	L	98.2	Very high	95	Very high	50 Å²	50	91.9 Å²	91.9	26%	0.262	45%	0.448	S	S	.	.	H	α-helix	trans	-63.8	-27.1	-178.9	-69.5	178.9	0	0	0	112.5	V212 M237 R248 D249 E250 I255 R256	V212-L252 HydrophobicContact CG2-CD2 3.95Å; M237-L252 HydrophobicContact CE-CD2 4.01Å; M237-L252 HydrophobicContact CE-CG 4.45Å; R248-L252 HydrophobicContact CG-CD1 4.06Å; R248-L252 HydrophobicContact CG-CG 4.4Å; R248-L252 WeakPolarHBondContact O-CB 3.47Å; R248-L252 VanDerWaalsContact O-CG 3.3Å; R248-L252 WeakPolarHBondContact O-CG 3.26Å; R248-L252 PolarHBondContact O-N 2.94Å; D249-L252 PolarHBondContact O-N 3.32Å; E250-L252 PolarHBondContact O-N 2.94Å; L252-I255 HydrophobicContact CD2-CD1 4.02Å; L252-I255 WeakPolarHBondContact O-CG1 3.46Å; L252-R256 WeakPolarHBondContact O-CD 3.46Å; L252-R256 WeakPolarHBondContact O-CG 3.26Å
253	T	98.1	Very high	94.8	Very high	92 Å²	92	86.4 Å²	86.4	56%	0.564	43%	0.434	S	S	*	.	H	α-helix	trans	-74.6	-44.9	174.5	-58.5	0	0	0	0	111	D249 E250 F251 I255 R256	D249-T253 WeakPolarHBondContact O-CB 3.47Å; D249-T253 PolarHBondContact O-N 3.06Å; D249-T253 PolarHBondContact O-OG1 3.16Å; E250-T253 WeakPolarHBondContact O-CB 3.37Å; E250-T253 PolarHBondContact O-N 3.05Å; E250-T253 VanDerWaalsContact O-N 3.16Å; F251-T253 PolarHBondContact O-N 2.69Å; T253-I255 VanDerWaalsContact C-N 3.31Å; T253-I255 PolarHBondContact O-N 3.31Å; T253-R256 PolarHBondContact O-N 3.08Å
254	L	97.8	Very high	94.6	Very high	75 Å²	75	81.4 Å²	81.4	39%	0.393	41%	0.413	S	S	.	.	H	α-helix	trans	-68.4	-26	-176.7	-69.9	172.4	0	0	0	113.9	I138 K140 E250 F251 S257	I138-L254 HydrophobicContact CD1-CB 3.5Å; I138-L254 HydrophobicContact CD1-CD1 3.55Å; I138-L254 HydrophobicContact CD1-CG 4.18Å; K140-L254 PolarHBondContact NZ-O 2.84Å; E250-L254 HydrophobicContact CG-CD1 3.91Å; E250-L254 WeakPolarHBondContact O-CG 3.34Å; E250-L254 PolarHBondContact O-N 3.06Å; F251-L254 PolarHBondContact O-N 3.34Å; L254-S257 PolarHBondContact O-OG 3.38Å
255	I	97.4	Very high	94.3	Very high	20 Å²	20	83.4 Å²	83.4	10%	0.103	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-6.5	177.6	66.7	174.1	0	0	0	114.2	I138 H160 V212 F251 L252 T253	I138-I255 HydrophobicContact CG2-CG2 4.09Å; H160-I255 HydrophobicContact CB-CB 4.11Å; H160-I255 HydrophobicContact CB-CD1 4.2Å; H160-I255 HydrophobicContact CB-CG2 3.81Å; V212-I255 HydrophobicContact CB-CD1 3.96Å; V212-I255 HydrophobicContact CG1-CD1 4.23Å; V212-I255 HydrophobicContact CG2-CD1 3.78Å; F251-I255 HydrophobicContact CD2-CG2 3.82Å; F251-I255 HydrophobicContact CE1-CD1 4.4Å; F251-I255 HydrophobicContact CE2-CG2 3.43Å; F251-I255 VanDerWaalsContact CE2-CG2 3.43Å; F251-I255 HydrophobicContact CZ-CD1 4.22Å; F251-I255 HydrophobicContact CZ-CG2 4.07Å; F251-I255 WeakPolarHBondContact O-CG2 3.48Å; F251-I255 PolarHBondContact O-N 3.5Å; F251-I255 VanDerWaalsContact O-N 3.16Å; L252-I255 HydrophobicContact CD2-CD1 4.02Å; L252-I255 WeakPolarHBondContact O-CG1 3.46Å; T253-I255 VanDerWaalsContact C-N 3.31Å; T253-I255 PolarHBondContact O-N 3.31Å
256	R	90.5	Very high	94	Very high	208 Å²	208	85 Å²	85	79%	0.785	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-12.6	179.8	-75	173.7	-178.7	-179.5	2.6	114.3	L252 T253	L252-R256 WeakPolarHBondContact O-CD 3.46Å; L252-R256 WeakPolarHBondContact O-CG 3.26Å; T253-R256 PolarHBondContact O-N 3.08Å
257	S	55.5	Low	93.6	Very high	131 Å²	131	77.6 Å²	77.6	92%	0.916	40%	0.395	S	S	*	.			trans	-90.3	0	-176.1	53	0	0	0	0	114.6	K140 L254	K140-S257 PolarHBondContact NZ-O 2.97Å; K140-S257 PolarHBondContact NZ-OG 3.28Å; L254-S257 PolarHBondContact O-OG 3.38Å

Retrieved 257 of 257 residues in 1574.9 ms (Link to these results)

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