A0A060Y3N2_ONCMY Loading...

Glutathione peroxidase

AlphaFold DB , UniProt , Accession A0A060Y3N2, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110525174, Length 262 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	33.9	Very low	38.7	Very low	236 Å²	236	140.5 Å²	140.5	100%	1.163	79%	0.79	S	S	*	*				0	144.6	0	-71.2	-177.9	172	0	0	107.9
2	P	57.1	Low	38.3	Very low	119 Å²	119	146.5 Å²	146.5	77%	0.773	79%	0.792	S	S	*	*			cis	-78.9	178.6	-22.3	38.2	-34.4	0	0	0	109.6
3	N	34.9	Very low	38	Very low	138 Å²	138	153.8 Å²	153.8	74%	0.738	80%	0.801	S	S	*	*			cis	65.6	143.3	34.9	-65.3	21.1	0	0	0	112.3
4	T	46.7	Very low	37.8	Very low	115 Å²	115	153 Å²	153	71%	0.706	80%	0.797	S	S	*	*			cis	-130.5	138.3	25.1	35.2	0	0	0	0	112.3
5	E	37.1	Very low	38.1	Very low	143 Å²	143	154 Å²	154	67%	0.668	80%	0.803	S	S	*	*				72.3	119.3	93.5	-60.4	-170.4	99.4	0	0	118.7
6	Q	35.6	Very low	38	Very low	160 Å²	160	152.6 Å²	152.6	75%	0.748	80%	0.803	S	S	*	*				59.2	135.9	127.2	-60.4	-164.2	37.3	0	0	119.8
7	T	37.5	Very low	38.1	Very low	143 Å²	143	149.9 Å²	149.9	88%	0.877	80%	0.799	S	S	*	*				-143.7	165.3	68.5	35.4	0	0	0	0	114.6
8	S	34.3	Very low	38.1	Very low	104 Å²	104	150.4 Å²	150.4	73%	0.727	80%	0.801	S	S	*	*			trans	-121.6	155.6	178.4	102.6	0	0	0	0	111.2
9	S	35.4	Very low	37.9	Very low	119 Å²	119	149 Å²	149	83%	0.832	80%	0.803	S	S	*	*			trans	-142.3	137.4	152.9	-167	0	0	0	0	111.3
10	K	37.7	Very low	37.6	Very low	192 Å²	192	146.9 Å²	146.9	84%	0.835	81%	0.807	S	S	*	*			trans	-133.1	127.4	177.6	-74.1	175.8	178.3	169.3	0	109.3
11	A	35.4	Very low	37.5	Very low	76 Å²	76	151.3 Å²	151.3	63%	0.628	81%	0.812	S	S	*	*			trans	-143.2	126	156.6	0	0	0	0	0	106.2
12	R	34.4	Very low	38.2	Very low	213 Å²	213	146 Å²	146	80%	0.804	80%	0.795	S	S	*	*			cis	58.6	82.7	17.4	-167.3	179.3	-73.6	-147.5	-1.8	113.7
13	W	33.3	Very low	37.2	Very low	241 Å²	241	144.4 Å²	144.4	91%	0.913	79%	0.792	S	S	*	*			trans	-105.1	142.1	151.3	-74.5	99.8	0	0	0	109
14	L	35.8	Very low	37.3	Very low	143 Å²	143	142.7 Å²	142.7	75%	0.749	79%	0.79	S	S	*	*			trans	-112.8	159.6	-176.8	-85.3	167	0	0	0	111.1
15	L	41.8	Very low	36.8	Very low	168 Å²	168	145.7 Å²	145.7	88%	0.88	80%	0.796	S	S	*	*			trans	-70.5	134.8	172.2	-66.5	155.1	0	0	0	111
16	T	37	Very low	36.8	Very low	132 Å²	132	145.1 Å²	145.1	81%	0.81	80%	0.803	S	S	*	*			trans	-144.9	132.8	149.6	-38	0	0	0	0	110.1
17	S	40.3	Very low	36.8	Very low	106 Å²	106	146.1 Å²	146.1	74%	0.741	81%	0.808	S	S	*	*			trans	-104.1	142.2	171.4	-52.9	0	0	0	0	110.7
18	L	37.5	Very low	37.2	Very low	159 Å²	159	145.1 Å²	145.1	83%	0.832	80%	0.803	S	S	*	*			trans	-163	110.9	153.1	-96	128.3	0	0	0	106.8
19	C	33.5	Very low	37.3	Very low	124 Å²	124	145 Å²	145	84%	0.838	80%	0.803	S	S	*	*				76.2	98.2	67.9	-73.9	0	0	0	0	114.7
20	A	33.5	Very low	37.3	Very low	106 Å²	106	145.2 Å²	145.2	88%	0.876	80%	0.804	S	S	*	*			trans	-142	144	152.2	0	0	0	0	0	110
21	R	34	Very low	37	Very low	241 Å²	241	139.9 Å²	139.9	91%	0.909	80%	0.803	S	S	*	*			trans	-131.6	-178.3	179.7	-88.7	-175.2	173.3	-166.3	-0	107.4
22	P	50.3	Low	36.9	Very low	125 Å²	125	141.3 Å²	141.3	81%	0.812	81%	0.809	S	S	*	*			cis	-99.4	-142.3	-10.3	33	-15.2	0	0	0	108.9
23	A	36.1	Very low	36.9	Very low	85 Å²	85	138.9 Å²	138.9	70%	0.702	81%	0.811	S	S	*	*			cis	-159.8	169.5	0.7	0	0	0	0	0	107.2
24	S	35.8	Very low	37.4	Very low	102 Å²	102	133.2 Å²	133.2	71%	0.713	80%	0.803	S	S	*	*			cis	-163.6	-169.4	-9.1	49.7	0	0	0	0	105.8
25	Q	36.3	Very low	37.9	Very low	177 Å²	177	132.3 Å²	132.3	83%	0.827	81%	0.806	S	S	*	*			cis	-128.8	-114.1	10.8	-66.6	-175.5	-27.2	0	0	112.5
26	T	36.8	Very low	37.7	Very low	131 Å²	131	129.5 Å²	129.5	80%	0.804	80%	0.8	S	S	*	*			trans	-140	143.9	-153	39.3	0	0	0	0	114
27	Q	35.8	Very low	38.3	Very low	182 Å²	182	129.2 Å²	129.2	85%	0.85	80%	0.8	S	S	*	*			trans	-72.3	175.8	159.4	-110.6	-176.1	12.3	0	0	110.9
28	P	45.3	Very low	38.1	Very low	121 Å²	121	128.3 Å²	128.3	79%	0.786	80%	0.8	S	S	*	*			cis	-148.1	-167.2	43.5	42.9	-20.2	0	0	0	118.1
29	S	36.5	Very low	38.7	Very low	102 Å²	102	127 Å²	127	71%	0.713	80%	0.801	S	S	*	*			trans	-82	157.7	-172.2	54.8	0	0	0	0	116.9
30	S	35.5	Very low	38.7	Very low	124 Å²	124	126.2 Å²	126.2	87%	0.867	80%	0.797	S	S	*	*				153.8	176.3	120	59.7	0	0	0	0	112.1
31	G	32.3	Very low	39	Very low	79 Å²	79	126.4 Å²	126.4	81%	0.814	79%	0.791	S	S	*	*			trans	108.5	101.4	157.7	0	0	0	0	0	116.8
32	S	32.8	Very low	39.2	Very low	107 Å²	107	122.9 Å²	122.9	75%	0.748	79%	0.785	S	S	*	*			trans	-78.2	174	174.4	49	0	0	0	0	115.1
33	L	35.3	Very low	38.5	Very low	162 Å²	162	122.1 Å²	122.1	85%	0.848	78%	0.781	S	S	*	*			trans	103.1	141.5	154.6	-66.8	158.6	0	0	0	120.7
34	T	42.7	Very low	38.7	Very low	122 Å²	122	123.2 Å²	123.2	75%	0.748	78%	0.784	S	S	*	*			trans	-74.8	166.3	170.3	46.4	0	0	0	0	112.1
35	P	46.1	Very low	39.5	Very low	123 Å²	123	123.9 Å²	123.9	80%	0.799	79%	0.786	S	S	*	*			cis	-150.3	-165.6	38.4	43.6	-21	0	0	0	118.3
36	S	37.6	Very low	39.4	Very low	109 Å²	109	121.3 Å²	121.3	76%	0.762	79%	0.787	S	S	*	*			trans	-55.7	161.3	171.2	-125.2	0	0	0	0	114.4
37	P	51	Low	39.7	Very low	126 Å²	126	122.5 Å²	122.5	82%	0.818	78%	0.781	S	S	*	*				-148	-166.1	71.8	41.3	-21.4	0	0	0	116.6
38	A	35.9	Very low	39.8	Very low	88 Å²	88	122.9 Å²	122.9	73%	0.727	79%	0.785	S	S	*	*			trans	-80.7	-176.6	-177.6	0	0	0	0	0	114.6
39	P	48.9	Very low	39.6	Very low	131 Å²	131	124.4 Å²	124.4	85%	0.851	78%	0.782	S	S	*	*				-143.6	175.6	102.9	40.6	-27.1	0	0	0	117.2
40	S	34.3	Very low	39.7	Very low	108 Å²	108	124.4 Å²	124.4	76%	0.755	79%	0.788	S	S	*	*			trans	-68.8	162.6	-174.3	54.2	0	0	0	0	119.3
41	S	38.9	Very low	39.9	Very low	109 Å²	109	125.8 Å²	125.8	76%	0.762	79%	0.785	S	S	*	*			trans	-155	125.8	134.1	48.4	0	0	0	0	114.9
42	H	39.7	Very low	40.4	Very low	168 Å²	168	130.4 Å²	130.4	78%	0.778	79%	0.785	S	S	*	*			trans	27.1	124.3	146.3	-68.5	-64.1	0	0	0	122.3
43	C	34.6	Very low	41.2	Very low	108 Å²	108	130 Å²	130	73%	0.73	78%	0.778	S	S	*	*				70	141.3	83.7	-69.4	0	0	0	0	114.8
44	S	40.5	Very low	41.6	Very low	108 Å²	108	130.6 Å²	130.6	76%	0.755	78%	0.781	S	S	*	*			cis	-163.1	177.2	-4.1	-113.2	0	0	0	0	111
45	P	53	Low	41.4	Very low	117 Å²	117	128 Å²	128	76%	0.76	78%	0.779	S	S	*	*			trans	-102	162.6	-156.2	39.1	-38.1	0	0	0	117.7
46	S	34.8	Very low	41.3	Very low	123 Å²	123	125.9 Å²	125.9	86%	0.86	78%	0.779	S	S	*	*			trans	-173.6	153.6	152.9	10.3	0	0	0	0	108.8
47	K	41.3	Very low	41.6	Very low	156 Å²	156	131 Å²	131	68%	0.678	78%	0.784	S	S	*	*			cis	-156.4	148.5	-15	-175.1	-173.1	176.8	-153.7	0	106.7	E49	K47-E49 WeakPolarHBondContact CE-OE1 3.37Å; K47-E49 WeakPolarHBondContact CE-OE2 3.47Å; K47-E49 IonicContact NZ-OE1 2.74Å; K47-E49 PolarHBondContact NZ-OE1 2.8Å; K47-E49 IonicContact NZ-OE2 3.39Å; K47-E49 PolarHBondContact NZ-OE2 2.98Å
48	M	38.8	Very low	41.6	Very low	189 Å²	189	130.1 Å²	130.1	93%	0.931	78%	0.778	S	S	*	*			trans	-96.8	130.8	171.5	-85.6	-172.6	170	0	0	111.7
49	E	40.7	Very low	42.7	Very low	153 Å²	153	132.5 Å²	132.5	72%	0.715	78%	0.784	S	S	*	*			trans	-167.2	142.3	166.9	-97.5	150.3	170.3	0	0	106.2	K47	K47-E49 WeakPolarHBondContact CE-OE1 3.37Å; K47-E49 WeakPolarHBondContact CE-OE2 3.47Å; K47-E49 IonicContact NZ-OE1 2.74Å; K47-E49 PolarHBondContact NZ-OE1 2.8Å; K47-E49 IonicContact NZ-OE2 3.39Å; K47-E49 PolarHBondContact NZ-OE2 2.98Å
50	A	39.1	Very low	43.1	Very low	102 Å²	102	134.8 Å²	134.8	84%	0.843	78%	0.78	S	S	*	*			cis	-151.1	170	-18.8	0	0	0	0	0	108
51	L	40.3	Very low	43.9	Very low	154 Å²	154	135.9 Å²	135.9	81%	0.806	78%	0.784	S	S	*	*			trans	-119.4	109.7	-171.7	-174.2	97.3	0	0	0	112.8
52	E	42.3	Very low	44.8	Very low	175 Å²	175	133 Å²	133	82%	0.818	76%	0.764	S	S	*	*			trans	-136.1	115.3	162.9	-77.5	-76.9	113.7	0	0	105.6
53	V	48.8	Very low	46.2	Very low	98 Å²	98	129.2 Å²	129.2	59%	0.594	75%	0.75	S	S	*	*				89.6	136.9	55.4	175.8	0	0	0	0	112.3
54	L	44.4	Very low	47.8	Very low	175 Å²	175	129 Å²	129	92%	0.916	75%	0.747	S	S	*	*			trans	74.6	122.5	-172.8	-49.2	-172.6	0	0	0	117.5
55	G	38.6	Very low	49.2	Very low	67 Å²	67	133.1 Å²	133.1	69%	0.691	75%	0.746	S	S	*	*			trans	168.5	61.6	177.5	0	0	0	0	0	114.4	Y57	G55-Y57 PolarHBondContact O-N 3.1Å
56	G	43.1	Very low	50	Low	79 Å²	79	130.1 Å²	130.1	81%	0.814	73%	0.728	S	S	*	*			trans	-66.7	118.7	179.8	0	0	0	0	0	112.6	P58	G56-P58 WeakPolarHBondContact O-CD 3.43Å
57	Y	44.9	Very low	51.9	Low	218 Å²	218	132 Å²	132	86%	0.855	72%	0.716	S	S	*	*			trans	-64.6	120.4	179.3	-75.2	-79.9	0	0	0	111.9	G55 T59	G55-Y57 PolarHBondContact O-N 3.1Å; Y57-T59 PolarHBondContact O-N 3.3Å; Y57-T59 VanDerWaalsContact O-N 3.1Å
58	P	50.2	Low	53.6	Low	107 Å²	107	130.3 Å²	130.3	70%	0.695	71%	0.712	S	S	*	*			trans	-74.3	106	178.4	29	-33.5	0	0	0	110.6	G56 K60	G56-P58 WeakPolarHBondContact O-CD 3.43Å; P58-K60 PolarHBondContact O-N 2.95Å
59	T	60.4	Low	55.6	Low	138 Å²	138	125.1 Å²	125.1	85%	0.847	69%	0.691	S	S	*	*			trans	-69.8	74.4	172.8	44.1	0	0	0	0	110.9	Y57	Y57-T59 PolarHBondContact O-N 3.3Å; Y57-T59 VanDerWaalsContact O-N 3.1Å
60	K	56.5	Low	57.4	Low	179 Å²	179	127 Å²	127	78%	0.778	69%	0.691	S	S	*	*			trans	-47.2	126.1	-179.8	-74.6	-175.3	176.1	179.3	0	110.4	P58 S62	P58-K60 PolarHBondContact O-N 2.95Å; K60-S62 PolarHBondContact O-N 3.42Å
61	P	51.6	Low	59.5	Low	130 Å²	130	126.3 Å²	126.3	84%	0.844	68%	0.677	S	S	*	*			trans	-66.5	95.4	-179	26.1	-33.9	0	0	0	109.9	N63	P61-N63 PolarHBondContact O-N 3.45Å
62	S	57.2	Low	61.5	Low	48 Å²	48	123.9 Å²	123.9	34%	0.336	66%	0.664	S	S	.	*			trans	-69.3	105.1	-178.2	58.4	0	0	0	0	109.8	K60 R67	K60-S62 PolarHBondContact O-N 3.42Å; S62-R67 VanDerWaalsContact OG-CZ 3.29Å; S62-R67 PolarHBondContact OG-NE 2.81Å; S62-R67 PolarHBondContact OG-NH2 2.8Å
63	N	68.4	Low	63.4	Low	89 Å²	89	120.7 Å²	120.7	48%	0.476	65%	0.652	S	S	.	*			trans	-44.9	128.6	176.6	-177.1	-34.2	0	0	0	110.8	P61 R65 S66 R67	P61-N63 PolarHBondContact O-N 3.45Å; N63-R65 PolarHBondContact O-N 3.2Å; N63-R65 VanDerWaalsContact O-N 3.1Å; N63-R65 WeakPolarHBondContact OD1-CB 3.37Å; N63-R65 PolarHBondContact OD1-N 2.9Å; N63-S66 PolarHBondContact O-N 2.96Å; N63-S66 PolarHBondContact O-OG 3.38Å; N63-R67 PolarHBondContact O-N 3.1Å
64	P	69.1	Low	65.2	Low	103 Å²	103	118.9 Å²	118.9	67%	0.669	64%	0.644	S	S	*	*	H	α-helix	trans	-56.6	-31	-177.3	21.2	-33	0	0	0	112.8	S66 R67 M68	P64-S66 PolarHBondContact O-N 3.17Å; P64-R67 PolarHBondContact O-N 3.45Å; P64-M68 WeakPolarHBondContact O-CB 3.21Å; P64-M68 PolarHBondContact O-N 2.65Å
65	R	70.3	Confident	67.2	Low	195 Å²	195	115.6 Å²	115.6	74%	0.736	63%	0.625	S	S	*	*	H	α-helix	trans	-62.4	-38.6	174.1	-65.7	-179.7	171.7	165	-2.2	112.4	N63 M68 V69	N63-R65 PolarHBondContact O-N 3.2Å; N63-R65 VanDerWaalsContact O-N 3.1Å; N63-R65 WeakPolarHBondContact OD1-CB 3.37Å; N63-R65 PolarHBondContact OD1-N 2.9Å; R65-M68 PolarHBondContact O-N 2.69Å; R65-V69 WeakPolarHBondContact O-CG2 3.3Å; R65-V69 PolarHBondContact O-N 2.98Å
66	S	69.3	Low	69.5	Low	54 Å²	54	116.9 Å²	116.9	38%	0.378	62%	0.619	S	S	.	*	H	α-helix	trans	-79	-27.4	179.1	71.5	0	0	0	0	113.3	N63 P64 R70	N63-S66 PolarHBondContact O-N 2.96Å; N63-S66 PolarHBondContact O-OG 3.38Å; P64-S66 PolarHBondContact O-N 3.17Å; S66-R70 VanDerWaalsContact O-CG 3.3Å; S66-R70 WeakPolarHBondContact O-CG 3.33Å; S66-R70 PolarHBondContact O-N 3.46Å
67	R	74.6	Confident	71.7	Confident	162 Å²	162	117.5 Å²	117.5	61%	0.611	61%	0.607	S	S	*	*	H	α-helix	trans	-61.9	-50.4	164.2	-72.1	-167.9	-178.3	179	5.1	110.7	S62 N63 P64 V69 R70 V71	S62-R67 VanDerWaalsContact OG-CZ 3.29Å; S62-R67 PolarHBondContact OG-NE 2.81Å; S62-R67 PolarHBondContact OG-NH2 2.8Å; N63-R67 PolarHBondContact O-N 3.1Å; P64-R67 PolarHBondContact O-N 3.45Å; R67-V69 PolarHBondContact O-N 3.01Å; R67-R70 PolarHBondContact O-N 3.06Å; R67-R70 VanDerWaalsContact O-N 3.17Å; R67-V71 WeakPolarHBondContact O-CG2 3.34Å; R67-V71 PolarHBondContact O-N 3.28Å
68	M	77.6	Confident	73.9	Confident	122 Å²	122	110.4 Å²	110.4	60%	0.601	59%	0.586	S	S	*	*	H	α-helix	trans	-61.4	-43.8	-177.3	-165.2	169.7	78	0	0	112.3	P64 R65 R70 V71 L72	P64-M68 WeakPolarHBondContact O-CB 3.21Å; P64-M68 PolarHBondContact O-N 2.65Å; R65-M68 PolarHBondContact O-N 2.69Å; M68-R70 PolarHBondContact O-N 2.91Å; M68-V71 PolarHBondContact O-N 3.28Å; M68-L72 HydrophobicContact CG-CD1 4.19Å; M68-L72 WeakPolarHBondContact O-CG 3.49Å; M68-L72 PolarHBondContact O-N 2.92Å
69	V	79.3	Confident	75.7	Confident	80 Å²	80	110.6 Å²	110.6	49%	0.485	58%	0.579	S	S	.	*	H	α-helix	trans	-60.2	-41.5	174.3	167.9	0	0	0	0	112.2	R65 R67 L72 L73	R65-V69 WeakPolarHBondContact O-CG2 3.3Å; R65-V69 PolarHBondContact O-N 2.98Å; R67-V69 PolarHBondContact O-N 3.01Å; V69-L72 PolarHBondContact O-N 3.4Å; V69-L73 HydrophobicContact CG1-CD1 3.83Å; V69-L73 HydrophobicContact CG1-CG 4.5Å; V69-L73 WeakPolarHBondContact O-CB 3.47Å; V69-L73 WeakPolarHBondContact O-CG 3.32Å; V69-L73 PolarHBondContact O-N 3.44Å
70	R	79.6	Confident	77	Confident	191 Å²	191	105.5 Å²	105.5	72%	0.721	55%	0.554	S	S	*	*	H	α-helix	trans	-65.6	-39.6	176.5	-74	175.2	179.6	-157.4	-1.3	112.8	S66 R67 M68 S74	S66-R70 VanDerWaalsContact O-CG 3.3Å; S66-R70 WeakPolarHBondContact O-CG 3.33Å; S66-R70 PolarHBondContact O-N 3.46Å; R67-R70 PolarHBondContact O-N 3.06Å; R67-R70 VanDerWaalsContact O-N 3.17Å; M68-R70 PolarHBondContact O-N 2.91Å; R70-S74 WeakPolarHBondContact O-CB 3.41Å; R70-S74 PolarHBondContact O-N 3.21Å
71	V	83.3	Confident	78.4	Confident	89 Å²	89	100.5 Å²	100.5	54%	0.539	54%	0.541	S	S	.	.	H	α-helix	trans	-65.2	-45.4	175.6	172.9	0	0	0	0	110.6	R67 M68 L73 S74 M75	R67-V71 WeakPolarHBondContact O-CG2 3.34Å; R67-V71 PolarHBondContact O-N 3.28Å; M68-V71 PolarHBondContact O-N 3.28Å; V71-L73 PolarHBondContact O-N 3.28Å; V71-S74 WeakPolarHBondContact O-CB 3.33Å; V71-S74 PolarHBondContact O-N 2.99Å; V71-M75 HydrophobicContact CG1-CG 4.4Å; V71-M75 WeakPolarHBondContact O-CG 3.44Å; V71-M75 PolarHBondContact O-N 2.98Å
72	L	81.3	Confident	80	Confident	103 Å²	103	98.7 Å²	98.7	54%	0.539	52%	0.524	S	S	.	.	H	α-helix	trans	-61.3	-44.9	177.6	-71	167.4	0	0	0	112.1	M68 V69 S74 M75 T76	M68-L72 HydrophobicContact CG-CD1 4.19Å; M68-L72 WeakPolarHBondContact O-CG 3.49Å; M68-L72 PolarHBondContact O-N 2.92Å; V69-L72 PolarHBondContact O-N 3.4Å; L72-S74 VanDerWaalsContact C-N 3.33Å; L72-S74 PolarHBondContact O-N 2.97Å; L72-M75 PolarHBondContact O-N 3.49Å; L72-T76 PolarHBondContact O-N 3.43Å; L72-T76 PolarHBondContact O-OG1 2.94Å
73	L	83.6	Confident	81.1	Confident	108 Å²	108	101.4 Å²	101.4	57%	0.565	53%	0.534	S	S	*	.	H	α-helix	trans	-62.6	-37.2	174.7	-75	166	0	0	0	112.8	V69 V71 T76 V77	V69-L73 HydrophobicContact CG1-CD1 3.83Å; V69-L73 HydrophobicContact CG1-CG 4.5Å; V69-L73 WeakPolarHBondContact O-CB 3.47Å; V69-L73 WeakPolarHBondContact O-CG 3.32Å; V69-L73 PolarHBondContact O-N 3.44Å; V71-L73 PolarHBondContact O-N 3.28Å; L73-T76 PolarHBondContact O-OG1 3.3Å; L73-V77 WeakPolarHBondContact O-CG2 3.33Å; L73-V77 PolarHBondContact O-N 3.3Å
74	S	86.4	Confident	81.4	Confident	60 Å²	60	101.3 Å²	101.3	42%	0.42	54%	0.537	S	S	.	.	H	α-helix	trans	-65.8	-44.4	174.4	179.6	0	0	0	0	111.5	R70 V71 L72 V77 V78	R70-S74 WeakPolarHBondContact O-CB 3.41Å; R70-S74 PolarHBondContact O-N 3.21Å; V71-S74 WeakPolarHBondContact O-CB 3.33Å; V71-S74 PolarHBondContact O-N 2.99Å; L72-S74 VanDerWaalsContact C-N 3.33Å; L72-S74 PolarHBondContact O-N 2.97Å; S74-V77 PolarHBondContact O-N 2.99Å; S74-V78 WeakPolarHBondContact O-CG2 3.3Å; S74-V78 PolarHBondContact O-N 2.91Å
75	M	86.4	Confident	81.7	Confident	106 Å²	106	101 Å²	101	52%	0.522	53%	0.529	S	S	.	.	H	α-helix	trans	-67.6	-36.7	-180	-67.7	-63.7	97.7	0	0	113.1	V71 L72 M79	V71-M75 HydrophobicContact CG1-CG 4.4Å; V71-M75 WeakPolarHBondContact O-CG 3.44Å; V71-M75 PolarHBondContact O-N 2.98Å; L72-M75 PolarHBondContact O-N 3.49Å; M75-M79 VanDerWaalsContact O-CB 3.3Å; M75-M79 WeakPolarHBondContact O-CB 3.34Å; M75-M79 PolarHBondContact O-N 3.22Å
76	T	85.7	Confident	81.7	Confident	93 Å²	93	97.7 Å²	97.7	57%	0.571	52%	0.521	S	S	*	.	H	α-helix	trans	-69.2	-37.9	175.2	53.9	0	0	0	0	112.3	L72 L73 G80	L72-T76 PolarHBondContact O-N 3.43Å; L72-T76 PolarHBondContact O-OG1 2.94Å; L73-T76 PolarHBondContact O-OG1 3.3Å; T76-G80 PolarHBondContact O-N 2.96Å
77	V	91.1	Very high	81.6	Confident	93 Å²	93	98.4 Å²	98.4	56%	0.564	53%	0.527	S	S	*	.	H	α-helix	trans	-64	-47.5	172.8	170.3	0	0	0	0	111.1	L73 S74 M79 G80 C81	L73-V77 WeakPolarHBondContact O-CG2 3.33Å; L73-V77 PolarHBondContact O-N 3.3Å; S74-V77 PolarHBondContact O-N 2.99Å; V77-M79 PolarHBondContact O-N 2.93Å; V77-G80 PolarHBondContact O-N 3.31Å; V77-C81 PolarHBondContact O-N 3.46Å; V77-C81 PolarHBondContact O-SG 3.48Å; V77-C81 VanDerWaalsContact O-SG 3.37Å
78	V	89.3	Confident	81.1	Confident	68 Å²	68	97.8 Å²	97.8	41%	0.412	53%	0.529	S	S	.	.	H	α-helix	trans	-60.9	-45.6	177.8	170.3	0	0	0	0	111.3	S74 G80 C81 L82	S74-V78 WeakPolarHBondContact O-CG2 3.3Å; S74-V78 PolarHBondContact O-N 2.91Å; V78-G80 VanDerWaalsContact C-N 3.35Å; V78-G80 PolarHBondContact O-N 2.89Å; V78-C81 PolarHBondContact O-N 3.23Å; V78-L82 HydrophobicContact CG1-CD1 3.97Å; V78-L82 HydrophobicContact CG1-CG 4.45Å; V78-L82 WeakPolarHBondContact O-CG 3.29Å; V78-L82 PolarHBondContact O-N 3.37Å
79	M	88	Confident	80.5	Confident	111 Å²	111	97 Å²	97	55%	0.547	53%	0.526	S	S	.	.	H	α-helix	trans	-62.1	-41.7	176.2	-172.4	62.6	69.4	0	0	111.8	M75 V77 L82 L83	M75-M79 VanDerWaalsContact O-CB 3.3Å; M75-M79 WeakPolarHBondContact O-CB 3.34Å; M75-M79 PolarHBondContact O-N 3.22Å; V77-M79 PolarHBondContact O-N 2.93Å; M79-L82 PolarHBondContact O-N 3.14Å; M79-L83 HydrophobicContact CG-CD1 4.14Å; M79-L83 VanDerWaalsContact O-CG 3.3Å; M79-L83 WeakPolarHBondContact O-CG 3.39Å; M79-L83 PolarHBondContact O-N 2.91Å
80	G	88.7	Confident	79.5	Confident	32 Å²	32	101.2 Å²	101.2	33%	0.33	54%	0.538	S	S	.	.	H	α-helix	trans	-59.6	-47.1	174.5	0	0	0	0	0	112.6	T76 V77 V78 L82 L83 T84	T76-G80 PolarHBondContact O-N 2.96Å; V77-G80 PolarHBondContact O-N 3.31Å; V78-G80 VanDerWaalsContact C-N 3.35Å; V78-G80 PolarHBondContact O-N 2.89Å; G80-L82 PolarHBondContact O-N 3.15Å; G80-L83 PolarHBondContact O-N 3.21Å; G80-T84 PolarHBondContact O-N 3.33Å; G80-T84 PolarHBondContact O-OG1 3.41Å
81	C	85.3	Confident	78.6	Confident	74 Å²	74	98.3 Å²	98.3	50%	0.5	54%	0.536	S	S	.	.	H	α-helix	trans	-62.9	-38.2	175.4	-69.7	0	0	0	0	112.8	V77 V78 T84 L85	V77-C81 PolarHBondContact O-N 3.46Å; V77-C81 PolarHBondContact O-SG 3.48Å; V77-C81 VanDerWaalsContact O-SG 3.37Å; V78-C81 PolarHBondContact O-N 3.23Å; C81-T84 PolarHBondContact O-OG1 3.47Å; C81-T84 VanDerWaalsContact O-OG1 3.14Å; C81-L85 WeakPolarHBondContact O-CB 3.15Å; C81-L85 PolarHBondContact O-N 2.94Å
82	L	86	Confident	77	Confident	92 Å²	92	99.1 Å²	99.1	48%	0.482	54%	0.541	S	S	.	.	H	α-helix	trans	-67.1	-39	175.7	-71.5	170.7	0	0	0	111.8	V78 M79 G80 H86	V78-L82 HydrophobicContact CG1-CD1 3.97Å; V78-L82 HydrophobicContact CG1-CG 4.45Å; V78-L82 WeakPolarHBondContact O-CG 3.29Å; V78-L82 PolarHBondContact O-N 3.37Å; M79-L82 PolarHBondContact O-N 3.14Å; G80-L82 PolarHBondContact O-N 3.15Å; L82-H86 WeakPolarHBondContact O-CB 3.3Å; L82-H86 PolarHBondContact O-N 3.23Å
83	L	80.8	Confident	75.6	Confident	105 Å²	105	103.1 Å²	103.1	55%	0.55	55%	0.554	S	S	.	*	H	α-helix	trans	-69.6	-39.9	177.1	-70.5	169.5	0	0	0	112.7	M79 G80 S87	M79-L83 HydrophobicContact CG-CD1 4.14Å; M79-L83 VanDerWaalsContact O-CG 3.3Å; M79-L83 WeakPolarHBondContact O-CG 3.39Å; M79-L83 PolarHBondContact O-N 2.91Å; G80-L83 PolarHBondContact O-N 3.21Å; L83-S87 WeakPolarHBondContact O-CB 3.32Å; L83-S87 PolarHBondContact O-N 3.15Å; L83-S87 PolarHBondContact O-OG 2.95Å
84	T	74.4	Confident	73.8	Confident	87 Å²	87	103.6 Å²	103.6	53%	0.534	57%	0.566	S	S	.	*	H	α-helix	trans	-69.5	-37.8	174	55.5	0	0	0	0	111.7	G80 C81 S87 F88	G80-T84 PolarHBondContact O-N 3.33Å; G80-T84 PolarHBondContact O-OG1 3.41Å; C81-T84 PolarHBondContact O-OG1 3.47Å; C81-T84 VanDerWaalsContact O-OG1 3.14Å; T84-S87 WeakPolarHBondContact O-CB 3.28Å; T84-S87 PolarHBondContact O-N 2.87Å; T84-F88 PolarHBondContact O-N 2.77Å
85	L	76.1	Confident	72.4	Confident	97 Å²	97	110.4 Å²	110.4	51%	0.508	58%	0.583	S	S	.	*	H	α-helix	trans	-64.5	-44.9	174	-173	66.1	0	0	0	112	C81 S87 F88 L89	C81-L85 WeakPolarHBondContact O-CB 3.15Å; C81-L85 PolarHBondContact O-N 2.94Å; L85-S87 PolarHBondContact O-N 3.41Å; L85-F88 PolarHBondContact O-N 3.22Å; L85-L89 HydrophobicContact CG-CD1 4.06Å; L85-L89 WeakPolarHBondContact O-CB 3.41Å; L85-L89 VanDerWaalsContact O-CG 3.29Å; L85-L89 WeakPolarHBondContact O-CG 3.44Å; L85-L89 PolarHBondContact O-N 3.19Å
86	H	68.4	Low	71	Confident	124 Å²	124	113.7 Å²	113.7	57%	0.574	59%	0.594	S	S	*	*	H	α-helix	trans	-60.6	-31.2	172.3	-106.1	-145.2	0	0	0	112.9	L82 K90	L82-H86 WeakPolarHBondContact O-CB 3.3Å; L82-H86 PolarHBondContact O-N 3.23Å; H86-K90 WeakPolarHBondContact O-CG 3.43Å; H86-K90 PolarHBondContact O-N 2.88Å
87	S	68.1	Low	69.6	Low	70 Å²	70	114.6 Å²	114.6	49%	0.49	60%	0.601	S	S	.	*	H	α-helix	trans	-72.6	-43.8	175.3	-57.5	0	0	0	0	111.3	L83 T84 L85 K90 I91	L83-S87 WeakPolarHBondContact O-CB 3.32Å; L83-S87 PolarHBondContact O-N 3.15Å; L83-S87 PolarHBondContact O-OG 2.95Å; T84-S87 WeakPolarHBondContact O-CB 3.28Å; T84-S87 PolarHBondContact O-N 2.87Å; L85-S87 PolarHBondContact O-N 3.41Å; S87-K90 PolarHBondContact O-N 3.21Å; S87-I91 WeakPolarHBondContact O-CG1 3.41Å; S87-I91 PolarHBondContact O-N 2.69Å
88	F	64.9	Low	69.1	Low	148 Å²	148	113.8 Å²	113.8	65%	0.649	59%	0.592	S	S	*	*	H	α-helix	trans	-62	-44.4	174	-104.9	-100	0	0	0	112.9	T84 L85 K90 I91 T92	T84-F88 PolarHBondContact O-N 2.77Å; L85-F88 PolarHBondContact O-N 3.22Å; F88-K90 PolarHBondContact O-N 2.96Å; F88-I91 WeakPolarHBondContact O-CB 3.3Å; F88-I91 PolarHBondContact O-N 2.9Å; F88-T92 PolarHBondContact O-N 3.31Å
89	L	63.8	Low	69.4	Low	106 Å²	106	111.4 Å²	111.4	56%	0.555	58%	0.576	S	S	*	*	H	α-helix	trans	-62.9	-24.8	178.7	-72.7	167.2	0	0	0	113.3	L85 T92	L85-L89 HydrophobicContact CG-CD1 4.06Å; L85-L89 WeakPolarHBondContact O-CB 3.41Å; L85-L89 VanDerWaalsContact O-CG 3.29Å; L85-L89 WeakPolarHBondContact O-CG 3.44Å; L85-L89 PolarHBondContact O-N 3.19Å; L89-T92 PolarHBondContact O-OG1 3.05Å
90	K	59.5	Low	69.8	Low	168 Å²	168	106.1 Å²	106.1	73%	0.73	55%	0.551	S	S	*	*	H	α-helix	trans	-78.9	-19.7	172.6	-75.2	177.3	178.9	-179.3	0	113.5	H86 S87 F88	H86-K90 WeakPolarHBondContact O-CG 3.43Å; H86-K90 PolarHBondContact O-N 2.88Å; S87-K90 PolarHBondContact O-N 3.21Å; F88-K90 PolarHBondContact O-N 2.96Å
91	I	59.3	Low	70.3	Confident	130 Å²	130	104.6 Å²	104.6	67%	0.667	54%	0.535	S	S	*	.	H	α-helix	trans	-82.7	-28	179.8	-66.6	166.5	0	0	0	111	S87 F88 K93	S87-I91 WeakPolarHBondContact O-CG1 3.41Å; S87-I91 PolarHBondContact O-N 2.69Å; F88-I91 WeakPolarHBondContact O-CB 3.3Å; F88-I91 PolarHBondContact O-N 2.9Å; I91-K93 PolarHBondContact O-N 3.49Å
92	T	51.1	Low	70.8	Confident	106 Å²	106	104 Å²	104	65%	0.65	53%	0.531	S	S	*	.			trans	-77.2	37.2	177.7	54.5	0	0	0	0	114.1	F88 L89 S94	F88-T92 PolarHBondContact O-N 3.31Å; L89-T92 PolarHBondContact O-OG1 3.05Å; T92-S94 PolarHBondContact O-N 3.14Å; T92-S94 VanDerWaalsContact O-N 3.1Å
93	K	51.4	Low	71.3	Confident	188 Å²	188	100.9 Å²	100.9	82%	0.817	51%	0.514	S	S	*	.			trans	-73.6	101.6	169.6	-147.3	179.7	-169.8	-176.4	0	107.8	I91 R95	I91-K93 PolarHBondContact O-N 3.49Å; K93-R95 PolarHBondContact O-N 2.97Å
94	S	45.8	Very low	72.1	Confident	117 Å²	117	101.8 Å²	101.8	82%	0.818	52%	0.515	S	S	*	.			trans	-53.5	102.9	-176.2	-175.4	0	0	0	0	111.1	T92 K96	T92-S94 PolarHBondContact O-N 3.14Å; T92-S94 VanDerWaalsContact O-N 3.1Å; S94-K96 PolarHBondContact O-N 3.16Å; S94-K96 VanDerWaalsContact O-N 3.1Å
95	R	57	Low	73.2	Confident	203 Å²	203	97.9 Å²	97.9	77%	0.766	49%	0.491	S	S	*	.			trans	-77.6	97.8	177.6	-172.5	175.2	-175.2	167.3	-0.6	106.6	K93	K93-R95 PolarHBondContact O-N 2.97Å
96	K	55.7	Low	74.3	Confident	175 Å²	175	99.3 Å²	99.3	76%	0.761	49%	0.493	S	S	*	.			trans	-42.6	137.3	165.9	-70	-173.8	176.6	-174.5	0	108.4	S94 Q98	S94-K96 PolarHBondContact O-N 3.16Å; S94-K96 VanDerWaalsContact O-N 3.1Å; K96-Q98 PolarHBondContact O-N 3.16Å; K96-Q98 VanDerWaalsContact O-N 3.11Å
97	P	57.2	Low	75.7	Confident	112 Å²	112	94.3 Å²	94.3	73%	0.727	47%	0.471	S	S	*	.			trans	-53.5	124.6	173.9	23.8	-33.1	0	0	0	107.9	D99	P97-D99 PolarHBondContact O-N 3.16Å
98	Q	80.8	Confident	77	Confident	77 Å²	77	91.3 Å²	91.3	36%	0.36	45%	0.45	S	S	.	.			trans	-70.8	130.6	-177.1	-80.8	-175.8	-91.6	0	0	109.4	K96 F103 F206	K96-Q98 PolarHBondContact O-N 3.16Å; K96-Q98 VanDerWaalsContact O-N 3.11Å; Q98-F103 VanDerWaalsContact NE2-CZ 3.31Å; Q98-F206 HydrophobicContact CB-CD2 4.45Å; Q98-F206 HydrophobicContact CB-CE2 4.3Å; Q98-F206 WeakPolarHBondContact O-CE2 3.48Å; Q98-F206 WeakPolarHBondContact O-CZ 3.16Å
99	D	94.7	Very high	78.5	Confident	17 Å²	17	90.5 Å²	90.5	9%	0.091	45%	0.446	C	S	.	.			trans	-128.6	161.2	173.1	74.2	59.5	0	0	0	108.9	P97 Y101 S102 F103 R119 E227	P97-D99 PolarHBondContact O-N 3.16Å; D99-Y101 VanDerWaalsContact C-N 3.26Å; D99-Y101 PolarHBondContact O-N 3.12Å; D99-Y101 WeakPolarHBondContact OD1-CA 3.49Å; D99-Y101 WeakPolarHBondContact OD1-CB 3.47Å; D99-Y101 PolarHBondContact OD1-N 2.81Å; D99-S102 PolarHBondContact N-OG 3.33Å; D99-S102 WeakPolarHBondContact O-CB 3.05Å; D99-S102 PolarHBondContact O-N 3.09Å; D99-S102 VanDerWaalsContact O-N 3.15Å; D99-S102 PolarHBondContact O-OG 3.01Å; D99-S102 PolarHBondContact OD1-N 2.61Å; D99-F103 WeakPolarHBondContact O-CD2 3.37Å; D99-F103 WeakPolarHBondContact O-CE2 3.39Å; D99-R119 VanDerWaalsContact CG-NH1 3.27Å; D99-R119 VanDerWaalsContact CG-NH2 3.31Å; D99-R119 IonicContact OD1-CZ 2.79Å; D99-R119 IonicContact OD1-NH1 2.72Å; D99-R119 PolarHBondContact OD1-NH1 3.34Å; D99-R119 IonicContact OD1-NH2 3.28Å; D99-R119 PolarHBondContact OD1-NH2 2.78Å; D99-R119 IonicContact OD2-CZ 3.01Å; D99-R119 VanDerWaalsContact OD2-CZ 3.28Å; D99-R119 IonicContact OD2-NH1 3.28Å; D99-R119 PolarHBondContact OD2-NH1 3.01Å; D99-R119 IonicContact OD2-NH2 3.83Å; D99-R119 PolarHBondContact OD2-NH2 2.95Å; D99-E227 WeakPolarHBondContact CB-O 3.46Å
100	F	97.7	Very high	80	Confident	1 Å²	1	87.4 Å²	87.4	0%	0.004	44%	0.44	C	S	.	.	G	3₁₀ helix	trans	-61.8	-30.5	-174.9	174.2	-105.4	0	0	0	113.9	S102 L115 V125 L157 F159 A203 F206 I207 V224 G228	F100-S102 VanDerWaalsContact C-N 3.33Å; F100-L115 HydrophobicContact CD1-CD1 4.43Å; F100-L115 HydrophobicContact CD2-CD1 4.29Å; F100-L115 HydrophobicContact CE1-CD1 3.88Å; F100-L115 HydrophobicContact CE2-CD1 3.72Å; F100-L115 HydrophobicContact CZ-CD1 3.5Å; F100-L115 HydrophobicContact CZ-CD2 4.44Å; F100-L115 WeakPolarHBondContact O-CD1 3.41Å; F100-V125 HydrophobicContact CD1-CG2 4.34Å; F100-V125 HydrophobicContact CE1-CG2 3.6Å; F100-V125 HydrophobicContact CE2-CG2 4.18Å; F100-V125 HydrophobicContact CZ-CG1 4.38Å; F100-V125 HydrophobicContact CZ-CG2 3.49Å; F100-V125 VanDerWaalsContact CZ-CG2 3.49Å; F100-L157 HydrophobicContact CE1-CD1 3.66Å; F100-L157 HydrophobicContact CZ-CD1 4.14Å; F100-F159 HydrophobicContact CZ-CE2 4.31Å; F100-F159 HydrophobicContact CZ-CZ 4.38Å; F100-A203 HydrophobicContact CE2-CB 4.13Å; F100-F206 HydrophobicContact CB-CD1 3.93Å; F100-F206 HydrophobicContact CB-CE1 3.83Å; F100-I207 HydrophobicContact CD2-CD1 3.7Å; F100-I207 HydrophobicContact CD2-CG1 3.83Å; F100-I207 HydrophobicContact CE2-CD1 3.58Å; F100-I207 HydrophobicContact CE2-CG1 4.21Å; F100-I207 HydrophobicContact CG-CD1 4.5Å; F100-I207 HydrophobicContact CZ-CD1 4.3Å; F100-V224 HydrophobicContact CB-CG1 3.95Å; F100-V224 HydrophobicContact CD1-CB 4.47Å; F100-V224 HydrophobicContact CD1-CG1 4.04Å; F100-V224 HydrophobicContact CD1-CG2 4.15Å; F100-V224 HydrophobicContact CG-CG1 4.32Å; F100-V224 HydrophobicContact CG-CG2 4.34Å; F100-G228 WeakPolarHBondContact CB-O 3.4Å; F100-G228 PolarHBondContact N-O 2.64Å
101	Y	97.8	Very high	81.8	Confident	0 Å²	0	86.9 Å²	86.9	0%	0	43%	0.433	C	S	.	.	G	3₁₀ helix	trans	-78.5	-18.7	-179.9	-56.2	-49.5	0	0	0	112.9	D99 F103 L115 E116 R119 K121 S123 V224 N225 P226 G228	D99-Y101 VanDerWaalsContact C-N 3.26Å; D99-Y101 PolarHBondContact O-N 3.12Å; D99-Y101 WeakPolarHBondContact OD1-CA 3.49Å; D99-Y101 WeakPolarHBondContact OD1-CB 3.47Å; D99-Y101 PolarHBondContact OD1-N 2.81Å; Y101-F103 PolarHBondContact O-N 3.05Å; Y101-F103 VanDerWaalsContact O-N 3.16Å; Y101-L115 HydrophobicContact CD1-CB 4.43Å; Y101-L115 WeakPolarHBondContact CD1-O 3.48Å; Y101-L115 CarbonylContact O-C 3.58Å; Y101-E116 WeakPolarHBondContact O-CA 3.09Å; Y101-E116 PolarHBondContact O-N 3.49Å; Y101-R119 HydrophobicContact CD2-CB 3.82Å; Y101-R119 HydrophobicContact CD2-CG 3.98Å; Y101-R119 HydrophobicContact CE2-CB 4.47Å; Y101-R119 HydrophobicContact CG-CB 4.16Å; Y101-K121 PolarHBondContact OH-O 2.93Å; Y101-S123 VanDerWaalsContact CE1-OG 3.29Å; Y101-S123 WeakPolarHBondContact CE1-OG 3.17Å; Y101-S123 VanDerWaalsContact OH-CB 3.3Å; Y101-S123 WeakPolarHBondContact OH-CB 3.35Å; Y101-S123 PolarHBondContact OH-OG 3.16Å; Y101-V224 HydrophobicContact CE1-CG1 4.47Å; Y101-V224 HydrophobicContact CE2-CG1 4.35Å; Y101-N225 WeakPolarHBondContact CE2-O 3.25Å; Y101-N225 PolarHBondContact OH-O 3.01Å; Y101-N225 VanDerWaalsContact OH-O 3.11Å; Y101-P226 WeakPolarHBondContact CE2-O 3.25Å; Y101-G228 VanDerWaalsContact CD2-CA 3.45Å; Y101-G228 VanDerWaalsContact CE2-CA 3.49Å
102	S	96.6	Very high	83.7	Confident	60 Å²	60	84.2 Å²	84.2	42%	0.42	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	-68.9	-5.5	176.2	73.7	0	0	0	0	115.3	D99 F100	D99-S102 PolarHBondContact N-OG 3.33Å; D99-S102 WeakPolarHBondContact O-CB 3.05Å; D99-S102 PolarHBondContact O-N 3.09Å; D99-S102 VanDerWaalsContact O-N 3.15Å; D99-S102 PolarHBondContact O-OG 3.01Å; D99-S102 PolarHBondContact OD1-N 2.61Å; F100-S102 VanDerWaalsContact C-N 3.33Å
103	F	97	Very high	85.9	Confident	27 Å²	27	80.3 Å²	80.3	12%	0.118	40%	0.403	C	S	.	.			trans	-93.7	156.5	179.4	-65.8	-94.6	0	0	0	113	Q98 D99 Y101 L115 P202 A203 F206	Q98-F103 VanDerWaalsContact NE2-CZ 3.31Å; D99-F103 WeakPolarHBondContact O-CD2 3.37Å; D99-F103 WeakPolarHBondContact O-CE2 3.39Å; Y101-F103 PolarHBondContact O-N 3.05Å; Y101-F103 VanDerWaalsContact O-N 3.16Å; F103-L115 HydrophobicContact CB-CD1 4.24Å; F103-L115 WeakPolarHBondContact O-CB 3.46Å; F103-L115 PolarHBondContact O-N 2.93Å; F103-P202 HydrophobicContact CD1-CB 3.95Å; F103-P202 HydrophobicContact CE1-CB 3.78Å; F103-A203 HydrophobicContact CB-CB 3.76Å; F103-A203 HydrophobicContact CD1-CB 4.32Å; F103-A203 HydrophobicContact CD2-CB 4.46Å; F103-A203 HydrophobicContact CG-CB 3.96Å; F103-F206 HydrophobicContact CE2-CB 3.69Å; F103-F206 HydrophobicContact CE2-CD1 4.3Å; F103-F206 HydrophobicContact CE2-CD2 4.15Å; F103-F206 AromaticContact CE2-CG 3.77Å; F103-F206 HydrophobicContact CE2-CG 3.77Å; F103-F206 HydrophobicContact CZ-CB 3.68Å; F103-F206 HydrophobicContact CZ-CD2 4.36Å; F103-F206 HydrophobicContact CZ-CG 4.14Å
104	E	97.3	Very high	88.1	Confident	125 Å²	125	73.6 Å²	73.6	58%	0.584	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.8	144.6	162.5	-61.6	-167.2	-171.6	0	0	110.1	S112	E104-S112 WeakPolarHBondContact OE2-CB 3.42Å; E104-S112 PolarHBondContact OE2-OG 3.4Å
105	V	97.9	Very high	90.5	Very high	4 Å²	4	68 Å²	68	2%	0.024	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	157.5	176.6	-63.3	0	0	0	0	109.9	V113 L115 F159 F190 A203	V105-V113 PolarHBondContact N-O 3.04Å; V105-V113 PolarHBondContact O-N 3.3Å; V105-L115 HydrophobicContact CG1-CD1 3.88Å; V105-L115 HydrophobicContact CG1-CG 4.31Å; V105-L115 HydrophobicContact CG2-CD1 4.35Å; V105-L115 HydrophobicContact CG2-CD2 3.68Å; V105-L115 HydrophobicContact CG2-CG 3.96Å; V105-F159 HydrophobicContact CB-CE1 4.14Å; V105-F159 HydrophobicContact CG1-CE1 3.96Å; V105-F159 HydrophobicContact CG1-CZ 4.29Å; V105-F159 HydrophobicContact CG2-CE1 4.19Å; V105-F159 HydrophobicContact CG2-CZ 4.33Å; V105-F190 HydrophobicContact CB-CD1 4.43Å; V105-F190 HydrophobicContact CG2-CD1 3.41Å; V105-F190 VanDerWaalsContact CG2-CD1 3.41Å; V105-F190 HydrophobicContact CG2-CE1 3.46Å; V105-F190 VanDerWaalsContact CG2-CE1 3.46Å; V105-F190 HydrophobicContact CG2-CG 4.16Å; V105-F190 HydrophobicContact CG2-CZ 4.26Å; V105-A203 HydrophobicContact CG1-CB 3.54Å
106	K	98.2	Very high	92.4	Very high	127 Å²	127	62.7 Å²	62.7	55%	0.552	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.5	137.7	176.3	-69.4	178.4	-178	176.2	0	111.4	R111 F190 S191	K106-R111 CarbonylContact C-O 3.54Å; K106-R111 VanDerWaalsContact CA-O 3.32Å; K106-R111 WeakPolarHBondContact CA-O 3.23Å; K106-F190 WeakPolarHBondContact O-CB 3.39Å; K106-S191 PolarHBondContact O-N 2.85Å
107	D	97.5	Very high	94.4	Very high	20 Å²	20	62.7 Å²	62.7	11%	0.107	32%	0.319	C	S	.	.	B	Isolated β-bridge	trans	-71.2	173.6	166.4	78.4	-2.9	0	0	0	111.8	K109 G110 R111 V113 S191	D107-K109 PolarHBondContact O-N 2.72Å; D107-K109 VanDerWaalsContact OD1-C 3.24Å; D107-K109 VanDerWaalsContact OD1-CA 3.29Å; D107-K109 WeakPolarHBondContact OD1-CA 3.42Å; D107-K109 WeakPolarHBondContact OD1-CB 3.45Å; D107-K109 PolarHBondContact OD1-N 3.1Å; D107-G110 PolarHBondContact O-N 3.1Å; D107-G110 PolarHBondContact OD1-N 2.91Å; D107-R111 PolarHBondContact N-O 3.25Å; D107-R111 WeakPolarHBondContact OD1-CB 3.29Å; D107-R111 PolarHBondContact OD1-N 3.48Å; D107-R111 IonicContact OD1-NE 3.17Å; D107-R111 IonicContact OD2-CZ 2.65Å; D107-R111 IonicContact OD2-NE 2.69Å; D107-R111 PolarHBondContact OD2-NE 3.21Å; D107-R111 IonicContact OD2-NH2 2.69Å; D107-R111 PolarHBondContact OD2-NH2 3.08Å; D107-V113 HydrophobicContact CB-CG2 3.95Å; D107-S191 WeakPolarHBondContact O-CB 3.29Å; D107-S191 PolarHBondContact O-N 2.79Å; D107-S191 PolarHBondContact O-OG 2.86Å
108	A	96.1	Very high	96.2	Very high	6 Å²	6	58.6 Å²	58.6	5%	0.05	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-13.6	177.6	0	0	0	0	0	114.9	S172 R173 E176	A108-S172 WeakPolarHBondContact CB-O 3.45Å; A108-S172 WeakPolarHBondContact O-CB 3.48Å; A108-R173 PolarHBondContact O-N 2.88Å; A108-E176 HydrophobicContact CB-CB 3.57Å; A108-E176 HydrophobicContact CB-CG 4.06Å; A108-E176 WeakPolarHBondContact CB-OE2 3.42Å
109	K	96	Very high	97	Very high	131 Å²	131	58.9 Å²	58.9	57%	0.57	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	8.2	179.1	-58.5	173.5	-174.1	176.2	0	112	D107 R111 E176	D107-K109 PolarHBondContact O-N 2.72Å; D107-K109 VanDerWaalsContact OD1-C 3.24Å; D107-K109 VanDerWaalsContact OD1-CA 3.29Å; D107-K109 WeakPolarHBondContact OD1-CA 3.42Å; D107-K109 WeakPolarHBondContact OD1-CB 3.45Å; D107-K109 PolarHBondContact OD1-N 3.1Å; K109-R111 VanDerWaalsContact C-N 3.33Å; K109-R111 PolarHBondContact O-N 2.86Å; K109-E176 WeakPolarHBondContact CE-OE2 3.34Å
110	G	96.1	Very high	97	Very high	41 Å²	41	59 Å²	59	42%	0.423	29%	0.293	S	S	.	.	S	Bend	trans	81	3.4	176.6	0	0	0	0	0	115.3	D107	D107-G110 PolarHBondContact O-N 3.1Å; D107-G110 PolarHBondContact OD1-N 2.91Å
111	R	97.3	Very high	96.9	Very high	157 Å²	157	62 Å²	62	59%	0.592	31%	0.306	S	S	*	.			trans	-81.9	141.3	-178.3	-54.1	179	-63.1	168.5	5.1	110	K106 D107 K109	K106-R111 CarbonylContact C-O 3.54Å; K106-R111 VanDerWaalsContact CA-O 3.32Å; K106-R111 WeakPolarHBondContact CA-O 3.23Å; D107-R111 PolarHBondContact N-O 3.25Å; D107-R111 WeakPolarHBondContact OD1-CB 3.29Å; D107-R111 PolarHBondContact OD1-N 3.48Å; D107-R111 IonicContact OD1-NE 3.17Å; D107-R111 IonicContact OD2-CZ 2.65Å; D107-R111 IonicContact OD2-NE 2.69Å; D107-R111 PolarHBondContact OD2-NE 3.21Å; D107-R111 IonicContact OD2-NH2 2.69Å; D107-R111 PolarHBondContact OD2-NH2 3.08Å; K109-R111 VanDerWaalsContact C-N 3.33Å; K109-R111 PolarHBondContact O-N 2.86Å
112	S	97.6	Very high	96.9	Very high	74 Å²	74	62 Å²	62	52%	0.517	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	139	175.3	-150.7	0	0	0	0	111.4	E104	E104-S112 WeakPolarHBondContact OE2-CB 3.42Å; E104-S112 PolarHBondContact OE2-OG 3.4Å
113	V	97.5	Very high	97	Very high	25 Å²	25	59.1 Å²	59.1	15%	0.152	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	115.6	176.7	178.5	0	0	0	0	107.8	V105 D107 F190	V105-V113 PolarHBondContact N-O 3.04Å; V105-V113 PolarHBondContact O-N 3.3Å; D107-V113 HydrophobicContact CB-CG2 3.95Å; V113-F190 HydrophobicContact CG1-CE1 4.46Å
114	S	97.8	Very high	97.1	Very high	47 Å²	47	57.8 Å²	57.8	33%	0.329	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	132.3	170.4	-178.2	0	0	0	0	110.8	E116 R117	S114-E116 PolarHBondContact O-N 2.85Å; S114-E116 VanDerWaalsContact OG-CB 3.29Å; S114-E116 WeakPolarHBondContact OG-CB 3.32Å; S114-E116 PolarHBondContact OG-N 3.25Å; S114-R117 WeakPolarHBondContact O-CG 3.45Å
115	L	97.7	Very high	97.1	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-74.7	-10.5	175.8	-66.3	175.6	0	0	0	112.6	F100 Y101 F103 V105 R117 Y118 F190 A203	F100-L115 HydrophobicContact CD1-CD1 4.43Å; F100-L115 HydrophobicContact CD2-CD1 4.29Å; F100-L115 HydrophobicContact CE1-CD1 3.88Å; F100-L115 HydrophobicContact CE2-CD1 3.72Å; F100-L115 HydrophobicContact CZ-CD1 3.5Å; F100-L115 HydrophobicContact CZ-CD2 4.44Å; F100-L115 WeakPolarHBondContact O-CD1 3.41Å; Y101-L115 HydrophobicContact CD1-CB 4.43Å; Y101-L115 WeakPolarHBondContact CD1-O 3.48Å; Y101-L115 CarbonylContact O-C 3.58Å; F103-L115 HydrophobicContact CB-CD1 4.24Å; F103-L115 WeakPolarHBondContact O-CB 3.46Å; F103-L115 PolarHBondContact O-N 2.93Å; V105-L115 HydrophobicContact CG1-CD1 3.88Å; V105-L115 HydrophobicContact CG1-CG 4.31Å; V105-L115 HydrophobicContact CG2-CD1 4.35Å; V105-L115 HydrophobicContact CG2-CD2 3.68Å; V105-L115 HydrophobicContact CG2-CG 3.96Å; L115-R117 PolarHBondContact O-N 2.9Å; L115-Y118 HydrophobicContact CB-CD2 4.4Å; L115-Y118 HydrophobicContact CD2-CD2 3.85Å; L115-Y118 HydrophobicContact CD2-CE2 3.82Å; L115-Y118 WeakPolarHBondContact O-CB 3.43Å; L115-Y118 WeakPolarHBondContact O-CD2 3.29Å; L115-Y118 PolarHBondContact O-N 3Å; L115-F190 HydrophobicContact CD2-CE1 4.38Å; L115-F190 HydrophobicContact CD2-CZ 4.06Å; L115-A203 HydrophobicContact CD1-CB 4.03Å
116	E	97.2	Very high	97.2	Very high	90 Å²	90	51.7 Å²	51.7	42%	0.421	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-53	-30.7	176.9	-172.2	62.9	-161.7	0	0	112.1	Y101 S114 Y118 R119	Y101-E116 WeakPolarHBondContact O-CA 3.09Å; Y101-E116 PolarHBondContact O-N 3.49Å; S114-E116 PolarHBondContact O-N 2.85Å; S114-E116 VanDerWaalsContact OG-CB 3.29Å; S114-E116 WeakPolarHBondContact OG-CB 3.32Å; S114-E116 PolarHBondContact OG-N 3.25Å; E116-Y118 PolarHBondContact O-N 2.9Å; E116-Y118 VanDerWaalsContact O-N 3.09Å; E116-R119 VanDerWaalsContact O-CB 3.25Å; E116-R119 WeakPolarHBondContact O-CB 3.41Å; E116-R119 PolarHBondContact O-N 3.04Å; E116-R119 WeakPolarHBondContact OE1-CD 3.4Å; E116-R119 IonicContact OE1-CZ 2.64Å; E116-R119 IonicContact OE1-NE 2.81Å; E116-R119 PolarHBondContact OE1-NE 3.41Å; E116-R119 IonicContact OE1-NH2 3.61Å; E116-R119 IonicContact OE2-CZ 3.56Å; E116-R119 VanDerWaalsContact OE2-CZ 3.28Å; E116-R119 IonicContact OE2-NE 3.8Å; E116-R119 PolarHBondContact OE2-NE 2.91Å; E116-R119 IonicContact OE2-NH2 3.8Å; E116-R119 PolarHBondContact OE2-NH2 2.97Å
117	R	95.6	Very high	97.1	Very high	176 Å²	176	45.6 Å²	45.6	66%	0.664	23%	0.225	S	C	*	.	G	3₁₀ helix	trans	-64.3	-10.3	176.3	77.2	-174.1	-53.2	-164	4.3	115.2	S114 L115	S114-R117 WeakPolarHBondContact O-CG 3.45Å; L115-R117 PolarHBondContact O-N 2.9Å
118	Y	96.3	Very high	97.1	Very high	25 Å²	25	44.7 Å²	44.7	10%	0.098	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-104.8	-3.3	175.6	-52.5	-69	0	0	0	112.5	L115 E116 K121 N155 L157 F190	L115-Y118 HydrophobicContact CB-CD2 4.4Å; L115-Y118 HydrophobicContact CD2-CD2 3.85Å; L115-Y118 HydrophobicContact CD2-CE2 3.82Å; L115-Y118 WeakPolarHBondContact O-CB 3.43Å; L115-Y118 WeakPolarHBondContact O-CD2 3.29Å; L115-Y118 PolarHBondContact O-N 3Å; E116-Y118 PolarHBondContact O-N 2.9Å; E116-Y118 VanDerWaalsContact O-N 3.09Å; Y118-K121 WeakPolarHBondContact O-CB 3.48Å; Y118-K121 PolarHBondContact O-N 2.86Å; Y118-N155 WeakPolarHBondContact CD1-OD1 3.34Å; Y118-L157 HydrophobicContact CD1-CD2 4.05Å; Y118-L157 HydrophobicContact CD2-CD1 4.22Å; Y118-L157 HydrophobicContact CD2-CD2 4.08Å; Y118-L157 HydrophobicContact CE1-CD2 3.82Å; Y118-L157 HydrophobicContact CE2-CD2 3.88Å; Y118-L157 HydrophobicContact CG-CD1 4.41Å; Y118-L157 HydrophobicContact CG-CD2 4.17Å; Y118-F190 HydrophobicContact CE2-CZ 4.08Å
119	R	96.3	Very high	97.1	Very high	83 Å²	83	44.4 Å²	44.4	31%	0.313	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	146.3	173.4	-168	-178.3	-63.2	-78.9	-3.5	110.7	D99 Y101 E116 K121 P226	D99-R119 VanDerWaalsContact CG-NH1 3.27Å; D99-R119 VanDerWaalsContact CG-NH2 3.31Å; D99-R119 IonicContact OD1-CZ 2.79Å; D99-R119 IonicContact OD1-NH1 2.72Å; D99-R119 PolarHBondContact OD1-NH1 3.34Å; D99-R119 IonicContact OD1-NH2 3.28Å; D99-R119 PolarHBondContact OD1-NH2 2.78Å; D99-R119 IonicContact OD2-CZ 3.01Å; D99-R119 VanDerWaalsContact OD2-CZ 3.28Å; D99-R119 IonicContact OD2-NH1 3.28Å; D99-R119 PolarHBondContact OD2-NH1 3.01Å; D99-R119 IonicContact OD2-NH2 3.83Å; D99-R119 PolarHBondContact OD2-NH2 2.95Å; Y101-R119 HydrophobicContact CD2-CB 3.82Å; Y101-R119 HydrophobicContact CD2-CG 3.98Å; Y101-R119 HydrophobicContact CE2-CB 4.47Å; Y101-R119 HydrophobicContact CG-CB 4.16Å; E116-R119 VanDerWaalsContact O-CB 3.25Å; E116-R119 WeakPolarHBondContact O-CB 3.41Å; E116-R119 PolarHBondContact O-N 3.04Å; E116-R119 WeakPolarHBondContact OE1-CD 3.4Å; E116-R119 IonicContact OE1-CZ 2.64Å; E116-R119 IonicContact OE1-NE 2.81Å; E116-R119 PolarHBondContact OE1-NE 3.41Å; E116-R119 IonicContact OE1-NH2 3.61Å; E116-R119 IonicContact OE2-CZ 3.56Å; E116-R119 VanDerWaalsContact OE2-CZ 3.28Å; E116-R119 IonicContact OE2-NE 3.8Å; E116-R119 PolarHBondContact OE2-NE 2.91Å; E116-R119 IonicContact OE2-NH2 3.8Å; E116-R119 PolarHBondContact OE2-NH2 2.97Å; R119-K121 VanDerWaalsContact C-N 3.28Å; R119-P226 WeakPolarHBondContact CG-O 3.32Å
120	G	95.3	Very high	96.8	Very high	21 Å²	21	38.8 Å²	38.8	22%	0.216	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.8	11.1	-175.8	0	0	0	0	0	114.3	P226 K258	G120-P226 PolarHBondContact N-O 2.97Å; G120-K258 PolarHBondContact O-NZ 3.02Å
121	K	96.6	Very high	96.4	Very high	62 Å²	62	43.4 Å²	43.4	27%	0.27	21%	0.205	S	C	.	.	S	Bend	trans	-129.8	159.7	173.2	-58	-171.1	178.2	-156.6	0	110.9	Y101 Y118 R119 S152 H153 N155 P226	Y101-K121 PolarHBondContact OH-O 2.93Å; Y118-K121 WeakPolarHBondContact O-CB 3.48Å; Y118-K121 PolarHBondContact O-N 2.86Å; R119-K121 VanDerWaalsContact C-N 3.28Å; K121-S152 WeakPolarHBondContact CE-O 3.4Å; K121-S152 PolarHBondContact NZ-O 2.65Å; K121-H153 WeakPolarHBondContact CA-O 3.41Å; K121-H153 WeakPolarHBondContact CB-O 3.34Å; K121-N155 VanDerWaalsContact CD-OD1 3.32Å; K121-N155 WeakPolarHBondContact CD-OD1 3.43Å; K121-P226 WeakPolarHBondContact O-CA 3.25Å
122	A	97.7	Very high	95.9	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	126.1	164.3	0	0	0	0	0	109.6	H153 F154 N155 L223 V224 M250 V251 I254	A122-H153 PolarHBondContact N-O 2.99Å; A122-F154 HydrophobicContact CB-CD2 3.91Å; A122-F154 CarbonylContact O-C 3.59Å; A122-F154 VanDerWaalsContact O-CA 3.23Å; A122-F154 WeakPolarHBondContact O-CA 3.3Å; A122-F154 WeakPolarHBondContact O-CD2 3.39Å; A122-N155 PolarHBondContact O-N 3.45Å; A122-L223 HydrophobicContact CB-CD1 4.32Å; A122-V224 WeakPolarHBondContact CA-O 3.26Å; A122-M250 HydrophobicContact CB-CG 3.92Å; A122-M250 HydrophobicContact CB-SD 3.43Å; A122-M250 WeakPolarHBondContact CB-SD 3.43Å; A122-V251 HydrophobicContact CB-CG2 4.28Å; A122-I254 HydrophobicContact CB-CD1 3.94Å
123	S	98.3	Very high	95.4	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	122	177.7	-60.3	0	0	0	0	111.2	Y101 N155 V224	Y101-S123 VanDerWaalsContact CE1-OG 3.29Å; Y101-S123 WeakPolarHBondContact CE1-OG 3.17Å; Y101-S123 VanDerWaalsContact OH-CB 3.3Å; Y101-S123 WeakPolarHBondContact OH-CB 3.35Å; Y101-S123 PolarHBondContact OH-OG 3.16Å; S123-N155 WeakPolarHBondContact CA-O 3.34Å; S123-N155 WeakPolarHBondContact CB-ND2 3.45Å; S123-N155 PolarHBondContact OG-ND2 2.93Å; S123-V224 PolarHBondContact N-O 2.98Å; S123-V224 PolarHBondContact O-N 3.06Å
124	L	98.5	Very high	94.9	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	101.8	169.9	-173.2	70.4	0	0	0	109.1	V126 L142 L145 F154 N155 V156 L157 K221 L223 W234 V243	L124-V126 HydrophobicContact CD2-CG2 4.31Å; L124-V126 HydrophobicContact CG-CG2 4.03Å; L124-L142 HydrophobicContact CD2-CD2 3.61Å; L124-L145 HydrophobicContact CD2-CD2 3.73Å; L124-F154 HydrophobicContact CB-CE2 3.73Å; L124-F154 HydrophobicContact CB-CZ 3.54Å; L124-F154 HydrophobicContact CD2-CZ 4.22Å; L124-N155 PolarHBondContact N-O 2.82Å; L124-V156 HydrophobicContact CD2-CG2 4.49Å; L124-V156 CarbonylContact O-C 3.54Å; L124-V156 WeakPolarHBondContact O-CA 3.49Å; L124-L157 PolarHBondContact O-N 2.89Å; L124-K221 HydrophobicContact CD1-CB 4.17Å; L124-L223 HydrophobicContact CD1-CB 4.46Å; L124-W234 HydrophobicContact CD1-CZ3 4.11Å; L124-V243 HydrophobicContact CD1-CG1 3.7Å; L124-V243 HydrophobicContact CD2-CG1 3.66Å; L124-V243 HydrophobicContact CG-CG1 4.36Å
125	V	98.6	Very high	94.6	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	131	177.9	-176.3	0	0	0	0	109.2	F100 L157 F159 F204 I207 K221 F222 V224	F100-V125 HydrophobicContact CD1-CG2 4.34Å; F100-V125 HydrophobicContact CE1-CG2 3.6Å; F100-V125 HydrophobicContact CE2-CG2 4.18Å; F100-V125 HydrophobicContact CZ-CG1 4.38Å; F100-V125 HydrophobicContact CZ-CG2 3.49Å; F100-V125 VanDerWaalsContact CZ-CG2 3.49Å; V125-L157 WeakPolarHBondContact CA-O 3.38Å; V125-L157 HydrophobicContact CG2-CB 4.26Å; V125-L157 HydrophobicContact CG2-CD1 4.15Å; V125-F159 HydrophobicContact CG1-CD2 3.69Å; V125-F159 HydrophobicContact CG1-CE2 3.72Å; V125-F204 HydrophobicContact CG1-CD2 4.4Å; V125-F204 HydrophobicContact CG1-CE2 4.13Å; V125-I207 HydrophobicContact CB-CD1 3.79Å; V125-I207 HydrophobicContact CG1-CD1 3.54Å; V125-I207 HydrophobicContact CG2-CD1 3.89Å; V125-K221 CarbonylContact O-C 3.59Å; V125-K221 WeakPolarHBondContact O-CA 3.45Å; V125-F222 HydrophobicContact CB-CB 4.43Å; V125-F222 PolarHBondContact N-O 3.26Å; V125-F222 PolarHBondContact O-N 2.81Å; V125-V224 HydrophobicContact CG2-CG2 3.87Å
126	V	98.4	Very high	94.3	Very high	0 Å²	0	44 Å²	44	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	133.4	-175.6	-172.6	0	0	0	0	110.4	L124 V128 L142 V156 L157 F159 F219 W220 K221	L124-V126 HydrophobicContact CD2-CG2 4.31Å; L124-V126 HydrophobicContact CG-CG2 4.03Å; V126-V128 HydrophobicContact CB-CG1 4.28Å; V126-V128 HydrophobicContact CG1-CG1 3.89Å; V126-L142 HydrophobicContact CG1-CD1 4.13Å; V126-L142 HydrophobicContact CG2-CD1 4.23Å; V126-L142 HydrophobicContact CG2-CD2 3.93Å; V126-V156 HydrophobicContact CG2-CG1 4.46Å; V126-L157 PolarHBondContact N-O 2.77Å; V126-F159 PolarHBondContact O-N 2.93Å; V126-F219 HydrophobicContact CG1-CD1 4.21Å; V126-W220 WeakPolarHBondContact CA-O 3.32Å; V126-K221 HydrophobicContact CG1-CG 4.43Å; V126-K221 HydrophobicContact CG2-CB 4.36Å; V126-K221 HydrophobicContact CG2-CG 4.41Å
127	N	97.6	Very high	94.1	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	124.3	164.8	69	-59.7	0	0	0	110.1	F159 F164 I195 F204 W217 N218 F219 W220	N127-F159 CarbonylContact C-O 3.33Å; N127-F159 VanDerWaalsContact CA-O 3.27Å; N127-F159 WeakPolarHBondContact CA-O 3.45Å; N127-F164 WeakPolarHBondContact ND2-CE2 3.37Å; N127-I195 HydrophobicContact CB-CD1 3.49Å; N127-I195 VanDerWaalsContact CB-CD1 3.49Å; N127-F204 HydrophobicContact CB-CE2 4.05Å; N127-F204 HydrophobicContact CB-CZ 3.91Å; N127-W217 PolarHBondContact ND2-O 2.86Å; N127-N218 WeakPolarHBondContact ND2-CA 3.27Å; N127-F219 VanDerWaalsContact O-CA 3.24Å; N127-F219 WeakPolarHBondContact O-CA 3.48Å; N127-F219 PolarHBondContact O-N 2.77Å; N127-W220 PolarHBondContact N-O 2.87Å; N127-W220 WeakPolarHBondContact OD1-CA 3.16Å; N127-W220 WeakPolarHBondContact OD1-CB 3.48Å; N127-W220 PolarHBondContact OD1-N 3.28Å; N127-W220 PolarHBondContact OD1-O 3.14Å
128	V	96.8	Very high	94	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	160.7	-172.6	-59.8	0	0	0	0	112.3	V126 Y139 A158 F159 P160 C161 F219	V126-V128 HydrophobicContact CB-CG1 4.28Å; V126-V128 HydrophobicContact CG1-CG1 3.89Å; V128-Y139 HydrophobicContact CB-CE1 4.49Å; V128-Y139 HydrophobicContact CG1-CE1 4.38Å; V128-Y139 WeakPolarHBondContact CG2-OH 3.39Å; V128-A158 HydrophobicContact CG1-CB 3.98Å; V128-A158 HydrophobicContact CG2-CB 4.14Å; V128-F159 PolarHBondContact N-O 3.11Å; V128-P160 HydrophobicContact CG2-CB 4.31Å; V128-P160 HydrophobicContact CG2-CG 4.03Å; V128-P160 WeakPolarHBondContact O-CA 3.46Å; V128-C161 PolarHBondContact O-N 2.83Å; V128-F219 HydrophobicContact CB-CE1 3.95Å; V128-F219 HydrophobicContact CG1-CD1 4.19Å; V128-F219 HydrophobicContact CG1-CE1 3.87Å
129	A	95.3	Very high	94	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.179	C	C	.	.			trans	-147.7	152.8	170.8	0	0	0	0	0	111.3	T135 T167 E168 N218 F219	A129-T135 WeakPolarHBondContact O-CG2 3.21Å; A129-T135 PolarHBondContact O-OG1 2.64Å; A129-T167 WeakPolarHBondContact CB-OG1 3.21Å; A129-E168 WeakPolarHBondContact CA-OE1 3.27Å; A129-E168 HydrophobicContact CB-CB 4.3Å; A129-N218 HydrophobicContact CB-CB 4.25Å; A129-N218 VanDerWaalsContact CB-CG 3.47Å; A129-N218 WeakPolarHBondContact CB-ND2 3.34Å; A129-F219 WeakPolarHBondContact O-CZ 3.45Å
130	S	91.1	Very high	94	Very high	13 Å²	13	40.5 Å²	40.5	9%	0.091	19%	0.194	C	C	.	.	S	Bend	trans	-88.2	-23.3	-177.6	-57.2	0	0	0	0	113.8	E168 N178	S130-E168 WeakPolarHBondContact CB-OE2 3.22Å; S130-E168 PolarHBondContact N-OE2 3Å; S130-E168 PolarHBondContact OG-OE1 3.35Å; S130-E168 PolarHBondContact OG-OE2 2.86Å; S130-N178 WeakPolarHBondContact CB-ND2 3.39Å; S130-N178 PolarHBondContact OG-ND2 3.2Å
131	H	88	Confident	94	Very high	138 Å²	138	41 Å²	41	64%	0.639	19%	0.194	S	C	*	.	S	Bend	trans	-125.6	54	-173.4	-53.9	-57.5	0	0	0	112.1	T167	H131-T167 PolarHBondContact N-O 3.19Å; H131-T167 VanDerWaalsContact N-O 3.12Å; H131-T167 WeakPolarHBondContact O-CB 3.38Å; H131-T167 WeakPolarHBondContact O-CG2 3.33Å
132	S	86.9	Confident	94	Very high	16 Å²	16	38.1 Å²	38.1	11%	0.112	18%	0.182	C	C	.	.	S	Bend	trans	-122.5	148	176.2	178.7	0	0	0	0	110.5	H134 T135	S132-H134 PolarHBondContact O-N 3.18Å; S132-T135 PolarHBondContact N-OG1 3.49Å; S132-T135 VanDerWaalsContact N-OG1 3.16Å; S132-T135 WeakPolarHBondContact O-CB 3.44Å; S132-T135 PolarHBondContact O-N 3.09Å; S132-T135 PolarHBondContact O-OG1 3.15Å
133	E	86.6	Confident	93.9	Very high	152 Å²	152	39.6 Å²	39.6	71%	0.71	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-23.3	178	73.7	-154.7	119.1	0	0	113.9
134	H	86.1	Confident	93.7	Very high	51 Å²	51	42.8 Å²	42.8	24%	0.236	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-3.3	-179.4	-61	-33.6	0	0	0	114.1	S132 N138 F219	S132-H134 PolarHBondContact O-N 3.18Å; H134-N138 WeakPolarHBondContact O-CB 3.14Å; H134-N138 PolarHBondContact O-N 2.91Å; H134-N138 VanDerWaalsContact O-N 3.09Å; H134-N138 PolarHBondContact O-ND2 3.19Å; H134-F219 HydrophobicContact CB-CD2 3.88Å; H134-F219 HydrophobicContact CB-CE2 4.25Å
135	T	91.6	Very high	93.6	Very high	5 Å²	5	42.8 Å²	42.8	3%	0.031	20%	0.204	C	C	.	.	H	α-helix	trans	-59.3	-55.3	-169	-70.8	0	0	0	0	113	A129 S132 N137 N138 Y139	A129-T135 WeakPolarHBondContact O-CG2 3.21Å; A129-T135 PolarHBondContact O-OG1 2.64Å; S132-T135 PolarHBondContact N-OG1 3.49Å; S132-T135 VanDerWaalsContact N-OG1 3.16Å; S132-T135 WeakPolarHBondContact O-CB 3.44Å; S132-T135 PolarHBondContact O-N 3.09Å; S132-T135 PolarHBondContact O-OG1 3.15Å; T135-N137 PolarHBondContact O-N 3.11Å; T135-N138 PolarHBondContact O-N 3.38Å; T135-Y139 HydrophobicContact CG2-CD2 3.57Å; T135-Y139 HydrophobicContact CG2-CE2 3.78Å; T135-Y139 PolarHBondContact O-N 2.88Å
136	E	91.7	Very high	93.4	Very high	93 Å²	93	44.2 Å²	44.2	44%	0.435	21%	0.21	S	C	.	.	H	α-helix	trans	-58.2	-50.1	-177.1	-70.3	-60.2	156	0	0	113	N138 R140 H183	E136-N138 PolarHBondContact O-N 3.39Å; E136-R140 VanDerWaalsContact O-CB 3.25Å; E136-R140 WeakPolarHBondContact O-CB 3.42Å; E136-R140 PolarHBondContact O-N 3.47Å; E136-H183 VanDerWaalsContact CD-CE1 3.5Å; E136-H183 IonicContact OE1-CE1 3.48Å; E136-H183 PolarHBondContact OE1-CE1 2.9Å; E136-H183 IonicContact OE1-ND1 3.2Å; E136-H183 PolarHBondContact OE1-ND1 2.96Å; E136-H183 IonicContact OE2-CE1 3.01Å; E136-H183 PolarHBondContact OE2-CE1 3.39Å; E136-H183 IonicContact OE2-ND1 3.16Å; E136-H183 PolarHBondContact OE2-ND1 2.91Å
137	N	92.6	Very high	93.3	Very high	112 Å²	112	51.6 Å²	51.6	60%	0.599	24%	0.238	S	C	*	.	H	α-helix	trans	-67.9	-36.8	-176.5	-73.1	-2.9	0	0	0	111.6	T135 S141	T135-N137 PolarHBondContact O-N 3.11Å; N137-S141 VanDerWaalsContact O-CB 3.32Å; N137-S141 WeakPolarHBondContact O-CB 3.47Å; N137-S141 PolarHBondContact O-N 3.14Å; N137-S141 VanDerWaalsContact O-N 3.14Å; N137-S141 PolarHBondContact O-OG 2.93Å
138	N	94.6	Very high	93	Very high	19 Å²	19	55.6 Å²	55.6	10%	0.102	26%	0.257	C	S	.	.	H	α-helix	trans	-71.9	-48.4	176.7	-80.5	-92.6	0	0	0	111.8	H134 T135 E136 R140 S141 L142 F219 K221	H134-N138 WeakPolarHBondContact O-CB 3.14Å; H134-N138 PolarHBondContact O-N 2.91Å; H134-N138 VanDerWaalsContact O-N 3.09Å; H134-N138 PolarHBondContact O-ND2 3.19Å; T135-N138 PolarHBondContact O-N 3.38Å; E136-N138 PolarHBondContact O-N 3.39Å; N138-R140 VanDerWaalsContact C-N 3.34Å; N138-R140 PolarHBondContact O-N 3.4Å; N138-S141 PolarHBondContact O-N 2.68Å; N138-L142 HydrophobicContact CB-CD1 4.46Å; N138-L142 VanDerWaalsContact O-CB 3.26Å; N138-L142 WeakPolarHBondContact O-CB 3.38Å; N138-L142 WeakPolarHBondContact O-CD1 3.45Å; N138-L142 WeakPolarHBondContact O-CG 3.43Å; N138-L142 PolarHBondContact O-N 3.47Å; N138-F219 HydrophobicContact CB-CB 4.32Å; N138-F219 HydrophobicContact CB-CD1 3.4Å; N138-F219 VanDerWaalsContact CB-CD1 3.4Å; N138-F219 HydrophobicContact CB-CD2 4.31Å; N138-F219 HydrophobicContact CB-CE1 3.69Å; N138-F219 HydrophobicContact CB-CG 3.75Å; N138-F219 HydrophobicContact CB-CZ 4.26Å; N138-K221 WeakPolarHBondContact OD1-CE 3.34Å; N138-K221 PolarHBondContact OD1-NZ 2.8Å
139	Y	96	Very high	92.9	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-60.4	-43.1	179.3	-86.3	-59.4	0	0	0	112.4	V128 T135 Q143 A179 H183 V185 F187 F219	V128-Y139 HydrophobicContact CB-CE1 4.49Å; V128-Y139 HydrophobicContact CG1-CE1 4.38Å; V128-Y139 WeakPolarHBondContact CG2-OH 3.39Å; T135-Y139 HydrophobicContact CG2-CD2 3.57Å; T135-Y139 HydrophobicContact CG2-CE2 3.78Å; T135-Y139 PolarHBondContact O-N 2.88Å; Y139-Q143 VanDerWaalsContact O-CB 3.3Å; Y139-Q143 WeakPolarHBondContact O-CB 3.5Å; Y139-Q143 PolarHBondContact O-N 3.08Å; Y139-A179 HydrophobicContact CE1-CB 3.99Å; Y139-A179 HydrophobicContact CE2-CB 4.39Å; Y139-H183 AromaticContact CD2-CD2 3.25Å; Y139-H183 WeakPolarHBondContact CD2-CD2 3.49Å; Y139-H183 AromaticContact CD2-NE2 3.3Å; Y139-H183 VanDerWaalsContact CD2-NE2 3.3Å; Y139-H183 WeakPolarHBondContact CD2-NE2 3.46Å; Y139-H183 AromaticContact CE2-CD2 3.86Å; Y139-H183 AromaticContact CE2-NE2 3.78Å; Y139-H183 HydrophobicContact CG-CB 4.43Å; Y139-H183 AromaticContact CG-CD2 3.5Å; Y139-V185 HydrophobicContact CD1-CG1 3.84Å; Y139-V185 HydrophobicContact CG-CG1 4.47Å; Y139-F187 HydrophobicContact CD1-CE2 4.45Å; Y139-F187 AromaticContact CD1-CZ 3.89Å; Y139-F187 HydrophobicContact CD1-CZ 3.89Å; Y139-F187 HydrophobicContact CE1-CE2 4.29Å; Y139-F187 HydrophobicContact CE1-CZ 4.18Å; Y139-F219 HydrophobicContact CE2-CZ 4.45Å
140	R	95	Very high	92.1	Very high	169 Å²	169	57.4 Å²	57.4	64%	0.638	27%	0.271	S	S	*	.	H	α-helix	trans	-57.9	-51.3	174.8	-173.7	-177.4	-58.5	-158.5	1	111.9	E136 N138 Q143 E144	E136-R140 VanDerWaalsContact O-CB 3.25Å; E136-R140 WeakPolarHBondContact O-CB 3.42Å; E136-R140 PolarHBondContact O-N 3.47Å; N138-R140 VanDerWaalsContact C-N 3.34Å; N138-R140 PolarHBondContact O-N 3.4Å; R140-Q143 PolarHBondContact O-N 3.45Å; R140-E144 PolarHBondContact O-N 2.85Å
141	S	95.2	Very high	91.3	Very high	30 Å²	30	62.7 Å²	62.7	21%	0.21	30%	0.302	C	S	.	.	H	α-helix	trans	-70.8	-35	-175.4	-49.7	0	0	0	0	112.6	N137 N138 L145	N137-S141 VanDerWaalsContact O-CB 3.32Å; N137-S141 WeakPolarHBondContact O-CB 3.47Å; N137-S141 PolarHBondContact O-N 3.14Å; N137-S141 VanDerWaalsContact O-N 3.14Å; N137-S141 PolarHBondContact O-OG 2.93Å; N138-S141 PolarHBondContact O-N 2.68Å; S141-L145 WeakPolarHBondContact O-CB 3.48Å; S141-L145 PolarHBondContact O-N 2.82Å
142	L	96.6	Very high	90.5	Very high	2 Å²	2	59.2 Å²	59.2	1%	0.01	29%	0.294	C	S	.	.	H	α-helix	trans	-67.8	-38.9	174.1	-70.9	169.2	0	0	0	111.7	L124 V126 N138 H146 V156 F187	L124-L142 HydrophobicContact CD2-CD2 3.61Å; V126-L142 HydrophobicContact CG1-CD1 4.13Å; V126-L142 HydrophobicContact CG2-CD1 4.23Å; V126-L142 HydrophobicContact CG2-CD2 3.93Å; N138-L142 HydrophobicContact CB-CD1 4.46Å; N138-L142 VanDerWaalsContact O-CB 3.26Å; N138-L142 WeakPolarHBondContact O-CB 3.38Å; N138-L142 WeakPolarHBondContact O-CD1 3.45Å; N138-L142 WeakPolarHBondContact O-CG 3.43Å; N138-L142 PolarHBondContact O-N 3.47Å; L142-H146 VanDerWaalsContact O-CB 3.23Å; L142-H146 WeakPolarHBondContact O-CB 3.42Å; L142-H146 PolarHBondContact O-N 2.96Å; L142-V156 HydrophobicContact CD2-CG1 4.32Å; L142-V156 HydrophobicContact CD2-CG2 4.33Å; L142-F187 HydrophobicContact CB-CE1 3.89Å; L142-F187 HydrophobicContact CB-CZ 4.08Å
143	Q	96.4	Very high	90.8	Very high	31 Å²	31	60.2 Å²	60.2	15%	0.145	30%	0.296	C	S	.	.	H	α-helix	trans	-70.3	-36.8	177.6	179.5	55.1	19.9	0	0	111.8	Y139 R140 H146 R147 V185 T186 F187	Y139-Q143 VanDerWaalsContact O-CB 3.3Å; Y139-Q143 WeakPolarHBondContact O-CB 3.5Å; Y139-Q143 PolarHBondContact O-N 3.08Å; R140-Q143 PolarHBondContact O-N 3.45Å; Q143-H146 PolarHBondContact O-N 3.02Å; Q143-R147 VanDerWaalsContact O-CB 3.31Å; Q143-R147 WeakPolarHBondContact O-CB 3.38Å; Q143-R147 PolarHBondContact O-N 3.24Å; Q143-V185 HydrophobicContact CB-CG1 4.23Å; Q143-T186 PolarHBondContact NE2-OG1 3.42Å; Q143-T186 PolarHBondContact OE1-OG1 2.92Å; Q143-F187 HydrophobicContact CB-CE1 4.15Å
144	E	95.1	Very high	91.3	Very high	67 Å²	67	53 Å²	53	31%	0.313	26%	0.263	S	S	.	.	H	α-helix	trans	-62.7	-51.1	171.4	172.9	158.7	-82.2	0	0	112.1	R140 H146 R147 E148 R244	R140-E144 PolarHBondContact O-N 2.85Å; E144-H146 VanDerWaalsContact C-N 3.25Å; E144-H146 PolarHBondContact O-N 3.42Å; E144-R147 WeakPolarHBondContact O-CB 3.38Å; E144-R147 PolarHBondContact O-N 2.96Å; E144-R147 VanDerWaalsContact O-N 3.09Å; E144-R147 IonicContact OE1-CZ 2.77Å; E144-R147 IonicContact OE1-NH2 2.9Å; E144-R147 PolarHBondContact OE1-NH2 3.42Å; E144-E148 WeakPolarHBondContact CG-OE1 3.36Å; E144-E148 PolarHBondContact O-N 3.14Å; E144-R244 IonicContact OE2-CZ 2.91Å; E144-R244 IonicContact OE2-NH1 2.69Å; E144-R244 PolarHBondContact OE2-NH1 3.44Å; E144-R244 IonicContact OE2-NH2 3.96Å; E144-R244 PolarHBondContact OE2-NH2 3.5Å
145	L	95.1	Very high	91.8	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-58.5	-38.9	176.7	-176.2	67.5	0	0	0	111.8	L124 S141 L149 F154 V243 R244	L124-L145 HydrophobicContact CD2-CD2 3.73Å; S141-L145 WeakPolarHBondContact O-CB 3.48Å; S141-L145 PolarHBondContact O-N 2.82Å; L145-L149 HydrophobicContact CD1-CD1 3.61Å; L145-L149 HydrophobicContact CD1-CG 4.23Å; L145-L149 HydrophobicContact CG-CD1 4.33Å; L145-L149 PolarHBondContact O-N 2.96Å; L145-L149 VanDerWaalsContact O-N 3.09Å; L145-F154 HydrophobicContact CD2-CE1 4.12Å; L145-F154 HydrophobicContact CD2-CZ 3.72Å; L145-F154 HydrophobicContact CG-CE1 3.81Å; L145-F154 HydrophobicContact CG-CZ 3.9Å; L145-V243 HydrophobicContact CD2-CG1 4.22Å; L145-R244 HydrophobicContact CD1-CB 4.04Å; L145-R244 HydrophobicContact CD1-CG 3.79Å
146	H	95.8	Very high	92.1	Very high	29 Å²	29	50.7 Å²	50.7	13%	0.134	25%	0.252	C	S	.	.	H	α-helix	trans	-67.6	-39.8	175.4	-175.9	45.3	0	0	0	112.7	L142 Q143 E144 G150 V156 T186 F187	L142-H146 VanDerWaalsContact O-CB 3.23Å; L142-H146 WeakPolarHBondContact O-CB 3.42Å; L142-H146 PolarHBondContact O-N 2.96Å; Q143-H146 PolarHBondContact O-N 3.02Å; E144-H146 VanDerWaalsContact C-N 3.25Å; E144-H146 PolarHBondContact O-N 3.42Å; H146-G150 WeakPolarHBondContact O-CA 3.36Å; H146-G150 PolarHBondContact O-N 3.41Å; H146-V156 HydrophobicContact CB-CG2 3.97Å; H146-T186 PolarHBondContact CD2-OG1 2.75Å; H146-F187 HydrophobicContact CB-CD1 4.07Å; H146-F187 AromaticContact CD2-CD1 3.97Å
147	R	94.4	Very high	92.4	Very high	156 Å²	156	46.2 Å²	46.2	59%	0.589	23%	0.231	S	C	*	.	H	α-helix	trans	-63.9	-41.7	175.2	178.6	-171.5	66.4	-161.1	-5	112	Q143 E144	Q143-R147 VanDerWaalsContact O-CB 3.31Å; Q143-R147 WeakPolarHBondContact O-CB 3.38Å; Q143-R147 PolarHBondContact O-N 3.24Å; E144-R147 WeakPolarHBondContact O-CB 3.38Å; E144-R147 PolarHBondContact O-N 2.96Å; E144-R147 VanDerWaalsContact O-N 3.09Å; E144-R147 IonicContact OE1-CZ 2.77Å; E144-R147 IonicContact OE1-NH2 2.9Å; E144-R147 PolarHBondContact OE1-NH2 3.42Å
148	E	92.9	Very high	92.7	Very high	84 Å²	84	40.9 Å²	40.9	39%	0.393	20%	0.203	S	C	.	.	H	α-helix	trans	-71.8	-49	-178	-75.2	169.2	-154.6	0	0	113	E144 R244	E144-E148 WeakPolarHBondContact CG-OE1 3.36Å; E144-E148 PolarHBondContact O-N 3.14Å; E148-R244 IonicContact OE1-NH1 3.03Å; E148-R244 PolarHBondContact OE1-NH1 2.67Å; E148-R244 IonicContact OE2-CZ 2.68Å; E148-R244 IonicContact OE2-NH1 2.82Å; E148-R244 PolarHBondContact OE2-NH1 3.16Å
149	L	92.9	Very high	92.9	Very high	19 Å²	19	40 Å²	40	10%	0.099	20%	0.198	C	C	.	.	H	α-helix	trans	-98.2	-19.8	-172	-58.9	-178	0	0	0	113.8	L145 T151 F154 A247 T248 V251	L145-L149 HydrophobicContact CD1-CD1 3.61Å; L145-L149 HydrophobicContact CD1-CG 4.23Å; L145-L149 HydrophobicContact CG-CD1 4.33Å; L145-L149 PolarHBondContact O-N 2.96Å; L145-L149 VanDerWaalsContact O-N 3.09Å; L149-T151 VanDerWaalsContact C-N 3.26Å; L149-T151 PolarHBondContact O-N 3.43Å; L149-F154 HydrophobicContact CB-CB 3.55Å; L149-F154 HydrophobicContact CB-CD1 3.67Å; L149-F154 HydrophobicContact CB-CG 3.73Å; L149-F154 HydrophobicContact CD1-CD1 4.4Å; L149-F154 HydrophobicContact CD1-CD2 4.44Å; L149-F154 HydrophobicContact CD1-CG 4.29Å; L149-F154 WeakPolarHBondContact O-CB 3.23Å; L149-A247 HydrophobicContact CD1-CB 3.73Å; L149-T248 HydrophobicContact CD2-CG2 4.44Å; L149-V251 HydrophobicContact CB-CG2 4.36Å; L149-V251 HydrophobicContact CD1-CG2 4.36Å; L149-V251 HydrophobicContact CD2-CG1 4.45Å
150	G	80	Confident	92.9	Very high	19 Å²	19	40 Å²	40	20%	0.196	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-5.8	-165.6	0	0	0	0	0	116.4	H146 S152 F154	H146-G150 WeakPolarHBondContact O-CA 3.36Å; H146-G150 PolarHBondContact O-N 3.41Å; G150-S152 VanDerWaalsContact C-N 3.28Å; G150-S152 PolarHBondContact O-N 2.94Å; G150-F154 WeakPolarHBondContact CA-O 3.26Å
151	T	72.9	Confident	93	Very high	123 Å²	123	32 Å²	32	76%	0.755	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-35.6	-175.5	50	0	0	0	0	113.7	L149	L149-T151 VanDerWaalsContact C-N 3.26Å; L149-T151 PolarHBondContact O-N 3.43Å
152	S	72	Confident	92.7	Very high	65 Å²	65	31.9 Å²	31.9	46%	0.455	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-139.8	-45	176.9	-68.1	0	0	0	0	114.4	K121 G150	K121-S152 WeakPolarHBondContact CE-O 3.4Å; K121-S152 PolarHBondContact NZ-O 2.65Å; G150-S152 VanDerWaalsContact C-N 3.28Å; G150-S152 PolarHBondContact O-N 2.94Å
153	H	92.9	Very high	92.5	Very high	37 Å²	37	35.1 Å²	35.1	17%	0.171	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.4	4.6	-158.5	-61.4	-60.7	0	0	0	115.7	K121 A122 V251 I254 I255	K121-H153 WeakPolarHBondContact CA-O 3.41Å; K121-H153 WeakPolarHBondContact CB-O 3.34Å; A122-H153 PolarHBondContact N-O 2.99Å; H153-V251 HydrophobicContact CB-CG1 4.21Å; H153-V251 HydrophobicContact CB-CG2 4.41Å; H153-I254 HydrophobicContact CB-CB 4.47Å; H153-I254 HydrophobicContact CB-CD1 4.42Å; H153-I254 HydrophobicContact CB-CG2 4.04Å; H153-I254 WeakPolarHBondContact ND1-CG2 3.25Å; H153-I255 WeakPolarHBondContact CD2-CG1 3.43Å
154	F	97.3	Very high	92.1	Very high	1 Å²	1	34.1 Å²	34.1	0%	0.004	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	157.5	178.9	-179.5	-105.6	0	0	0	112.4	A122 L124 L145 L149 G150 V156 A247 V251	A122-F154 HydrophobicContact CB-CD2 3.91Å; A122-F154 CarbonylContact O-C 3.59Å; A122-F154 VanDerWaalsContact O-CA 3.23Å; A122-F154 WeakPolarHBondContact O-CA 3.3Å; A122-F154 WeakPolarHBondContact O-CD2 3.39Å; L124-F154 HydrophobicContact CB-CE2 3.73Å; L124-F154 HydrophobicContact CB-CZ 3.54Å; L124-F154 HydrophobicContact CD2-CZ 4.22Å; L145-F154 HydrophobicContact CD2-CE1 4.12Å; L145-F154 HydrophobicContact CD2-CZ 3.72Å; L145-F154 HydrophobicContact CG-CE1 3.81Å; L145-F154 HydrophobicContact CG-CZ 3.9Å; L149-F154 HydrophobicContact CB-CB 3.55Å; L149-F154 HydrophobicContact CB-CD1 3.67Å; L149-F154 HydrophobicContact CB-CG 3.73Å; L149-F154 HydrophobicContact CD1-CD1 4.4Å; L149-F154 HydrophobicContact CD1-CD2 4.44Å; L149-F154 HydrophobicContact CD1-CG 4.29Å; L149-F154 WeakPolarHBondContact O-CB 3.23Å; G150-F154 WeakPolarHBondContact CA-O 3.26Å; F154-V156 HydrophobicContact CE1-CG2 3.8Å; F154-V156 HydrophobicContact CZ-CG2 4.09Å; F154-A247 HydrophobicContact CD2-CB 4.36Å; F154-A247 HydrophobicContact CE2-CB 3.85Å; F154-A247 HydrophobicContact CZ-CB 4.41Å; F154-V251 HydrophobicContact CB-CG2 3.83Å
155	N	96.6	Very high	91.4	Very high	7 Å²	7	33.5 Å²	33.5	4%	0.037	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	141.7	163.4	43	-113	0	0	0	112.1	Y118 K121 A122 S123 L124	Y118-N155 WeakPolarHBondContact CD1-OD1 3.34Å; K121-N155 VanDerWaalsContact CD-OD1 3.32Å; K121-N155 WeakPolarHBondContact CD-OD1 3.43Å; A122-N155 PolarHBondContact O-N 3.45Å; S123-N155 WeakPolarHBondContact CA-O 3.34Å; S123-N155 WeakPolarHBondContact CB-ND2 3.45Å; S123-N155 PolarHBondContact OG-ND2 2.93Å; L124-N155 PolarHBondContact N-O 2.82Å
156	V	98.1	Very high	90.7	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	139.1	163.5	177.1	0	0	0	0	108.5	L124 V126 L142 H146 F154 F187 P188	L124-V156 HydrophobicContact CD2-CG2 4.49Å; L124-V156 CarbonylContact O-C 3.54Å; L124-V156 WeakPolarHBondContact O-CA 3.49Å; V126-V156 HydrophobicContact CG2-CG1 4.46Å; L142-V156 HydrophobicContact CD2-CG1 4.32Å; L142-V156 HydrophobicContact CD2-CG2 4.33Å; H146-V156 HydrophobicContact CB-CG2 3.97Å; F154-V156 HydrophobicContact CE1-CG2 3.8Å; F154-V156 HydrophobicContact CZ-CG2 4.09Å; V156-F187 HydrophobicContact CB-CB 3.9Å; V156-F187 HydrophobicContact CB-CD1 3.95Å; V156-F187 HydrophobicContact CB-CD2 4.29Å; V156-F187 HydrophobicContact CB-CE1 4.49Å; V156-F187 HydrophobicContact CB-CG 3.82Å; V156-F187 HydrophobicContact CG1-CB 4.45Å; V156-F187 HydrophobicContact CG1-CD1 4.13Å; V156-F187 HydrophobicContact CG1-CD2 3.92Å; V156-F187 HydrophobicContact CG1-CE1 4.25Å; V156-F187 HydrophobicContact CG1-CE2 4.06Å; V156-F187 HydrophobicContact CG1-CG 3.94Å; V156-F187 HydrophobicContact CG1-CZ 4.19Å; V156-F187 HydrophobicContact CG2-CD1 4.44Å; V156-P188 WeakPolarHBondContact O-CD 3.44Å
157	L	98.4	Very high	90	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	102.8	177.4	-59.9	-179.4	0	0	0	108.4	F100 Y118 L124 V125 V126 F159 P188 F190	F100-L157 HydrophobicContact CE1-CD1 3.66Å; F100-L157 HydrophobicContact CZ-CD1 4.14Å; Y118-L157 HydrophobicContact CD1-CD2 4.05Å; Y118-L157 HydrophobicContact CD2-CD1 4.22Å; Y118-L157 HydrophobicContact CD2-CD2 4.08Å; Y118-L157 HydrophobicContact CE1-CD2 3.82Å; Y118-L157 HydrophobicContact CE2-CD2 3.88Å; Y118-L157 HydrophobicContact CG-CD1 4.41Å; Y118-L157 HydrophobicContact CG-CD2 4.17Å; L124-L157 PolarHBondContact O-N 2.89Å; V125-L157 WeakPolarHBondContact CA-O 3.38Å; V125-L157 HydrophobicContact CG2-CB 4.26Å; V125-L157 HydrophobicContact CG2-CD1 4.15Å; V126-L157 PolarHBondContact N-O 2.77Å; L157-F159 HydrophobicContact CB-CE2 4.03Å; L157-P188 HydrophobicContact CD2-CG 3.66Å; L157-F190 HydrophobicContact CB-CE2 3.97Å; L157-F190 HydrophobicContact CD2-CE2 3.96Å; L157-F190 HydrophobicContact CD2-CZ 4.18Å; L157-F190 HydrophobicContact CG-CE2 4.48Å
158	A	98.3	Very high	89.6	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	123.5	-171.2	0	0	0	0	0	112.3	V128 F187 P188 I189 F190	V128-A158 HydrophobicContact CG1-CB 3.98Å; V128-A158 HydrophobicContact CG2-CB 4.14Å; A158-F187 HydrophobicContact CB-CD2 3.95Å; A158-F187 HydrophobicContact CB-CE2 3.66Å; A158-P188 PolarHBondContact N-O 2.9Å; A158-P188 VanDerWaalsContact N-O 3.14Å; A158-I189 HydrophobicContact CB-CG1 4.18Å; A158-I189 WeakPolarHBondContact O-CA 3.33Å; A158-F190 WeakPolarHBondContact O-CD2 3.4Å; A158-F190 PolarHBondContact O-N 3Å
159	F	98.3	Very high	89.3	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	103.9	-178.8	-71.3	-91.1	0	0	0	110.3	F100 V105 V125 V126 N127 V128 L157 F190 I193 F204	F100-F159 HydrophobicContact CZ-CE2 4.31Å; F100-F159 HydrophobicContact CZ-CZ 4.38Å; V105-F159 HydrophobicContact CB-CE1 4.14Å; V105-F159 HydrophobicContact CG1-CE1 3.96Å; V105-F159 HydrophobicContact CG1-CZ 4.29Å; V105-F159 HydrophobicContact CG2-CE1 4.19Å; V105-F159 HydrophobicContact CG2-CZ 4.33Å; V125-F159 HydrophobicContact CG1-CD2 3.69Å; V125-F159 HydrophobicContact CG1-CE2 3.72Å; V126-F159 PolarHBondContact O-N 2.93Å; N127-F159 CarbonylContact C-O 3.33Å; N127-F159 VanDerWaalsContact CA-O 3.27Å; N127-F159 WeakPolarHBondContact CA-O 3.45Å; V128-F159 PolarHBondContact N-O 3.11Å; L157-F159 HydrophobicContact CB-CE2 4.03Å; F159-F190 HydrophobicContact CD1-CB 3.78Å; F159-F190 HydrophobicContact CD1-CD2 4.14Å; F159-F190 HydrophobicContact CD1-CG 4.16Å; F159-F190 HydrophobicContact CD2-CD2 4.16Å; F159-F190 HydrophobicContact CE1-CB 3.79Å; F159-F190 HydrophobicContact CE1-CD1 4.48Å; F159-F190 AromaticContact CE1-CD2 3.74Å; F159-F190 HydrophobicContact CE1-CD2 3.74Å; F159-F190 AromaticContact CE1-CG 3.73Å; F159-F190 HydrophobicContact CE1-CG 3.73Å; F159-F190 AromaticContact CE2-CD2 3.76Å; F159-F190 HydrophobicContact CE2-CD2 3.76Å; F159-F190 HydrophobicContact CE2-CE2 4.06Å; F159-F190 HydrophobicContact CG-CB 4.46Å; F159-F190 HydrophobicContact CG-CD2 4.34Å; F159-F190 HydrophobicContact CZ-CB 4.48Å; F159-F190 AromaticContact CZ-CD2 3.54Å; F159-F190 HydrophobicContact CZ-CD2 3.54Å; F159-F190 AromaticContact CZ-CE2 3.91Å; F159-F190 HydrophobicContact CZ-CE2 3.91Å; F159-F190 AromaticContact CZ-CG 3.97Å; F159-F190 HydrophobicContact CZ-CG 3.97Å; F159-I193 HydrophobicContact CB-CD1 3.76Å; F159-I193 HydrophobicContact CB-CG1 4.12Å; F159-I193 HydrophobicContact CD1-CD1 4.15Å; F159-I193 HydrophobicContact CD1-CG2 4.1Å; F159-I193 HydrophobicContact CG-CD1 4.24Å; F159-F204 HydrophobicContact CB-CD2 4.26Å; F159-F204 HydrophobicContact CB-CE2 4.38Å; F159-F204 HydrophobicContact CD2-CD2 4.45Å; F159-F204 HydrophobicContact CG-CD2 4.3Å
160	P	97.7	Very high	89.1	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	139.4	177.5	-24.2	34.9	0	0	0	112.3	V128 E168 I175 I189 F190 K192 I193	V128-P160 HydrophobicContact CG2-CB 4.31Å; V128-P160 HydrophobicContact CG2-CG 4.03Å; V128-P160 WeakPolarHBondContact O-CA 3.46Å; P160-E168 HydrophobicContact CB-CG 4.08Å; P160-E168 WeakPolarHBondContact CB-OE1 3.49Å; P160-I175 HydrophobicContact CB-CD1 4.13Å; P160-I175 HydrophobicContact CB-CG2 3.94Å; P160-I175 HydrophobicContact CG-CG2 3.61Å; P160-I189 HydrophobicContact CG-CG2 3.72Å; P160-F190 WeakPolarHBondContact CD-O 3.44Å; P160-K192 HydrophobicContact CB-CB 4.13Å; P160-K192 HydrophobicContact CB-CG 4.26Å; P160-K192 CarbonylContact O-C 3.59Å; P160-K192 WeakPolarHBondContact O-CA 3.38Å; P160-I193 WeakPolarHBondContact O-CG1 3.27Å; P160-I193 PolarHBondContact O-N 3.43Å
161	C	95.3	Very high	89.8	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	23%	0.234	C	C	.	.	B	Isolated β-bridge	trans	-141.9	120.4	178.9	-173.3	0	0	0	0	112.7	V128 F164 I195	V128-C161 PolarHBondContact O-N 2.83Å; C161-F164 HydrophobicContact CB-CE2 4.42Å; C161-I195 HydrophobicContact CB-CD1 3.85Å; C161-I195 HydrophobicContact CB-CG1 4.4Å
162	G	90.8	Very high	90.9	Very high	29 Å²	29	33.6 Å²	33.6	30%	0.299	21%	0.207	S	C	.	.			trans	-88.4	7.6	179.7	0	0	0	0	0	115.8	F164	G162-F164 VanDerWaalsContact C-N 3.28Å; G162-F164 PolarHBondContact O-N 3.01Å
163	Q	91.1	Very high	92.1	Very high	69 Å²	69	38.7 Å²	38.7	32%	0.322	22%	0.216	S	C	.	.	S	Bend	trans	-84.7	5.2	-174.9	-62.2	-173.7	-68.2	0	0	114.4	M196	Q163-M196 HydrophobicContact CB-CE 3.88Å; Q163-M196 PolarHBondContact NE2-O 3.03Å
164	F	89.1	Confident	92.2	Very high	10 Å²	10	41.2 Å²	41.2	4%	0.044	23%	0.23	C	C	.	.	S	Bend	trans	-124.7	116.1	-179.6	-52.4	-68.7	0	0	0	109.9	N127 C161 G162 E166 T167 I195 M196 P215 K216 W217 N218	N127-F164 WeakPolarHBondContact ND2-CE2 3.37Å; C161-F164 HydrophobicContact CB-CE2 4.42Å; G162-F164 VanDerWaalsContact C-N 3.28Å; G162-F164 PolarHBondContact O-N 3.01Å; F164-E166 PolarHBondContact O-N 3.39Å; F164-T167 WeakPolarHBondContact O-CG2 3.34Å; F164-T167 PolarHBondContact O-N 2.88Å; F164-T167 VanDerWaalsContact O-N 3.08Å; F164-T167 PolarHBondContact O-OG1 3.15Å; F164-I195 HydrophobicContact CE2-CD1 4.29Å; F164-M196 HydrophobicContact CD1-CE 4.37Å; F164-M196 HydrophobicContact CE1-CE 3.62Å; F164-M196 HydrophobicContact CZ-CE 3.97Å; F164-P215 VanDerWaalsContact CE1-O 3.31Å; F164-P215 WeakPolarHBondContact CE1-O 3.3Å; F164-P215 HydrophobicContact CE2-CB 4.5Å; F164-P215 HydrophobicContact CZ-CB 3.99Å; F164-P215 WeakPolarHBondContact CZ-O 3.4Å; F164-K216 WeakPolarHBondContact CD1-O 3.29Å; F164-W217 HydrophobicContact CB-CE3 3.9Å; F164-W217 HydrophobicContact CB-CZ3 4.16Å; F164-N218 WeakPolarHBondContact CD2-OD1 3.48Å
165	G	79.9	Confident	92.1	Very high	55 Å²	55	41.3 Å²	41.3	57%	0.567	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.8	24.5	173.8	0	0	0	0	0	116	T167	G165-T167 WeakPolarHBondContact O-CG2 3.45Å; G165-T167 PolarHBondContact O-N 3.22Å
166	E	79.3	Confident	92.2	Very high	141 Å²	141	42.5 Å²	42.5	66%	0.659	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.3	14.5	-171.8	-50.3	-164.7	141	0	0	115.5	F164 E168 M169	F164-E166 PolarHBondContact O-N 3.39Å; E166-E168 PolarHBondContact O-N 3.18Å; E166-M169 HydrophobicContact CB-CE 3.65Å; E166-M169 WeakPolarHBondContact O-CG 3.3Å; E166-M169 WeakPolarHBondContact OE2-CE 3.31Å
167	T	82.3	Confident	92	Very high	13 Å²	13	44.5 Å²	44.5	8%	0.08	25%	0.253	C	S	.	.			trans	-66.3	2.1	-167.4	56.7	0	0	0	0	116.6	A129 H131 F164 G165 N218	A129-T167 WeakPolarHBondContact CB-OG1 3.21Å; H131-T167 PolarHBondContact N-O 3.19Å; H131-T167 VanDerWaalsContact N-O 3.12Å; H131-T167 WeakPolarHBondContact O-CB 3.38Å; H131-T167 WeakPolarHBondContact O-CG2 3.33Å; F164-T167 WeakPolarHBondContact O-CG2 3.34Å; F164-T167 PolarHBondContact O-N 2.88Å; F164-T167 VanDerWaalsContact O-N 3.08Å; F164-T167 PolarHBondContact O-OG1 3.15Å; G165-T167 WeakPolarHBondContact O-CG2 3.45Å; G165-T167 PolarHBondContact O-N 3.22Å; T167-N218 PolarHBondContact OG1-ND2 3.47Å
168	E	86	Confident	91.9	Very high	2 Å²	2	46.9 Å²	46.9	1%	0.009	27%	0.266	C	S	.	.			trans	-146.4	61.1	-175.7	-161.6	76.9	133.4	0	0	111.9	A129 S130 P160 E166 I175 K192	A129-E168 WeakPolarHBondContact CA-OE1 3.27Å; A129-E168 HydrophobicContact CB-CB 4.3Å; S130-E168 WeakPolarHBondContact CB-OE2 3.22Å; S130-E168 PolarHBondContact N-OE2 3Å; S130-E168 PolarHBondContact OG-OE1 3.35Å; S130-E168 PolarHBondContact OG-OE2 2.86Å; P160-E168 HydrophobicContact CB-CG 4.08Å; P160-E168 WeakPolarHBondContact CB-OE1 3.49Å; E166-E168 PolarHBondContact O-N 3.18Å; E168-I175 HydrophobicContact CG-CD1 3.55Å; E168-I175 HydrophobicContact CG-CG1 4.19Å; E168-I175 WeakPolarHBondContact OE1-CG2 3.28Å; E168-K192 HydrophobicContact CB-CD 4.42Å; E168-K192 HydrophobicContact CG-CD 3.89Å; E168-K192 VanDerWaalsContact O-CD 3.28Å; E168-K192 WeakPolarHBondContact O-CD 3.29Å; E168-K192 PolarHBondContact O-NZ 2.93Å
169	M	85.4	Confident	91.7	Very high	138 Å²	138	46.9 Å²	46.9	68%	0.68	27%	0.266	S	S	*	.			trans	-70.9	-36.3	-178.7	-60.9	-175.6	-176.5	0	0	114.1	E166 K192	E166-M169 HydrophobicContact CB-CE 3.65Å; E166-M169 WeakPolarHBondContact O-CG 3.3Å; E166-M169 WeakPolarHBondContact OE2-CE 3.31Å; M169-K192 VanDerWaalsContact C-NZ 3.27Å; M169-K192 PolarHBondContact O-NZ 3.49Å
170	G	89.2	Confident	91.6	Very high	34 Å²	34	50.4 Å²	50.4	35%	0.351	28%	0.281	S	S	.	.	S	Bend	trans	-63.3	173.1	-169.9	0	0	0	0	0	116.4	I175 K192	G170-I175 WeakPolarHBondContact O-CD1 3.43Å; G170-K192 PolarHBondContact O-NZ 3.45Å
171	T	95.2	Very high	91.5	Very high	80 Å²	80	57.1 Å²	57.1	49%	0.491	32%	0.317	S	S	.	.			trans	-75.7	156.8	176.6	84.8	0	0	0	0	111.2	R173 D174 I175	T171-R173 PolarHBondContact O-N 3.35Å; T171-R173 VanDerWaalsContact O-N 3.08Å; T171-R173 PolarHBondContact OG1-N 3.05Å; T171-D174 VanDerWaalsContact CB-OD2 3.23Å; T171-D174 WeakPolarHBondContact CB-OD2 3.23Å; T171-D174 VanDerWaalsContact CG2-OD2 3.28Å; T171-D174 WeakPolarHBondContact CG2-OD2 3.2Å; T171-D174 PolarHBondContact N-OD2 2.93Å; T171-D174 PolarHBondContact O-N 3.09Å; T171-D174 PolarHBondContact OG1-N 3.47Å; T171-D174 PolarHBondContact OG1-OD2 3.31Å; T171-I175 WeakPolarHBondContact O-CD1 3.37Å; T171-I175 VanDerWaalsContact O-CG1 3.3Å; T171-I175 WeakPolarHBondContact O-CG1 3.4Å; T171-I175 PolarHBondContact O-N 3.37Å
172	S	96.6	Very high	91.4	Very high	24 Å²	24	60.8 Å²	60.8	17%	0.168	34%	0.34	C	S	.	.	H	α-helix	trans	-50.9	-34.9	177.9	-55.2	0	0	0	0	113.7	A108 E176 S191 K192	A108-S172 WeakPolarHBondContact CB-O 3.45Å; A108-S172 WeakPolarHBondContact O-CB 3.48Å; S172-E176 PolarHBondContact O-N 3.01Å; S172-S191 WeakPolarHBondContact OG-CA 3.32Å; S172-K192 PolarHBondContact OG-N 3.21Å
173	R	96.2	Very high	91.6	Very high	173 Å²	173	60.9 Å²	60.9	65%	0.653	33%	0.332	S	S	*	.	H	α-helix	trans	-74.6	-38.9	-179.8	-178.2	178.9	176.4	177	-2.7	112.1	A108 T171 I175 E176 A177	A108-R173 PolarHBondContact O-N 2.88Å; T171-R173 PolarHBondContact O-N 3.35Å; T171-R173 VanDerWaalsContact O-N 3.08Å; T171-R173 PolarHBondContact OG1-N 3.05Å; R173-I175 VanDerWaalsContact C-N 3.33Å; R173-E176 PolarHBondContact O-N 2.89Å; R173-A177 WeakPolarHBondContact O-CB 3.3Å; R173-A177 PolarHBondContact O-N 2.8Å
174	D	95.6	Very high	91.8	Very high	89 Å²	89	59.7 Å²	59.7	48%	0.476	34%	0.339	S	S	.	.	H	α-helix	trans	-71.3	-35.3	178.7	-46.2	-44.5	0	0	0	110.4	T171 A177 N178	T171-D174 VanDerWaalsContact CB-OD2 3.23Å; T171-D174 WeakPolarHBondContact CB-OD2 3.23Å; T171-D174 VanDerWaalsContact CG2-OD2 3.28Å; T171-D174 WeakPolarHBondContact CG2-OD2 3.2Å; T171-D174 PolarHBondContact N-OD2 2.93Å; T171-D174 PolarHBondContact O-N 3.09Å; T171-D174 PolarHBondContact OG1-N 3.47Å; T171-D174 PolarHBondContact OG1-OD2 3.31Å; D174-A177 PolarHBondContact O-N 3.42Å; D174-N178 VanDerWaalsContact O-CB 3.3Å; D174-N178 WeakPolarHBondContact O-CB 3.21Å; D174-N178 PolarHBondContact O-N 2.97Å
175	I	96	Very high	92.1	Very high	4 Å²	4	59.5 Å²	59.5	2%	0.021	34%	0.338	C	S	.	.	H	α-helix	trans	-64	-48	172.3	-65.7	159.4	0	0	0	110.9	P160 E168 G170 T171 R173 A177 N178 A179 K192	P160-I175 HydrophobicContact CB-CD1 4.13Å; P160-I175 HydrophobicContact CB-CG2 3.94Å; P160-I175 HydrophobicContact CG-CG2 3.61Å; E168-I175 HydrophobicContact CG-CD1 3.55Å; E168-I175 HydrophobicContact CG-CG1 4.19Å; E168-I175 WeakPolarHBondContact OE1-CG2 3.28Å; G170-I175 WeakPolarHBondContact O-CD1 3.43Å; T171-I175 WeakPolarHBondContact O-CD1 3.37Å; T171-I175 VanDerWaalsContact O-CG1 3.3Å; T171-I175 WeakPolarHBondContact O-CG1 3.4Å; T171-I175 PolarHBondContact O-N 3.37Å; R173-I175 VanDerWaalsContact C-N 3.33Å; I175-A177 VanDerWaalsContact C-N 3.3Å; I175-A177 PolarHBondContact O-N 3.41Å; I175-N178 PolarHBondContact O-N 3.24Å; I175-A179 WeakPolarHBondContact O-CB 3.19Å; I175-A179 PolarHBondContact O-N 2.9Å; I175-K192 HydrophobicContact CD1-CB 4.33Å; I175-K192 HydrophobicContact CD1-CD 4Å
176	E	96.8	Very high	92.8	Very high	31 Å²	31	61.5 Å²	61.5	15%	0.145	34%	0.339	C	S	.	.	H	α-helix	trans	-56.8	-45.1	173.8	-179	-172.1	-160.4	0	0	111	A108 K109 S172 R173 K180	A108-E176 HydrophobicContact CB-CB 3.57Å; A108-E176 HydrophobicContact CB-CG 4.06Å; A108-E176 WeakPolarHBondContact CB-OE2 3.42Å; K109-E176 WeakPolarHBondContact CE-OE2 3.34Å; S172-E176 PolarHBondContact O-N 3.01Å; R173-E176 PolarHBondContact O-N 2.89Å; E176-K180 HydrophobicContact CG-CD 3.96Å; E176-K180 WeakPolarHBondContact O-CB 3.23Å; E176-K180 WeakPolarHBondContact O-CG 3.47Å; E176-K180 PolarHBondContact O-N 3.4Å; E176-K180 IonicContact OE1-NZ 3.53Å; E176-K180 PolarHBondContact OE1-NZ 2.65Å
177	A	95.8	Very high	93.6	Very high	43 Å²	43	54.8 Å²	54.8	36%	0.355	31%	0.308	S	S	.	.	H	α-helix	trans	-66.4	-46.2	179.9	0	0	0	0	0	112.3	R173 D174 I175 K180 N181	R173-A177 WeakPolarHBondContact O-CB 3.3Å; R173-A177 PolarHBondContact O-N 2.8Å; D174-A177 PolarHBondContact O-N 3.42Å; I175-A177 VanDerWaalsContact C-N 3.3Å; I175-A177 PolarHBondContact O-N 3.41Å; A177-K180 PolarHBondContact O-N 3.38Å; A177-N181 VanDerWaalsContact O-CB 3.27Å; A177-N181 WeakPolarHBondContact O-CB 3.42Å; A177-N181 PolarHBondContact O-N 2.59Å; A177-N181 PolarHBondContact O-ND2 3.04Å; A177-N181 PolarHBondContact O-OD1 3.48Å
178	N	94.9	Very high	94.3	Very high	49 Å²	49	56 Å²	56	26%	0.262	32%	0.317	S	S	.	.	H	α-helix	trans	-58.9	-54.8	177.7	174.3	48.2	0	0	0	111.2	S130 D174 I175 K180 N181 T182	S130-N178 WeakPolarHBondContact CB-ND2 3.39Å; S130-N178 PolarHBondContact OG-ND2 3.2Å; D174-N178 VanDerWaalsContact O-CB 3.3Å; D174-N178 WeakPolarHBondContact O-CB 3.21Å; D174-N178 PolarHBondContact O-N 2.97Å; I175-N178 PolarHBondContact O-N 3.24Å; N178-K180 PolarHBondContact O-N 3.09Å; N178-N181 PolarHBondContact O-N 3.23Å; N178-T182 WeakPolarHBondContact O-CB 3.49Å; N178-T182 PolarHBondContact O-N 2.99Å; N178-T182 PolarHBondContact O-OG1 3.05Å; N178-T182 VanDerWaalsContact O-OG1 3.04Å; N178-T182 PolarHBondContact OD1-OG1 2.87Å
179	A	95.2	Very high	94.9	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-61.1	-33.9	-176.5	0	0	0	0	0	112.6	Y139 I175 H183 V185 I189	Y139-A179 HydrophobicContact CE1-CB 3.99Å; Y139-A179 HydrophobicContact CE2-CB 4.39Å; I175-A179 WeakPolarHBondContact O-CB 3.19Å; I175-A179 PolarHBondContact O-N 2.9Å; A179-H183 PolarHBondContact O-N 3.5Å; A179-H183 VanDerWaalsContact O-N 3.16Å; A179-V185 HydrophobicContact CB-CG2 4.08Å; A179-I189 HydrophobicContact CB-CD1 3.51Å
180	K	95.6	Very high	95.5	Very high	75 Å²	75	49.9 Å²	49.9	33%	0.326	29%	0.286	S	S	.	.	H	α-helix	trans	-72.8	-45.6	175.5	-72.4	-179.8	177.5	-178	0	113	E176 A177 N178 G184 V185	E176-K180 HydrophobicContact CG-CD 3.96Å; E176-K180 WeakPolarHBondContact O-CB 3.23Å; E176-K180 WeakPolarHBondContact O-CG 3.47Å; E176-K180 PolarHBondContact O-N 3.4Å; E176-K180 IonicContact OE1-NZ 3.53Å; E176-K180 PolarHBondContact OE1-NZ 2.65Å; A177-K180 PolarHBondContact O-N 3.38Å; N178-K180 PolarHBondContact O-N 3.09Å; K180-G184 WeakPolarHBondContact O-CA 3.36Å; K180-G184 PolarHBondContact O-N 3.33Å; K180-V185 HydrophobicContact CG-CG2 4.07Å
181	N	95.4	Very high	95.9	Very high	141 Å²	141	49 Å²	49	75%	0.754	28%	0.275	S	S	*	.	H	α-helix	trans	-73.1	-38.1	-177.5	-65.9	-10.2	0	0	0	112.1	A177 N178	A177-N181 VanDerWaalsContact O-CB 3.27Å; A177-N181 WeakPolarHBondContact O-CB 3.42Å; A177-N181 PolarHBondContact O-N 2.59Å; A177-N181 PolarHBondContact O-ND2 3.04Å; A177-N181 PolarHBondContact O-OD1 3.48Å; N178-N181 PolarHBondContact O-N 3.23Å
182	T	94	Very high	96	Very high	77 Å²	77	48.6 Å²	48.6	47%	0.472	27%	0.266	S	S	.	.	H	α-helix	trans	-87.1	-40	-173	-53.1	0	0	0	0	112.5	N178	N178-T182 WeakPolarHBondContact O-CB 3.49Å; N178-T182 PolarHBondContact O-N 2.99Å; N178-T182 PolarHBondContact O-OG1 3.05Å; N178-T182 VanDerWaalsContact O-OG1 3.04Å; N178-T182 PolarHBondContact OD1-OG1 2.87Å
183	H	94.1	Very high	96	Very high	30 Å²	30	48.2 Å²	48.2	14%	0.139	26%	0.262	C	S	.	.	H	α-helix	trans	-118	3.2	-176.9	-32.8	-73.1	0	0	0	114.5	E136 Y139 A179 V185	E136-H183 VanDerWaalsContact CD-CE1 3.5Å; E136-H183 IonicContact OE1-CE1 3.48Å; E136-H183 PolarHBondContact OE1-CE1 2.9Å; E136-H183 IonicContact OE1-ND1 3.2Å; E136-H183 PolarHBondContact OE1-ND1 2.96Å; E136-H183 IonicContact OE2-CE1 3.01Å; E136-H183 PolarHBondContact OE2-CE1 3.39Å; E136-H183 IonicContact OE2-ND1 3.16Å; E136-H183 PolarHBondContact OE2-ND1 2.91Å; Y139-H183 AromaticContact CD2-CD2 3.25Å; Y139-H183 WeakPolarHBondContact CD2-CD2 3.49Å; Y139-H183 AromaticContact CD2-NE2 3.3Å; Y139-H183 VanDerWaalsContact CD2-NE2 3.3Å; Y139-H183 WeakPolarHBondContact CD2-NE2 3.46Å; Y139-H183 AromaticContact CE2-CD2 3.86Å; Y139-H183 AromaticContact CE2-NE2 3.78Å; Y139-H183 HydrophobicContact CG-CB 4.43Å; Y139-H183 AromaticContact CG-CD2 3.5Å; A179-H183 PolarHBondContact O-N 3.5Å; A179-H183 VanDerWaalsContact O-N 3.16Å; H183-V185 VanDerWaalsContact C-N 3.33Å; H183-V185 HydrophobicContact CB-CG1 4.07Å; H183-V185 PolarHBondContact O-N 3.04Å
184	G	94.7	Very high	96	Very high	45 Å²	45	44.2 Å²	44.2	46%	0.464	25%	0.249	S	C	.	.			trans	68.1	24	174.1	0	0	0	0	0	115.4	K180	K180-G184 WeakPolarHBondContact O-CA 3.36Å; K180-G184 PolarHBondContact O-N 3.33Å
185	V	95.8	Very high	96	Very high	5 Å²	5	40.3 Å²	40.3	3%	0.03	23%	0.228	C	C	.	.			trans	-72.8	137.7	-170.5	-52.6	0	0	0	0	113.5	Y139 Q143 A179 K180 H183 F187 I189	Y139-V185 HydrophobicContact CD1-CG1 3.84Å; Y139-V185 HydrophobicContact CG-CG1 4.47Å; Q143-V185 HydrophobicContact CB-CG1 4.23Å; A179-V185 HydrophobicContact CB-CG2 4.08Å; K180-V185 HydrophobicContact CG-CG2 4.07Å; H183-V185 VanDerWaalsContact C-N 3.33Å; H183-V185 HydrophobicContact CB-CG1 4.07Å; H183-V185 PolarHBondContact O-N 3.04Å; V185-F187 HydrophobicContact CB-CD1 4.23Å; V185-F187 HydrophobicContact CB-CE1 3.85Å; V185-F187 HydrophobicContact CB-CE2 4.23Å; V185-F187 HydrophobicContact CB-CZ 3.88Å; V185-F187 HydrophobicContact CG1-CE1 3.94Å; V185-F187 HydrophobicContact CG1-CZ 3.83Å; V185-F187 HydrophobicContact CG2-CE2 4.3Å; V185-F187 HydrophobicContact CG2-CZ 4.38Å; V185-I189 HydrophobicContact CG2-CD1 3.88Å
186	T	95.6	Very high	95.9	Very high	97 Å²	97	43.3 Å²	43.3	60%	0.595	24%	0.243	S	C	*	.			trans	-109.2	-11.6	-178.7	60.7	0	0	0	0	113.7	Q143 H146	Q143-T186 PolarHBondContact NE2-OG1 3.42Å; Q143-T186 PolarHBondContact OE1-OG1 2.92Å; H146-T186 PolarHBondContact CD2-OG1 2.75Å
187	F	96.4	Very high	95.7	Very high	1 Å²	1	45 Å²	45	0%	0.004	27%	0.268	C	S	.	.	S	Bend	trans	-71.1	156.7	175.6	49.8	-104.1	0	0	0	112.6	Y139 L142 Q143 H146 V156 A158 V185 I189	Y139-F187 HydrophobicContact CD1-CE2 4.45Å; Y139-F187 AromaticContact CD1-CZ 3.89Å; Y139-F187 HydrophobicContact CD1-CZ 3.89Å; Y139-F187 HydrophobicContact CE1-CE2 4.29Å; Y139-F187 HydrophobicContact CE1-CZ 4.18Å; L142-F187 HydrophobicContact CB-CE1 3.89Å; L142-F187 HydrophobicContact CB-CZ 4.08Å; Q143-F187 HydrophobicContact CB-CE1 4.15Å; H146-F187 HydrophobicContact CB-CD1 4.07Å; H146-F187 AromaticContact CD2-CD1 3.97Å; V156-F187 HydrophobicContact CB-CB 3.9Å; V156-F187 HydrophobicContact CB-CD1 3.95Å; V156-F187 HydrophobicContact CB-CD2 4.29Å; V156-F187 HydrophobicContact CB-CE1 4.49Å; V156-F187 HydrophobicContact CB-CG 3.82Å; V156-F187 HydrophobicContact CG1-CB 4.45Å; V156-F187 HydrophobicContact CG1-CD1 4.13Å; V156-F187 HydrophobicContact CG1-CD2 3.92Å; V156-F187 HydrophobicContact CG1-CE1 4.25Å; V156-F187 HydrophobicContact CG1-CE2 4.06Å; V156-F187 HydrophobicContact CG1-CG 3.94Å; V156-F187 HydrophobicContact CG1-CZ 4.19Å; V156-F187 HydrophobicContact CG2-CD1 4.44Å; A158-F187 HydrophobicContact CB-CD2 3.95Å; A158-F187 HydrophobicContact CB-CE2 3.66Å; V185-F187 HydrophobicContact CB-CD1 4.23Å; V185-F187 HydrophobicContact CB-CE1 3.85Å; V185-F187 HydrophobicContact CB-CE2 4.23Å; V185-F187 HydrophobicContact CB-CZ 3.88Å; V185-F187 HydrophobicContact CG1-CE1 3.94Å; V185-F187 HydrophobicContact CG1-CZ 3.83Å; V185-F187 HydrophobicContact CG2-CE2 4.3Å; V185-F187 HydrophobicContact CG2-CZ 4.38Å; F187-I189 HydrophobicContact CD2-CG1 4.48Å; F187-I189 HydrophobicContact CE2-CG1 4.47Å; F187-I189 PolarHBondContact O-N 3.35Å
188	P	96.7	Very high	95.6	Very high	39 Å²	39	48.9 Å²	48.9	25%	0.253	29%	0.293	S	S	.	.			trans	-64.5	132.5	176	27.1	-36.9	0	0	0	112.4	V156 L157 A158 F190	V156-P188 WeakPolarHBondContact O-CD 3.44Å; L157-P188 HydrophobicContact CD2-CG 3.66Å; A158-P188 PolarHBondContact N-O 2.9Å; A158-P188 VanDerWaalsContact N-O 3.14Å; P188-F190 HydrophobicContact CB-CE2 4.17Å; P188-F190 HydrophobicContact CB-CZ 4.15Å; P188-F190 HydrophobicContact CG-CE2 4.3Å; P188-F190 HydrophobicContact CG-CZ 4.4Å
189	I	97.9	Very high	95.5	Very high	6 Å²	6	52.9 Å²	52.9	3%	0.031	31%	0.31	C	S	.	.	B	Isolated β-bridge	trans	-109	126.9	167.4	-59.3	170.4	0	0	0	107.1	A158 P160 A179 V185 F187	A158-I189 HydrophobicContact CB-CG1 4.18Å; A158-I189 WeakPolarHBondContact O-CA 3.33Å; P160-I189 HydrophobicContact CG-CG2 3.72Å; A179-I189 HydrophobicContact CB-CD1 3.51Å; V185-I189 HydrophobicContact CG2-CD1 3.88Å; F187-I189 HydrophobicContact CD2-CG1 4.48Å; F187-I189 HydrophobicContact CE2-CG1 4.47Å; F187-I189 PolarHBondContact O-N 3.35Å
190	F	98.3	Very high	95.5	Very high	4 Å²	4	53.5 Å²	53.5	2%	0.018	32%	0.316	C	S	.	.	B	Isolated β-bridge	trans	-90.1	178.4	-179.4	-66.7	-78.3	0	0	0	111.6	V105 K106 V113 L115 Y118 L157 A158 F159 P160 P188	V105-F190 HydrophobicContact CB-CD1 4.43Å; V105-F190 HydrophobicContact CG2-CD1 3.41Å; V105-F190 VanDerWaalsContact CG2-CD1 3.41Å; V105-F190 HydrophobicContact CG2-CE1 3.46Å; V105-F190 VanDerWaalsContact CG2-CE1 3.46Å; V105-F190 HydrophobicContact CG2-CG 4.16Å; V105-F190 HydrophobicContact CG2-CZ 4.26Å; K106-F190 WeakPolarHBondContact O-CB 3.39Å; V113-F190 HydrophobicContact CG1-CE1 4.46Å; L115-F190 HydrophobicContact CD2-CE1 4.38Å; L115-F190 HydrophobicContact CD2-CZ 4.06Å; Y118-F190 HydrophobicContact CE2-CZ 4.08Å; L157-F190 HydrophobicContact CB-CE2 3.97Å; L157-F190 HydrophobicContact CD2-CE2 3.96Å; L157-F190 HydrophobicContact CD2-CZ 4.18Å; L157-F190 HydrophobicContact CG-CE2 4.48Å; A158-F190 WeakPolarHBondContact O-CD2 3.4Å; A158-F190 PolarHBondContact O-N 3Å; F159-F190 HydrophobicContact CD1-CB 3.78Å; F159-F190 HydrophobicContact CD1-CD2 4.14Å; F159-F190 HydrophobicContact CD1-CG 4.16Å; F159-F190 HydrophobicContact CD2-CD2 4.16Å; F159-F190 HydrophobicContact CE1-CB 3.79Å; F159-F190 HydrophobicContact CE1-CD1 4.48Å; F159-F190 AromaticContact CE1-CD2 3.74Å; F159-F190 HydrophobicContact CE1-CD2 3.74Å; F159-F190 AromaticContact CE1-CG 3.73Å; F159-F190 HydrophobicContact CE1-CG 3.73Å; F159-F190 AromaticContact CE2-CD2 3.76Å; F159-F190 HydrophobicContact CE2-CD2 3.76Å; F159-F190 HydrophobicContact CE2-CE2 4.06Å; F159-F190 HydrophobicContact CG-CB 4.46Å; F159-F190 HydrophobicContact CG-CD2 4.34Å; F159-F190 HydrophobicContact CZ-CB 4.48Å; F159-F190 AromaticContact CZ-CD2 3.54Å; F159-F190 HydrophobicContact CZ-CD2 3.54Å; F159-F190 AromaticContact CZ-CE2 3.91Å; F159-F190 HydrophobicContact CZ-CE2 3.91Å; F159-F190 AromaticContact CZ-CG 3.97Å; F159-F190 HydrophobicContact CZ-CG 3.97Å; P160-F190 WeakPolarHBondContact CD-O 3.44Å; P188-F190 HydrophobicContact CB-CE2 4.17Å; P188-F190 HydrophobicContact CB-CZ 4.15Å; P188-F190 HydrophobicContact CG-CE2 4.3Å; P188-F190 HydrophobicContact CG-CZ 4.4Å
191	S	97.9	Very high	95.6	Very high	17 Å²	17	51.9 Å²	51.9	12%	0.119	31%	0.309	C	S	.	.			trans	-57.4	152.4	168.7	-92.6	0	0	0	0	111.4	K106 D107 S172 I193	K106-S191 PolarHBondContact O-N 2.85Å; D107-S191 WeakPolarHBondContact O-CB 3.29Å; D107-S191 PolarHBondContact O-N 2.79Å; D107-S191 PolarHBondContact O-OG 2.86Å; S172-S191 WeakPolarHBondContact OG-CA 3.32Å; S191-I193 WeakPolarHBondContact O-CG2 3.49Å; S191-I193 PolarHBondContact O-N 2.82Å
192	K	97.4	Very high	95.6	Very high	70 Å²	70	48.8 Å²	48.8	30%	0.304	30%	0.297	S	S	.	.			trans	-62.1	126.4	169.5	-174.2	166.2	70.7	-173.7	0	110.2	P160 E168 M169 G170 S172 I175	P160-K192 HydrophobicContact CB-CB 4.13Å; P160-K192 HydrophobicContact CB-CG 4.26Å; P160-K192 CarbonylContact O-C 3.59Å; P160-K192 WeakPolarHBondContact O-CA 3.38Å; E168-K192 HydrophobicContact CB-CD 4.42Å; E168-K192 HydrophobicContact CG-CD 3.89Å; E168-K192 VanDerWaalsContact O-CD 3.28Å; E168-K192 WeakPolarHBondContact O-CD 3.29Å; E168-K192 PolarHBondContact O-NZ 2.93Å; M169-K192 VanDerWaalsContact C-NZ 3.27Å; M169-K192 PolarHBondContact O-NZ 3.49Å; G170-K192 PolarHBondContact O-NZ 3.45Å; S172-K192 PolarHBondContact OG-N 3.21Å; I175-K192 HydrophobicContact CD1-CB 4.33Å; I175-K192 HydrophobicContact CD1-CD 4Å
193	I	96.8	Very high	95.8	Very high	16 Å²	16	45.1 Å²	45.1	8%	0.082	27%	0.274	C	S	.	.	B	Isolated β-bridge	trans	-109.4	167	-176.5	61	162.7	0	0	0	112	F159 P160 S191 I195 E201 F204	F159-I193 HydrophobicContact CB-CD1 3.76Å; F159-I193 HydrophobicContact CB-CG1 4.12Å; F159-I193 HydrophobicContact CD1-CD1 4.15Å; F159-I193 HydrophobicContact CD1-CG2 4.1Å; F159-I193 HydrophobicContact CG-CD1 4.24Å; P160-I193 WeakPolarHBondContact O-CG1 3.27Å; P160-I193 PolarHBondContact O-N 3.43Å; S191-I193 WeakPolarHBondContact O-CG2 3.49Å; S191-I193 PolarHBondContact O-N 2.82Å; I193-I195 HydrophobicContact CD1-CD1 4.25Å; I193-I195 HydrophobicContact CD1-CG1 3.67Å; I193-I195 HydrophobicContact CG1-CG1 4.21Å; I193-E201 HydrophobicContact CB-CB 3.88Å; I193-E201 HydrophobicContact CB-CG 4.4Å; I193-E201 HydrophobicContact CD1-CB 4.15Å; I193-E201 HydrophobicContact CD1-CG 4.45Å; I193-E201 HydrophobicContact CG2-CB 3.88Å; I193-E201 HydrophobicContact CG2-CG 3.88Å; I193-F204 HydrophobicContact CD1-CB 3.77Å; I193-F204 HydrophobicContact CD1-CD2 3.54Å; I193-F204 HydrophobicContact CD1-CE2 4.35Å; I193-F204 HydrophobicContact CD1-CG 3.75Å
194	K	96	Very high	95.9	Very high	89 Å²	89	43.7 Å²	43.7	39%	0.387	27%	0.268	S	S	.	.			trans	-100.4	139.7	155.2	-69	172.2	177.7	175.3	0	108.3	E199 A200 E201	K194-E199 HydrophobicContact CD-CB 3.82Å; K194-E199 IonicContact NZ-OE1 2.79Å; K194-E199 IonicContact NZ-OE2 3.92Å; K194-E199 PolarHBondContact NZ-OE2 2.87Å; K194-A200 WeakPolarHBondContact O-CA 3.38Å; K194-E201 PolarHBondContact O-N 3.11Å
195	I	95.6	Very high	96	Very high	7 Å²	7	46 Å²	46	4%	0.036	27%	0.265	C	S	.	.	S	Bend	trans	-102.8	-24.8	174.8	-66.8	174.5	0	0	0	110.4	N127 C161 F164 I193 F204 T208 I214 P215	N127-I195 HydrophobicContact CB-CD1 3.49Å; N127-I195 VanDerWaalsContact CB-CD1 3.49Å; C161-I195 HydrophobicContact CB-CD1 3.85Å; C161-I195 HydrophobicContact CB-CG1 4.4Å; F164-I195 HydrophobicContact CE2-CD1 4.29Å; I193-I195 HydrophobicContact CD1-CD1 4.25Å; I193-I195 HydrophobicContact CD1-CG1 3.67Å; I193-I195 HydrophobicContact CG1-CG1 4.21Å; I195-F204 HydrophobicContact CB-CD1 4.33Å; I195-F204 HydrophobicContact CD1-CD1 4.04Å; I195-F204 HydrophobicContact CD1-CD2 4.44Å; I195-F204 HydrophobicContact CD1-CE1 3.7Å; I195-F204 HydrophobicContact CD1-CE2 4.11Å; I195-F204 HydrophobicContact CD1-CG 4.41Å; I195-F204 HydrophobicContact CD1-CZ 3.73Å; I195-F204 HydrophobicContact CG1-CD1 3.76Å; I195-F204 HydrophobicContact CG1-CD2 4.45Å; I195-F204 HydrophobicContact CG1-CE1 3.95Å; I195-F204 HydrophobicContact CG1-CG 4.05Å; I195-F204 HydrophobicContact CG1-CZ 4.36Å; I195-F204 HydrophobicContact CG2-CD1 3.83Å; I195-F204 HydrophobicContact CG2-CE1 3.86Å; I195-T208 HydrophobicContact CG2-CG2 4.41Å; I195-I214 HydrophobicContact CG2-CG2 4.41Å; I195-P215 HydrophobicContact CG2-CG 4.13Å
196	M	93.2	Very high	96.1	Very high	68 Å²	68	47.1 Å²	47.1	34%	0.335	27%	0.27	S	S	.	.	S	Bend	trans	-122.7	146	-176.8	-59.9	-177	-71.8	0	0	111.5	Q163 F164 I214	Q163-M196 HydrophobicContact CB-CE 3.88Å; Q163-M196 PolarHBondContact NE2-O 3.03Å; F164-M196 HydrophobicContact CD1-CE 4.37Å; F164-M196 HydrophobicContact CE1-CE 3.62Å; F164-M196 HydrophobicContact CZ-CE 3.97Å; M196-I214 HydrophobicContact CG-CG2 3.7Å; M196-I214 HydrophobicContact SD-CG2 3.96Å
197	G	92.8	Very high	96.1	Very high	65 Å²	65	42.5 Å²	42.5	67%	0.67	24%	0.241	S	C	*	.	S	Bend	trans	101.6	-174.7	179.1	0	0	0	0	0	113.9	E199 A200	G197-E199 VanDerWaalsContact C-N 3.3Å; G197-E199 PolarHBondContact O-N 2.79Å; G197-A200 WeakPolarHBondContact O-CB 3.21Å; G197-A200 PolarHBondContact O-N 3.01Å
198	S	92.8	Very high	96.1	Very high	126 Å²	126	42.7 Å²	42.7	88%	0.881	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-30.7	177.9	44.7	0	0	0	0	113.4	A200	S198-A200 VanDerWaalsContact C-N 3.31Å
199	E	93.6	Very high	96	Very high	132 Å²	132	44.1 Å²	44.1	62%	0.617	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.3	19.2	178.5	-65.4	171.9	-138	0	0	113.2	K194 G197 E201	K194-E199 HydrophobicContact CD-CB 3.82Å; K194-E199 IonicContact NZ-OE1 2.79Å; K194-E199 IonicContact NZ-OE2 3.92Å; K194-E199 PolarHBondContact NZ-OE2 2.87Å; G197-E199 VanDerWaalsContact C-N 3.3Å; G197-E199 PolarHBondContact O-N 2.79Å; E199-E201 PolarHBondContact O-N 3.29Å
200	A	95.1	Very high	95.9	Very high	14 Å²	14	46.2 Å²	46.2	12%	0.116	26%	0.263	C	S	.	.			trans	-63.9	131.2	177.8	0	0	0	0	0	111.3	K194 G197 S198 P202	K194-A200 WeakPolarHBondContact O-CA 3.38Å; G197-A200 WeakPolarHBondContact O-CB 3.21Å; G197-A200 PolarHBondContact O-N 3.01Å; S198-A200 VanDerWaalsContact C-N 3.31Å; A200-P202 WeakPolarHBondContact O-CD 3.39Å
201	E	97.3	Very high	95.8	Very high	40 Å²	40	47.4 Å²	47.4	19%	0.187	27%	0.271	C	S	.	.			trans	-54.9	116.8	-179.4	170.2	53.4	-115.7	0	0	110.8	I193 K194 E199 A203 F204 K205	I193-E201 HydrophobicContact CB-CB 3.88Å; I193-E201 HydrophobicContact CB-CG 4.4Å; I193-E201 HydrophobicContact CD1-CB 4.15Å; I193-E201 HydrophobicContact CD1-CG 4.45Å; I193-E201 HydrophobicContact CG2-CB 3.88Å; I193-E201 HydrophobicContact CG2-CG 3.88Å; K194-E201 PolarHBondContact O-N 3.11Å; E199-E201 PolarHBondContact O-N 3.29Å; E201-A203 VanDerWaalsContact C-N 3.26Å; E201-A203 HydrophobicContact CG-CB 4.3Å; E201-A203 PolarHBondContact O-N 3.42Å; E201-A203 VanDerWaalsContact O-N 3.15Å; E201-A203 PolarHBondContact OE1-N 3.1Å; E201-F204 HydrophobicContact CB-CB 4.23Å; E201-F204 HydrophobicContact CG-CB 4.24Å; E201-F204 PolarHBondContact O-N 3.48Å; E201-K205 WeakPolarHBondContact O-CB 3.07Å; E201-K205 PolarHBondContact O-N 3.03Å
202	P	96.8	Very high	95.7	Very high	76 Å²	76	54.2 Å²	54.2	49%	0.494	30%	0.298	S	S	.	.	H	α-helix	trans	-52.2	-38.3	-176.2	-31.9	37.2	0	0	0	114.9	F103 A200 K205 F206	F103-P202 HydrophobicContact CD1-CB 3.95Å; F103-P202 HydrophobicContact CE1-CB 3.78Å; A200-P202 WeakPolarHBondContact O-CD 3.39Å; P202-K205 PolarHBondContact O-N 2.91Å; P202-F206 PolarHBondContact O-N 2.71Å
203	A	97.1	Very high	95.6	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-65.7	-40.5	177.9	0	0	0	0	0	112.4	F100 F103 V105 L115 E201	F100-A203 HydrophobicContact CE2-CB 4.13Å; F103-A203 HydrophobicContact CB-CB 3.76Å; F103-A203 HydrophobicContact CD1-CB 4.32Å; F103-A203 HydrophobicContact CD2-CB 4.46Å; F103-A203 HydrophobicContact CG-CB 3.96Å; V105-A203 HydrophobicContact CG1-CB 3.54Å; L115-A203 HydrophobicContact CD1-CB 4.03Å; E201-A203 VanDerWaalsContact C-N 3.26Å; E201-A203 HydrophobicContact CG-CB 4.3Å; E201-A203 PolarHBondContact O-N 3.42Å; E201-A203 VanDerWaalsContact O-N 3.15Å; E201-A203 PolarHBondContact OE1-N 3.1Å
204	F	97.1	Very high	95.4	Very high	1 Å²	1	59.2 Å²	59.2	0%	0.004	32%	0.323	C	S	.	.	H	α-helix	trans	-77.6	-35.5	177.4	-152.7	-72.7	0	0	0	111.4	V125 N127 F159 I193 I195 E201 F206 I207 T208 P215 F222	V125-F204 HydrophobicContact CG1-CD2 4.4Å; V125-F204 HydrophobicContact CG1-CE2 4.13Å; N127-F204 HydrophobicContact CB-CE2 4.05Å; N127-F204 HydrophobicContact CB-CZ 3.91Å; F159-F204 HydrophobicContact CB-CD2 4.26Å; F159-F204 HydrophobicContact CB-CE2 4.38Å; F159-F204 HydrophobicContact CD2-CD2 4.45Å; F159-F204 HydrophobicContact CG-CD2 4.3Å; I193-F204 HydrophobicContact CD1-CB 3.77Å; I193-F204 HydrophobicContact CD1-CD2 3.54Å; I193-F204 HydrophobicContact CD1-CE2 4.35Å; I193-F204 HydrophobicContact CD1-CG 3.75Å; I195-F204 HydrophobicContact CB-CD1 4.33Å; I195-F204 HydrophobicContact CD1-CD1 4.04Å; I195-F204 HydrophobicContact CD1-CD2 4.44Å; I195-F204 HydrophobicContact CD1-CE1 3.7Å; I195-F204 HydrophobicContact CD1-CE2 4.11Å; I195-F204 HydrophobicContact CD1-CG 4.41Å; I195-F204 HydrophobicContact CD1-CZ 3.73Å; I195-F204 HydrophobicContact CG1-CD1 3.76Å; I195-F204 HydrophobicContact CG1-CD2 4.45Å; I195-F204 HydrophobicContact CG1-CE1 3.95Å; I195-F204 HydrophobicContact CG1-CG 4.05Å; I195-F204 HydrophobicContact CG1-CZ 4.36Å; I195-F204 HydrophobicContact CG2-CD1 3.83Å; I195-F204 HydrophobicContact CG2-CE1 3.86Å; E201-F204 HydrophobicContact CB-CB 4.23Å; E201-F204 HydrophobicContact CG-CB 4.24Å; E201-F204 PolarHBondContact O-N 3.48Å; F204-F206 VanDerWaalsContact C-N 3.32Å; F204-F206 PolarHBondContact O-N 2.85Å; F204-I207 WeakPolarHBondContact O-CB 3.26Å; F204-I207 PolarHBondContact O-N 3.16Å; F204-I207 VanDerWaalsContact O-N 3.11Å; F204-T208 HydrophobicContact CD1-CG2 3.86Å; F204-T208 HydrophobicContact CE1-CG2 3.84Å; F204-T208 PolarHBondContact O-N 3.37Å; F204-T208 VanDerWaalsContact O-N 3.1Å; F204-P215 HydrophobicContact CE1-CG 3.86Å; F204-P215 HydrophobicContact CZ-CG 4.25Å; F204-F222 HydrophobicContact CE1-CE2 4.2Å; F204-F222 HydrophobicContact CZ-CD2 4.3Å; F204-F222 AromaticContact CZ-CE2 3.84Å; F204-F222 HydrophobicContact CZ-CE2 3.84Å
205	K	96.3	Very high	95.4	Very high	92 Å²	92	55 Å²	55	40%	0.4	31%	0.305	S	S	.	.	H	α-helix	trans	-57	-45.8	173.1	176.2	160.8	175.6	48.9	0	111.1	E201 P202 I207 T208 D209	E201-K205 WeakPolarHBondContact O-CB 3.07Å; E201-K205 PolarHBondContact O-N 3.03Å; P202-K205 PolarHBondContact O-N 2.91Å; K205-I207 VanDerWaalsContact C-N 3.27Å; K205-I207 PolarHBondContact O-N 3Å; K205-T208 PolarHBondContact O-N 3.39Å; K205-T208 VanDerWaalsContact O-N 3.14Å; K205-T208 PolarHBondContact O-OG1 3.36Å; K205-D209 VanDerWaalsContact CE-OD2 3.29Å; K205-D209 WeakPolarHBondContact CE-OD2 3.3Å; K205-D209 VanDerWaalsContact CG-OD2 3.27Å; K205-D209 WeakPolarHBondContact CG-OD2 3.3Å; K205-D209 VanDerWaalsContact NZ-CG 3.25Å; K205-D209 IonicContact NZ-OD1 3.35Å; K205-D209 PolarHBondContact NZ-OD1 2.83Å; K205-D209 IonicContact NZ-OD2 3.09Å; K205-D209 PolarHBondContact NZ-OD2 2.82Å; K205-D209 WeakPolarHBondContact O-CB 3.38Å; K205-D209 PolarHBondContact O-N 2.69Å
206	F	96.9	Very high	95.3	Very high	29 Å²	29	63 Å²	63	13%	0.127	34%	0.339	C	S	.	.	H	α-helix	trans	-52.6	-43.5	174	170.6	-95.9	0	0	0	112.7	Q98 F100 F103 P202 F204 S210 V230	Q98-F206 HydrophobicContact CB-CD2 4.45Å; Q98-F206 HydrophobicContact CB-CE2 4.3Å; Q98-F206 WeakPolarHBondContact O-CE2 3.48Å; Q98-F206 WeakPolarHBondContact O-CZ 3.16Å; F100-F206 HydrophobicContact CB-CD1 3.93Å; F100-F206 HydrophobicContact CB-CE1 3.83Å; F103-F206 HydrophobicContact CE2-CB 3.69Å; F103-F206 HydrophobicContact CE2-CD1 4.3Å; F103-F206 HydrophobicContact CE2-CD2 4.15Å; F103-F206 AromaticContact CE2-CG 3.77Å; F103-F206 HydrophobicContact CE2-CG 3.77Å; F103-F206 HydrophobicContact CZ-CB 3.68Å; F103-F206 HydrophobicContact CZ-CD2 4.36Å; F103-F206 HydrophobicContact CZ-CG 4.14Å; P202-F206 PolarHBondContact O-N 2.71Å; F204-F206 VanDerWaalsContact C-N 3.32Å; F204-F206 PolarHBondContact O-N 2.85Å; F206-S210 VanDerWaalsContact O-CB 3.32Å; F206-S210 WeakPolarHBondContact O-CB 3.25Å; F206-S210 PolarHBondContact O-N 3.04Å; F206-S210 PolarHBondContact O-OG 2.83Å; F206-V230 HydrophobicContact CE1-CG2 4.46Å
207	I	97	Very high	95.3	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-61.4	-51.7	176.7	-65.5	174.7	0	0	0	110.8	F100 V125 F204 K205 D209 S210 V211 F222 V230	F100-I207 HydrophobicContact CD2-CD1 3.7Å; F100-I207 HydrophobicContact CD2-CG1 3.83Å; F100-I207 HydrophobicContact CE2-CD1 3.58Å; F100-I207 HydrophobicContact CE2-CG1 4.21Å; F100-I207 HydrophobicContact CG-CD1 4.5Å; F100-I207 HydrophobicContact CZ-CD1 4.3Å; V125-I207 HydrophobicContact CB-CD1 3.79Å; V125-I207 HydrophobicContact CG1-CD1 3.54Å; V125-I207 HydrophobicContact CG2-CD1 3.89Å; F204-I207 WeakPolarHBondContact O-CB 3.26Å; F204-I207 PolarHBondContact O-N 3.16Å; F204-I207 VanDerWaalsContact O-N 3.11Å; K205-I207 VanDerWaalsContact C-N 3.27Å; K205-I207 PolarHBondContact O-N 3Å; I207-D209 VanDerWaalsContact C-N 3.34Å; I207-D209 PolarHBondContact O-N 3.35Å; I207-S210 WeakPolarHBondContact O-CB 3.28Å; I207-S210 PolarHBondContact O-N 2.79Å; I207-S210 VanDerWaalsContact O-N 3.13Å; I207-V211 PolarHBondContact O-N 2.86Å; I207-F222 HydrophobicContact CG2-CB 3.72Å; I207-F222 HydrophobicContact CG2-CD1 3.27Å; I207-F222 HydrophobicContact CG2-CD2 3.93Å; I207-F222 HydrophobicContact CG2-CE1 3.79Å; I207-F222 HydrophobicContact CG2-CE2 4.38Å; I207-F222 HydrophobicContact CG2-CG 3.35Å; I207-F222 HydrophobicContact CG2-CZ 4.31Å; I207-V230 HydrophobicContact CB-CG2 4.24Å; I207-V230 HydrophobicContact CG1-CG2 4.03Å; I207-V230 HydrophobicContact CG2-CG1 4.47Å; I207-V230 HydrophobicContact CG2-CG2 4.11Å
208	T	95.5	Very high	95.4	Very high	6 Å²	6	60.5 Å²	60.5	4%	0.037	31%	0.306	C	S	.	.	H	α-helix	trans	-64.7	-37	-178.2	60.3	0	0	0	0	113.2	I195 F204 K205 S210 K212 K213	I195-T208 HydrophobicContact CG2-CG2 4.41Å; F204-T208 HydrophobicContact CD1-CG2 3.86Å; F204-T208 HydrophobicContact CE1-CG2 3.84Å; F204-T208 PolarHBondContact O-N 3.37Å; F204-T208 VanDerWaalsContact O-N 3.1Å; K205-T208 PolarHBondContact O-N 3.39Å; K205-T208 VanDerWaalsContact O-N 3.14Å; K205-T208 PolarHBondContact O-OG1 3.36Å; T208-S210 VanDerWaalsContact C-N 3.34Å; T208-K212 WeakPolarHBondContact O-CA 3.41Å; T208-K212 PolarHBondContact O-N 2.74Å; T208-K213 VanDerWaalsContact CA-O 3.27Å; T208-K213 WeakPolarHBondContact CA-O 3.36Å; T208-K213 WeakPolarHBondContact CB-O 3.06Å; T208-K213 WeakPolarHBondContact CG2-O 3.26Å; T208-K213 PolarHBondContact O-N 3.03Å; T208-K213 VanDerWaalsContact O-N 3.14Å
209	D	95.3	Very high	95.6	Very high	69 Å²	69	54.5 Å²	54.5	37%	0.369	26%	0.264	S	S	.	.	H	α-helix	trans	-72.2	-26.8	175.3	-73.7	-22	0	0	0	111.9	K205 I207 K212	K205-D209 VanDerWaalsContact CE-OD2 3.29Å; K205-D209 WeakPolarHBondContact CE-OD2 3.3Å; K205-D209 VanDerWaalsContact CG-OD2 3.27Å; K205-D209 WeakPolarHBondContact CG-OD2 3.3Å; K205-D209 VanDerWaalsContact NZ-CG 3.25Å; K205-D209 IonicContact NZ-OD1 3.35Å; K205-D209 PolarHBondContact NZ-OD1 2.83Å; K205-D209 IonicContact NZ-OD2 3.09Å; K205-D209 PolarHBondContact NZ-OD2 2.82Å; K205-D209 WeakPolarHBondContact O-CB 3.38Å; K205-D209 PolarHBondContact O-N 2.69Å; I207-D209 VanDerWaalsContact C-N 3.34Å; I207-D209 PolarHBondContact O-N 3.35Å; D209-K212 VanDerWaalsContact O-CD 3.26Å; D209-K212 WeakPolarHBondContact O-CD 3.45Å; D209-K212 WeakPolarHBondContact O-CE 3.39Å; D209-K212 PolarHBondContact O-NZ 3.4Å
210	S	95.2	Very high	95.8	Very high	50 Å²	50	49 Å²	49	35%	0.35	24%	0.238	S	C	.	.	H	α-helix	trans	-72.3	-49.3	176.8	-63.4	0	0	0	0	111.3	F206 I207 T208 K212	F206-S210 VanDerWaalsContact O-CB 3.32Å; F206-S210 WeakPolarHBondContact O-CB 3.25Å; F206-S210 PolarHBondContact O-N 3.04Å; F206-S210 PolarHBondContact O-OG 2.83Å; I207-S210 WeakPolarHBondContact O-CB 3.28Å; I207-S210 PolarHBondContact O-N 2.79Å; I207-S210 VanDerWaalsContact O-N 3.13Å; T208-S210 VanDerWaalsContact C-N 3.34Å; S210-K212 VanDerWaalsContact C-N 3.35Å
211	V	95.8	Very high	95.9	Very high	29 Å²	29	48.5 Å²	48.5	18%	0.176	23%	0.233	C	C	.	.	H	α-helix	trans	-86.2	-3.4	-179.8	-56.3	0	0	0	0	114.2	I207 K213 F222 V230 Y233	I207-V211 PolarHBondContact O-N 2.86Å; V211-K213 VanDerWaalsContact C-N 3.26Å; V211-K213 HydrophobicContact CG2-CB 3.95Å; V211-K213 HydrophobicContact CG2-CG 4.26Å; V211-K213 PolarHBondContact O-N 2.96Å; V211-F222 HydrophobicContact CG2-CD1 4.33Å; V211-F222 HydrophobicContact CG2-CE1 3.91Å; V211-V230 HydrophobicContact CG1-CB 4.11Å; V211-V230 HydrophobicContact CG1-CG1 3.6Å; V211-Y233 HydrophobicContact CB-CD1 3.91Å; V211-Y233 HydrophobicContact CB-CE1 4.27Å; V211-Y233 HydrophobicContact CG1-CD1 3.97Å; V211-Y233 HydrophobicContact CG2-CD1 4.21Å; V211-Y233 HydrophobicContact CG2-CG 4.44Å
212	K	95.6	Very high	96	Very high	159 Å²	159	46.6 Å²	46.6	69%	0.691	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.1	40.8	-173.8	-51.2	-61.5	175.4	-157.6	0	112.8	T208 D209 S210	T208-K212 WeakPolarHBondContact O-CA 3.41Å; T208-K212 PolarHBondContact O-N 2.74Å; D209-K212 VanDerWaalsContact O-CD 3.26Å; D209-K212 WeakPolarHBondContact O-CD 3.45Å; D209-K212 WeakPolarHBondContact O-CE 3.39Å; D209-K212 PolarHBondContact O-NZ 3.4Å; S210-K212 VanDerWaalsContact C-N 3.35Å
213	K	95.1	Very high	96.1	Very high	96 Å²	96	43 Å²	43	42%	0.417	20%	0.201	S	C	.	.			trans	-139.8	132.8	175.6	-54.3	-64	162.3	-153.6	0	110.2	T208 V211 W220 Y233	T208-K213 VanDerWaalsContact CA-O 3.27Å; T208-K213 WeakPolarHBondContact CA-O 3.36Å; T208-K213 WeakPolarHBondContact CB-O 3.06Å; T208-K213 WeakPolarHBondContact CG2-O 3.26Å; T208-K213 PolarHBondContact O-N 3.03Å; T208-K213 VanDerWaalsContact O-N 3.14Å; V211-K213 VanDerWaalsContact C-N 3.26Å; V211-K213 HydrophobicContact CG2-CB 3.95Å; V211-K213 HydrophobicContact CG2-CG 4.26Å; V211-K213 PolarHBondContact O-N 2.96Å; K213-W220 HydrophobicContact CB-CZ3 4.02Å; K213-Y233 HydrophobicContact CG-CE1 4.27Å; K213-Y233 HydrophobicContact CG-CE2 4.02Å
214	I	94.4	Very high	96.1	Very high	95 Å²	95	43 Å²	43	49%	0.487	20%	0.201	S	C	.	.			trans	-99.8	133	169.7	-58.2	174.5	0	0	0	107.1	I195 M196 K216	I195-I214 HydrophobicContact CG2-CG2 4.41Å; M196-I214 HydrophobicContact CG-CG2 3.7Å; M196-I214 HydrophobicContact SD-CG2 3.96Å; I214-K216 PolarHBondContact O-N 2.93Å
215	P	95.1	Very high	96.2	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.006	21%	0.208	C	C	.	.			trans	-52.2	132.9	171.7	-27.4	33.6	0	0	0	111.9	F164 I195 F204 W220 F222	F164-P215 VanDerWaalsContact CE1-O 3.31Å; F164-P215 WeakPolarHBondContact CE1-O 3.3Å; F164-P215 HydrophobicContact CE2-CB 4.5Å; F164-P215 HydrophobicContact CZ-CB 3.99Å; F164-P215 WeakPolarHBondContact CZ-O 3.4Å; I195-P215 HydrophobicContact CG2-CG 4.13Å; F204-P215 HydrophobicContact CE1-CG 3.86Å; F204-P215 HydrophobicContact CZ-CG 4.25Å; P215-W220 HydrophobicContact CB-CB 4.06Å; P215-W220 HydrophobicContact CB-CD2 4.01Å; P215-W220 HydrophobicContact CB-CG 3.79Å; P215-W220 HydrophobicContact CG-CB 4.12Å; P215-W220 HydrophobicContact CG-CD2 4.43Å; P215-W220 HydrophobicContact CG-CG 4.27Å; P215-F222 HydrophobicContact CG-CE2 4.19Å; P215-F222 HydrophobicContact CG-CZ 3.98Å
216	K	93.2	Very high	96.2	Very high	174 Å²	174	41 Å²	41	76%	0.757	20%	0.195	S	C	*	.	S	Bend	trans	-94.4	-11.7	173.1	-65.8	-167.5	173	-168	0	113.2	F164 I214 W220	F164-K216 WeakPolarHBondContact CD1-O 3.29Å; I214-K216 PolarHBondContact O-N 2.93Å; K216-W220 HydrophobicContact CB-CZ2 4.19Å; K216-W220 HydrophobicContact CG-CZ2 4.3Å
217	W	94.2	Very high	96.1	Very high	81 Å²	81	43.5 Å²	43.5	31%	0.307	21%	0.207	S	C	.	.	S	Bend	trans	-155.4	179.5	-175.5	-153.5	-132.5	0	0	0	110.5	N127 F164	N127-W217 PolarHBondContact ND2-O 2.86Å; F164-W217 HydrophobicContact CB-CE3 3.9Å; F164-W217 HydrophobicContact CB-CZ3 4.16Å
218	N	95	Very high	96.2	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.207	C	C	.	.	S	Bend	trans	-66.3	163	171.5	-63.5	-44.1	0	0	0	112.2	N127 A129 F164 T167 W220 A236	N127-N218 WeakPolarHBondContact ND2-CA 3.27Å; A129-N218 HydrophobicContact CB-CB 4.25Å; A129-N218 VanDerWaalsContact CB-CG 3.47Å; A129-N218 WeakPolarHBondContact CB-ND2 3.34Å; F164-N218 WeakPolarHBondContact CD2-OD1 3.48Å; T167-N218 PolarHBondContact OG1-ND2 3.47Å; N218-W220 VanDerWaalsContact C-N 3.31Å; N218-W220 PolarHBondContact O-N 3Å; N218-A236 VanDerWaalsContact O-CB 3.31Å; N218-A236 WeakPolarHBondContact O-CB 3.24Å
219	F	95.9	Very high	96.3	Very high	0 Å²	0	47 Å²	47	0%	0	22%	0.223	C	C	.	.			trans	57.3	34.8	174	-53.6	-72.5	0	0	0	115.4	V126 N127 V128 A129 H134 N138 Y139 K221 K235 A236	V126-F219 HydrophobicContact CG1-CD1 4.21Å; N127-F219 VanDerWaalsContact O-CA 3.24Å; N127-F219 WeakPolarHBondContact O-CA 3.48Å; N127-F219 PolarHBondContact O-N 2.77Å; V128-F219 HydrophobicContact CB-CE1 3.95Å; V128-F219 HydrophobicContact CG1-CD1 4.19Å; V128-F219 HydrophobicContact CG1-CE1 3.87Å; A129-F219 WeakPolarHBondContact O-CZ 3.45Å; H134-F219 HydrophobicContact CB-CD2 3.88Å; H134-F219 HydrophobicContact CB-CE2 4.25Å; N138-F219 HydrophobicContact CB-CB 4.32Å; N138-F219 HydrophobicContact CB-CD1 3.4Å; N138-F219 VanDerWaalsContact CB-CD1 3.4Å; N138-F219 HydrophobicContact CB-CD2 4.31Å; N138-F219 HydrophobicContact CB-CE1 3.69Å; N138-F219 HydrophobicContact CB-CG 3.75Å; N138-F219 HydrophobicContact CB-CZ 4.26Å; Y139-F219 HydrophobicContact CE2-CZ 4.45Å; F219-K221 WeakPolarHBondContact O-CG 3.27Å; F219-K221 PolarHBondContact O-NZ 3.44Å; F219-K235 CarbonylContact O-C 3.59Å; F219-A236 WeakPolarHBondContact O-CA 3.38Å
220	W	97.5	Very high	96.4	Very high	17 Å²	17	44.8 Å²	44.8	6%	0.064	21%	0.212	C	C	.	.			trans	-74.4	141.3	157.3	-73.7	49.9	0	0	0	109	V126 N127 K213 P215 K216 N218 F222 Y233 W234 K235	V126-W220 WeakPolarHBondContact CA-O 3.32Å; N127-W220 PolarHBondContact N-O 2.87Å; N127-W220 WeakPolarHBondContact OD1-CA 3.16Å; N127-W220 WeakPolarHBondContact OD1-CB 3.48Å; N127-W220 PolarHBondContact OD1-N 3.28Å; N127-W220 PolarHBondContact OD1-O 3.14Å; K213-W220 HydrophobicContact CB-CZ3 4.02Å; P215-W220 HydrophobicContact CB-CB 4.06Å; P215-W220 HydrophobicContact CB-CD2 4.01Å; P215-W220 HydrophobicContact CB-CG 3.79Å; P215-W220 HydrophobicContact CG-CB 4.12Å; P215-W220 HydrophobicContact CG-CD2 4.43Å; P215-W220 HydrophobicContact CG-CG 4.27Å; K216-W220 HydrophobicContact CB-CZ2 4.19Å; K216-W220 HydrophobicContact CG-CZ2 4.3Å; N218-W220 VanDerWaalsContact C-N 3.31Å; N218-W220 PolarHBondContact O-N 3Å; W220-F222 HydrophobicContact CB-CE2 3.76Å; W220-F222 HydrophobicContact CB-CZ 4.03Å; W220-F222 HydrophobicContact CE3-CZ 4.09Å; W220-Y233 HydrophobicContact CE3-CD2 4.27Å; W220-Y233 HydrophobicContact CZ3-CD2 4.15Å; W220-Y233 HydrophobicContact CZ3-CE2 4.07Å; W220-W234 CarbonylContact C-O 3.47Å; W220-W234 WeakPolarHBondContact CA-O 3.32Å; W220-K235 HydrophobicContact CD2-CB 4.44Å; W220-K235 HydrophobicContact CD2-CG 4.38Å; W220-K235 HydrophobicContact CH2-CG 4.04Å; W220-K235 HydrophobicContact CZ2-CB 4.41Å; W220-K235 HydrophobicContact CZ2-CD 4.45Å; W220-K235 HydrophobicContact CZ2-CG 3.86Å; W220-K235 HydrophobicContact CZ3-CG 4.34Å
221	K	98.2	Very high	96.5	Very high	3 Å²	3	46.2 Å²	46.2	1%	0.013	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	134.1	-164.5	-42.6	171.9	-177.3	63.6	0	107.8	L124 V125 V126 N138 F219 Y233 W234 K235 A236 V243	L124-K221 HydrophobicContact CD1-CB 4.17Å; V125-K221 CarbonylContact O-C 3.59Å; V125-K221 WeakPolarHBondContact O-CA 3.45Å; V126-K221 HydrophobicContact CG1-CG 4.43Å; V126-K221 HydrophobicContact CG2-CB 4.36Å; V126-K221 HydrophobicContact CG2-CG 4.41Å; N138-K221 WeakPolarHBondContact OD1-CE 3.34Å; N138-K221 PolarHBondContact OD1-NZ 2.8Å; F219-K221 WeakPolarHBondContact O-CG 3.27Å; F219-K221 PolarHBondContact O-NZ 3.44Å; K221-Y233 CarbonylContact O-C 3.51Å; K221-Y233 WeakPolarHBondContact O-CA 3.19Å; K221-W234 HydrophobicContact CB-CB 4.31Å; K221-W234 HydrophobicContact CB-CE3 4.17Å; K221-W234 HydrophobicContact CD-CB 4.45Å; K221-W234 PolarHBondContact N-O 2.91Å; K221-W234 PolarHBondContact O-N 2.76Å; K221-K235 PolarHBondContact NZ-O 2.95Å; K221-A236 PolarHBondContact NZ-O 3.35Å; K221-V243 HydrophobicContact CD-CG2 3.97Å
222	F	98.5	Very high	96.6	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	118	-174.4	-57.6	-93.5	0	0	0	109.5	V125 F204 I207 V211 P215 W220 V230 Y233	V125-F222 HydrophobicContact CB-CB 4.43Å; V125-F222 PolarHBondContact N-O 3.26Å; V125-F222 PolarHBondContact O-N 2.81Å; F204-F222 HydrophobicContact CE1-CE2 4.2Å; F204-F222 HydrophobicContact CZ-CD2 4.3Å; F204-F222 AromaticContact CZ-CE2 3.84Å; F204-F222 HydrophobicContact CZ-CE2 3.84Å; I207-F222 HydrophobicContact CG2-CB 3.72Å; I207-F222 HydrophobicContact CG2-CD1 3.27Å; I207-F222 HydrophobicContact CG2-CD2 3.93Å; I207-F222 HydrophobicContact CG2-CE1 3.79Å; I207-F222 HydrophobicContact CG2-CE2 4.38Å; I207-F222 HydrophobicContact CG2-CG 3.35Å; I207-F222 HydrophobicContact CG2-CZ 4.31Å; V211-F222 HydrophobicContact CG2-CD1 4.33Å; V211-F222 HydrophobicContact CG2-CE1 3.91Å; P215-F222 HydrophobicContact CG-CE2 4.19Å; P215-F222 HydrophobicContact CG-CZ 3.98Å; W220-F222 HydrophobicContact CB-CE2 3.76Å; W220-F222 HydrophobicContact CB-CZ 4.03Å; W220-F222 HydrophobicContact CE3-CZ 4.09Å; F222-V230 HydrophobicContact CB-CG1 4.21Å; F222-V230 HydrophobicContact CD1-CG1 4.43Å; F222-Y233 VanDerWaalsContact CD1-CB 3.44Å; F222-Y233 HydrophobicContact CD1-CG 4.44Å; F222-Y233 HydrophobicContact CE1-CG 4.34Å
223	L	98.4	Very high	96.7	Very high	2 Å²	2	44 Å²	44	1%	0.01	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	118.5	177.5	-178.9	61.7	0	0	0	109.5	A122 L124 V231 R232 W234 E246 M250	A122-L223 HydrophobicContact CB-CD1 4.32Å; L124-L223 HydrophobicContact CD1-CB 4.46Å; L223-V231 HydrophobicContact CB-CG2 4.28Å; L223-V231 HydrophobicContact CD2-CG2 4.09Å; L223-V231 HydrophobicContact CG-CG2 4.03Å; L223-V231 PolarHBondContact O-N 2.74Å; L223-R232 HydrophobicContact CB-CB 4.47Å; L223-R232 PolarHBondContact N-O 2.84Å; L223-W234 HydrophobicContact CB-CH2 3.81Å; L223-W234 HydrophobicContact CB-CZ3 3.66Å; L223-W234 HydrophobicContact CD2-CH2 4.19Å; L223-E246 HydrophobicContact CD2-CB 4.22Å; L223-M250 HydrophobicContact CD1-CE 4.46Å; L223-M250 HydrophobicContact CD1-SD 4Å; L223-M250 HydrophobicContact CD2-CE 3.83Å; L223-M250 HydrophobicContact CD2-SD 4.23Å; L223-M250 HydrophobicContact CG-CE 3.86Å; L223-M250 HydrophobicContact CG-SD 4.06Å
224	V	98.5	Very high	96.8	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	130.5	177.4	-173.5	0	0	0	0	108.9	F100 Y101 A122 S123 V125 G228 Q229 V230	F100-V224 HydrophobicContact CB-CG1 3.95Å; F100-V224 HydrophobicContact CD1-CB 4.47Å; F100-V224 HydrophobicContact CD1-CG1 4.04Å; F100-V224 HydrophobicContact CD1-CG2 4.15Å; F100-V224 HydrophobicContact CG-CG1 4.32Å; F100-V224 HydrophobicContact CG-CG2 4.34Å; Y101-V224 HydrophobicContact CE1-CG1 4.47Å; Y101-V224 HydrophobicContact CE2-CG1 4.35Å; A122-V224 WeakPolarHBondContact CA-O 3.26Å; S123-V224 PolarHBondContact N-O 2.98Å; S123-V224 PolarHBondContact O-N 3.06Å; V125-V224 HydrophobicContact CG2-CG2 3.87Å; V224-G228 VanDerWaalsContact CG1-C 3.45Å; V224-Q229 CarbonylContact C-O 3.58Å; V224-Q229 WeakPolarHBondContact CA-O 3.16Å; V224-V230 HydrophobicContact CG2-CG2 4.35Å
225	N	97.8	Very high	96.8	Very high	29 Å²	29	39.4 Å²	39.4	16%	0.155	18%	0.18	C	C	.	.			trans	-77.9	173.9	-178.6	83.4	-13.9	0	0	0	112.8	Y101 E227 G228 Q229 V231 M250	Y101-N225 WeakPolarHBondContact CE2-O 3.25Å; Y101-N225 PolarHBondContact OH-O 3.01Å; Y101-N225 VanDerWaalsContact OH-O 3.11Å; N225-E227 PolarHBondContact ND2-OE2 3.31Å; N225-E227 PolarHBondContact O-N 2.85Å; N225-E227 PolarHBondContact OD1-N 3.15Å; N225-G228 PolarHBondContact O-N 2.87Å; N225-G228 PolarHBondContact OD1-N 2.83Å; N225-Q229 PolarHBondContact N-O 2.79Å; N225-Q229 PolarHBondContact OD1-N 2.89Å; N225-Q229 PolarHBondContact OD1-O 2.81Å; N225-V231 HydrophobicContact CB-CG1 3.96Å; N225-M250 HydrophobicContact CB-CE 3.64Å; N225-M250 HydrophobicContact CB-SD 4.11Å
226	P	96.7	Very high	96.6	Very high	20 Å²	20	39.7 Å²	39.7	13%	0.13	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-30	178.6	-27.3	36.5	0	0	0	115.1	Y101 R119 G120 K121 G228 I254	Y101-P226 WeakPolarHBondContact CE2-O 3.25Å; R119-P226 WeakPolarHBondContact CG-O 3.32Å; G120-P226 PolarHBondContact N-O 2.97Å; K121-P226 WeakPolarHBondContact O-CA 3.25Å; P226-G228 VanDerWaalsContact C-N 3.35Å; P226-I254 HydrophobicContact CG-CD1 3.59Å; P226-I254 HydrophobicContact CG-CG1 3.46Å; P226-I254 VanDerWaalsContact CG-CG1 3.46Å
227	E	96.1	Very high	96.4	Very high	82 Å²	82	37.3 Å²	37.3	38%	0.383	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-0.8	180	-63.1	75.3	-165.2	0	0	113.3	D99 N225 K257	D99-E227 WeakPolarHBondContact CB-O 3.46Å; N225-E227 PolarHBondContact ND2-OE2 3.31Å; N225-E227 PolarHBondContact O-N 2.85Å; N225-E227 PolarHBondContact OD1-N 3.15Å; E227-K257 IonicContact OE1-NZ 3.72Å; E227-K257 PolarHBondContact OE1-NZ 3.2Å; E227-K257 VanDerWaalsContact OE1-NZ 3.09Å
228	G	97.2	Very high	96.3	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.171	C	C	.	.	S	Bend	trans	85.9	15.8	174.8	0	0	0	0	0	115.3	F100 Y101 V224 N225 P226	F100-G228 WeakPolarHBondContact CB-O 3.4Å; F100-G228 PolarHBondContact N-O 2.64Å; Y101-G228 VanDerWaalsContact CD2-CA 3.45Å; Y101-G228 VanDerWaalsContact CE2-CA 3.49Å; V224-G228 VanDerWaalsContact CG1-C 3.45Å; N225-G228 PolarHBondContact O-N 2.87Å; N225-G228 PolarHBondContact OD1-N 2.83Å; P226-G228 VanDerWaalsContact C-N 3.35Å
229	Q	97.6	Very high	96.1	Very high	80 Å²	80	40.2 Å²	40.2	37%	0.374	20%	0.199	S	C	.	.			trans	-96.7	140.3	178	-56.5	-57.5	-46.2	0	0	111.3	V224 N225 V231	V224-Q229 CarbonylContact C-O 3.58Å; V224-Q229 WeakPolarHBondContact CA-O 3.16Å; N225-Q229 PolarHBondContact N-O 2.79Å; N225-Q229 PolarHBondContact OD1-N 2.89Å; N225-Q229 PolarHBondContact OD1-O 2.81Å; Q229-V231 PolarHBondContact O-N 2.86Å
230	V	97.6	Very high	95.9	Very high	23 Å²	23	41.8 Å²	41.8	14%	0.139	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	117.3	176.6	-167	0	0	0	0	109.6	F206 I207 V211 F222 V224	F206-V230 HydrophobicContact CE1-CG2 4.46Å; I207-V230 HydrophobicContact CB-CG2 4.24Å; I207-V230 HydrophobicContact CG1-CG2 4.03Å; I207-V230 HydrophobicContact CG2-CG1 4.47Å; I207-V230 HydrophobicContact CG2-CG2 4.11Å; V211-V230 HydrophobicContact CG1-CB 4.11Å; V211-V230 HydrophobicContact CG1-CG1 3.6Å; F222-V230 HydrophobicContact CB-CG1 4.21Å; F222-V230 HydrophobicContact CD1-CG1 4.43Å; V224-V230 HydrophobicContact CG2-CG2 4.35Å
231	V	97.3	Very high	95.7	Very high	79 Å²	79	45.7 Å²	45.7	48%	0.479	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	-32.3	-177.1	-58.6	0	0	0	0	113.5	L223 N225 Q229 M250	L223-V231 HydrophobicContact CB-CG2 4.28Å; L223-V231 HydrophobicContact CD2-CG2 4.09Å; L223-V231 HydrophobicContact CG-CG2 4.03Å; L223-V231 PolarHBondContact O-N 2.74Å; N225-V231 HydrophobicContact CB-CG1 3.96Å; Q229-V231 PolarHBondContact O-N 2.86Å; V231-M250 HydrophobicContact CB-CE 4.5Å; V231-M250 HydrophobicContact CG1-CE 4.29Å; V231-M250 HydrophobicContact CG2-CE 3.44Å; V231-M250 VanDerWaalsContact CG2-CE 3.44Å
232	R	97.6	Very high	95.6	Very high	82 Å²	82	47.1 Å²	47.1	31%	0.309	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	150.7	-174.5	-170.3	70.8	-174.9	85.1	26.8	109.9	L223 W234 E238 E246	L223-R232 HydrophobicContact CB-CB 4.47Å; L223-R232 PolarHBondContact N-O 2.84Å; R232-W234 HydrophobicContact CB-CH2 3.78Å; R232-W234 HydrophobicContact CB-CZ2 4.25Å; R232-W234 HydrophobicContact CB-CZ3 4.1Å; R232-W234 HydrophobicContact CG-CD2 4.34Å; R232-W234 HydrophobicContact CG-CE3 4.38Å; R232-W234 HydrophobicContact CG-CH2 3.5Å; R232-W234 HydrophobicContact CG-CZ2 3.45Å; R232-W234 VanDerWaalsContact CG-CZ2 3.45Å; R232-W234 HydrophobicContact CG-CZ3 3.98Å; R232-E238 IonicContact NH2-OE2 2.86Å; R232-E238 PolarHBondContact NH2-OE2 3.14Å; R232-E246 IonicContact NE-OE1 3.47Å
233	Y	97.8	Very high	95.5	Very high	60 Å²	60	47.1 Å²	47.1	24%	0.235	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	153.1	174.2	74.7	-84.5	0	0	0	111.2	V211 K213 W220 K221 F222	V211-Y233 HydrophobicContact CB-CD1 3.91Å; V211-Y233 HydrophobicContact CB-CE1 4.27Å; V211-Y233 HydrophobicContact CG1-CD1 3.97Å; V211-Y233 HydrophobicContact CG2-CD1 4.21Å; V211-Y233 HydrophobicContact CG2-CG 4.44Å; K213-Y233 HydrophobicContact CG-CE1 4.27Å; K213-Y233 HydrophobicContact CG-CE2 4.02Å; W220-Y233 HydrophobicContact CE3-CD2 4.27Å; W220-Y233 HydrophobicContact CZ3-CD2 4.15Å; W220-Y233 HydrophobicContact CZ3-CE2 4.07Å; K221-Y233 CarbonylContact O-C 3.51Å; K221-Y233 WeakPolarHBondContact O-CA 3.19Å; F222-Y233 VanDerWaalsContact CD1-CB 3.44Å; F222-Y233 HydrophobicContact CD1-CG 4.44Å; F222-Y233 HydrophobicContact CE1-CG 4.34Å
234	W	97.9	Very high	95.4	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	150.1	177.4	-56.8	-104.6	0	0	0	109.5	L124 W220 K221 L223 R232 E238 S242 V243 E246	L124-W234 HydrophobicContact CD1-CZ3 4.11Å; W220-W234 CarbonylContact C-O 3.47Å; W220-W234 WeakPolarHBondContact CA-O 3.32Å; K221-W234 HydrophobicContact CB-CB 4.31Å; K221-W234 HydrophobicContact CB-CE3 4.17Å; K221-W234 HydrophobicContact CD-CB 4.45Å; K221-W234 PolarHBondContact N-O 2.91Å; K221-W234 PolarHBondContact O-N 2.76Å; L223-W234 HydrophobicContact CB-CH2 3.81Å; L223-W234 HydrophobicContact CB-CZ3 3.66Å; L223-W234 HydrophobicContact CD2-CH2 4.19Å; R232-W234 HydrophobicContact CB-CH2 3.78Å; R232-W234 HydrophobicContact CB-CZ2 4.25Å; R232-W234 HydrophobicContact CB-CZ3 4.1Å; R232-W234 HydrophobicContact CG-CD2 4.34Å; R232-W234 HydrophobicContact CG-CE3 4.38Å; R232-W234 HydrophobicContact CG-CH2 3.5Å; R232-W234 HydrophobicContact CG-CZ2 3.45Å; R232-W234 VanDerWaalsContact CG-CZ2 3.45Å; R232-W234 HydrophobicContact CG-CZ3 3.98Å; W234-E238 WeakPolarHBondContact CA-OE1 3.47Å; W234-E238 HydrophobicContact CB-CB 4Å; W234-E238 VanDerWaalsContact CD1-OE2 3.27Å; W234-E238 HydrophobicContact CG-CB 4.45Å; W234-S242 VanDerWaalsContact CD1-OG 3.32Å; W234-S242 PolarHBondContact NE1-OG 3.47Å; W234-V243 HydrophobicContact CB-CG2 4.48Å; W234-V243 HydrophobicContact CD2-CG2 3.78Å; W234-V243 HydrophobicContact CE3-CG1 4.34Å; W234-V243 HydrophobicContact CE3-CG2 4.29Å; W234-V243 HydrophobicContact CG-CG2 3.87Å; W234-V243 HydrophobicContact CH2-CG1 4.21Å; W234-V243 HydrophobicContact CZ2-CB 4.34Å; W234-V243 HydrophobicContact CZ2-CG1 4.39Å; W234-V243 HydrophobicContact CZ2-CG2 4.37Å; W234-V243 HydrophobicContact CZ3-CG1 4.19Å; W234-E246 HydrophobicContact CH2-CB 4.06Å; W234-E246 HydrophobicContact CZ2-CB 3.82Å; W234-E246 HydrophobicContact CZ2-CG 3.94Å
235	K	95.6	Very high	95.3	Very high	94 Å²	94	56.5 Å²	56.5	41%	0.409	28%	0.282	S	S	.	.			trans	-80.5	-171.5	172.9	-54.8	172.5	-166.8	162.1	0	111.7	F219 W220 K221 E237 E238	F219-K235 CarbonylContact O-C 3.59Å; W220-K235 HydrophobicContact CD2-CB 4.44Å; W220-K235 HydrophobicContact CD2-CG 4.38Å; W220-K235 HydrophobicContact CH2-CG 4.04Å; W220-K235 HydrophobicContact CZ2-CB 4.41Å; W220-K235 HydrophobicContact CZ2-CD 4.45Å; W220-K235 HydrophobicContact CZ2-CG 3.86Å; W220-K235 HydrophobicContact CZ3-CG 4.34Å; K221-K235 PolarHBondContact NZ-O 2.95Å; K235-E237 VanDerWaalsContact C-N 3.33Å; K235-E237 WeakPolarHBondContact CB-OE2 3.34Å; K235-E238 WeakPolarHBondContact CG-OE1 3.19Å; K235-E238 PolarHBondContact N-OE1 3.43Å
236	A	90.1	Very high	95.3	Very high	7 Å²	7	59.2 Å²	59.2	6%	0.058	29%	0.294	C	S	.	.	S	Bend	trans	-63.4	-40.3	175.6	0	0	0	0	0	112.2	N218 F219 K221	N218-A236 VanDerWaalsContact O-CB 3.31Å; N218-A236 WeakPolarHBondContact O-CB 3.24Å; F219-A236 WeakPolarHBondContact O-CA 3.38Å; K221-A236 PolarHBondContact NZ-O 3.35Å
237	E	88.4	Confident	95.3	Very high	125 Å²	125	58.2 Å²	58.2	58%	0.584	29%	0.287	S	S	*	.	S	Bend	trans	-92.2	-10.9	-164.7	-37.5	78.6	-175.5	0	0	113.5	K235	K235-E237 VanDerWaalsContact C-N 3.33Å; K235-E237 WeakPolarHBondContact CB-OE2 3.34Å
238	E	92.2	Very high	95.3	Very high	53 Å²	53	57.2 Å²	57.2	25%	0.248	29%	0.287	C	S	.	.	S	Bend	trans	-73.1	137	178.9	-81.7	172.1	-100.4	0	0	111.5	R232 W234 K235	R232-E238 IonicContact NH2-OE2 2.86Å; R232-E238 PolarHBondContact NH2-OE2 3.14Å; W234-E238 WeakPolarHBondContact CA-OE1 3.47Å; W234-E238 HydrophobicContact CB-CB 4Å; W234-E238 VanDerWaalsContact CD1-OE2 3.27Å; W234-E238 HydrophobicContact CG-CB 4.45Å; K235-E238 WeakPolarHBondContact CG-OE1 3.19Å; K235-E238 PolarHBondContact N-OE1 3.43Å
239	P	90.9	Very high	95.3	Very high	89 Å²	89	59.4 Å²	59.4	58%	0.578	31%	0.305	S	S	*	.			trans	-68	135.7	-171.7	27.4	-35.4	0	0	0	112.2	D241 S242	P239-D241 PolarHBondContact O-N 3.47Å; P239-D241 VanDerWaalsContact O-N 3.16Å; P239-S242 PolarHBondContact O-N 3.13Å; P239-S242 VanDerWaalsContact O-N 3.11Å; P239-S242 PolarHBondContact O-OG 3.18Å
240	V	91.8	Very high	95.2	Very high	32 Å²	32	56.4 Å²	56.4	19%	0.194	29%	0.291	C	S	.	.	H	α-helix	trans	-63.5	-23.6	-174	71.5	0	0	0	0	113.6	S242 V243 R244	V240-S242 PolarHBondContact O-N 3Å; V240-V243 HydrophobicContact CG2-CB 4.41Å; V240-V243 CarbonylContact O-C 3.56Å; V240-V243 WeakPolarHBondContact O-CA 3.11Å; V240-V243 VanDerWaalsContact O-CB 3.26Å; V240-V243 WeakPolarHBondContact O-CB 3.3Å; V240-V243 PolarHBondContact O-N 2.71Å; V240-R244 PolarHBondContact O-N 3.36Å
241	D	93.9	Very high	95.2	Very high	100 Å²	100	56 Å²	56	54%	0.535	29%	0.288	S	S	.	.	H	α-helix	trans	-64.4	-29.9	177	-60.5	-46.6	0	0	0	112.7	P239 V243 R244 Q245	P239-D241 PolarHBondContact O-N 3.47Å; P239-D241 VanDerWaalsContact O-N 3.16Å; D241-V243 VanDerWaalsContact C-N 3.31Å; D241-V243 PolarHBondContact O-N 3.01Å; D241-R244 PolarHBondContact O-N 3.16Å; D241-R244 IonicContact OD1-NE 3.56Å; D241-Q245 WeakPolarHBondContact O-CB 3.4Å; D241-Q245 PolarHBondContact O-N 3.48Å
242	S	96.1	Very high	95.1	Very high	33 Å²	33	60.6 Å²	60.6	23%	0.231	30%	0.297	C	S	.	.	H	α-helix	trans	-67.7	-32.7	171.1	71.5	0	0	0	0	112.2	W234 P239 V240 E246	W234-S242 VanDerWaalsContact CD1-OG 3.32Å; W234-S242 PolarHBondContact NE1-OG 3.47Å; P239-S242 PolarHBondContact O-N 3.13Å; P239-S242 VanDerWaalsContact O-N 3.11Å; P239-S242 PolarHBondContact O-OG 3.18Å; V240-S242 PolarHBondContact O-N 3Å; S242-E246 VanDerWaalsContact O-CG 3.3Å; S242-E246 WeakPolarHBondContact O-CG 3.43Å; S242-E246 PolarHBondContact O-N 2.86Å
243	V	96.6	Very high	95	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-71.5	-42.6	172.8	-166.6	0	0	0	0	110.2	L124 L145 K221 W234 V240 D241 A247	L124-V243 HydrophobicContact CD1-CG1 3.7Å; L124-V243 HydrophobicContact CD2-CG1 3.66Å; L124-V243 HydrophobicContact CG-CG1 4.36Å; L145-V243 HydrophobicContact CD2-CG1 4.22Å; K221-V243 HydrophobicContact CD-CG2 3.97Å; W234-V243 HydrophobicContact CB-CG2 4.48Å; W234-V243 HydrophobicContact CD2-CG2 3.78Å; W234-V243 HydrophobicContact CE3-CG1 4.34Å; W234-V243 HydrophobicContact CE3-CG2 4.29Å; W234-V243 HydrophobicContact CG-CG2 3.87Å; W234-V243 HydrophobicContact CH2-CG1 4.21Å; W234-V243 HydrophobicContact CZ2-CB 4.34Å; W234-V243 HydrophobicContact CZ2-CG1 4.39Å; W234-V243 HydrophobicContact CZ2-CG2 4.37Å; W234-V243 HydrophobicContact CZ3-CG1 4.19Å; V240-V243 HydrophobicContact CG2-CB 4.41Å; V240-V243 CarbonylContact O-C 3.56Å; V240-V243 WeakPolarHBondContact O-CA 3.11Å; V240-V243 VanDerWaalsContact O-CB 3.26Å; V240-V243 WeakPolarHBondContact O-CB 3.3Å; V240-V243 PolarHBondContact O-N 2.71Å; D241-V243 VanDerWaalsContact C-N 3.31Å; D241-V243 PolarHBondContact O-N 3.01Å; V243-A247 WeakPolarHBondContact O-CB 3.47Å; V243-A247 PolarHBondContact O-N 3.16Å
244	R	95.9	Very high	94.9	Very high	53 Å²	53	60.5 Å²	60.5	20%	0.2	30%	0.302	C	S	.	.	H	α-helix	trans	-60.9	-46	177.6	-167	-169	-58.8	-102.1	10.1	111	E144 L145 E148 V240 D241 T248	E144-R244 IonicContact OE2-CZ 2.91Å; E144-R244 IonicContact OE2-NH1 2.69Å; E144-R244 PolarHBondContact OE2-NH1 3.44Å; E144-R244 IonicContact OE2-NH2 3.96Å; E144-R244 PolarHBondContact OE2-NH2 3.5Å; L145-R244 HydrophobicContact CD1-CB 4.04Å; L145-R244 HydrophobicContact CD1-CG 3.79Å; E148-R244 IonicContact OE1-NH1 3.03Å; E148-R244 PolarHBondContact OE1-NH1 2.67Å; E148-R244 IonicContact OE2-CZ 2.68Å; E148-R244 IonicContact OE2-NH1 2.82Å; E148-R244 PolarHBondContact OE2-NH1 3.16Å; V240-R244 PolarHBondContact O-N 3.36Å; D241-R244 PolarHBondContact O-N 3.16Å; D241-R244 IonicContact OD1-NE 3.56Å; R244-T248 WeakPolarHBondContact O-CB 3.33Å; R244-T248 PolarHBondContact O-N 3.09Å; R244-T248 PolarHBondContact O-OG1 2.95Å
245	Q	96.6	Very high	94.7	Very high	146 Å²	146	62.9 Å²	62.9	68%	0.682	32%	0.315	S	S	*	.	H	α-helix	trans	-59.8	-53.2	179	-177.2	176.4	2	0	0	111.9	D241 T248 A249	D241-Q245 WeakPolarHBondContact O-CB 3.4Å; D241-Q245 PolarHBondContact O-N 3.48Å; Q245-T248 PolarHBondContact O-N 2.86Å; Q245-A249 WeakPolarHBondContact O-CB 3.37Å; Q245-A249 PolarHBondContact O-N 2.91Å
246	E	97.3	Very high	94.7	Very high	85 Å²	85	62.9 Å²	62.9	40%	0.397	32%	0.319	S	S	.	.	H	α-helix	trans	-67.9	-41.2	-177.2	-67.7	-100	-123.8	0	0	111.9	L223 R232 W234 S242 T248 A249 M250	L223-E246 HydrophobicContact CD2-CB 4.22Å; R232-E246 IonicContact NE-OE1 3.47Å; W234-E246 HydrophobicContact CH2-CB 4.06Å; W234-E246 HydrophobicContact CZ2-CB 3.82Å; W234-E246 HydrophobicContact CZ2-CG 3.94Å; S242-E246 VanDerWaalsContact O-CG 3.3Å; S242-E246 WeakPolarHBondContact O-CG 3.43Å; S242-E246 PolarHBondContact O-N 2.86Å; E246-T248 PolarHBondContact O-N 3.02Å; E246-A249 PolarHBondContact O-N 3.33Å; E246-M250 PolarHBondContact O-N 3.12Å
247	A	96.6	Very high	94.9	Very high	0 Å²	0	67.4 Å²	67.4	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-64.3	-39.5	174	0	0	0	0	0	112.2	L149 F154 V243 V251	L149-A247 HydrophobicContact CD1-CB 3.73Å; F154-A247 HydrophobicContact CD2-CB 4.36Å; F154-A247 HydrophobicContact CE2-CB 3.85Å; F154-A247 HydrophobicContact CZ-CB 4.41Å; V243-A247 WeakPolarHBondContact O-CB 3.47Å; V243-A247 PolarHBondContact O-N 3.16Å; A247-V251 WeakPolarHBondContact O-CB 3.45Å; A247-V251 VanDerWaalsContact O-CG2 3.26Å; A247-V251 WeakPolarHBondContact O-CG2 3.42Å; A247-V251 PolarHBondContact O-N 3.25Å
248	T	96.2	Very high	95	Very high	61 Å²	61	65.7 Å²	65.7	37%	0.374	33%	0.328	S	S	.	.	H	α-helix	trans	-68.2	-39.8	177.4	-57.6	0	0	0	0	111.6	L149 R244 Q245 E246 V251 R252	L149-T248 HydrophobicContact CD2-CG2 4.44Å; R244-T248 WeakPolarHBondContact O-CB 3.33Å; R244-T248 PolarHBondContact O-N 3.09Å; R244-T248 PolarHBondContact O-OG1 2.95Å; Q245-T248 PolarHBondContact O-N 2.86Å; E246-T248 PolarHBondContact O-N 3.02Å; T248-V251 PolarHBondContact O-N 3.39Å; T248-R252 WeakPolarHBondContact O-CB 3.31Å; T248-R252 PolarHBondContact O-N 2.82Å
249	A	96.8	Very high	95.1	Very high	45 Å²	45	71.8 Å²	71.8	37%	0.372	35%	0.348	S	S	.	.	H	α-helix	trans	-59.9	-51.3	174.5	0	0	0	0	0	111	Q245 E246 V251 R252 E253	Q245-A249 WeakPolarHBondContact O-CB 3.37Å; Q245-A249 PolarHBondContact O-N 2.91Å; E246-A249 PolarHBondContact O-N 3.33Å; A249-V251 PolarHBondContact O-N 2.85Å; A249-R252 WeakPolarHBondContact O-CB 3.5Å; A249-R252 PolarHBondContact O-N 2.96Å; A249-R252 VanDerWaalsContact O-N 3.14Å; A249-E253 PolarHBondContact O-N 2.73Å
250	M	96.8	Very high	95.2	Very high	18 Å²	18	71.7 Å²	71.7	9%	0.089	36%	0.355	C	S	.	.	H	α-helix	trans	-61	-41.7	177.1	-176.6	-179.2	-76	0	0	112.6	A122 L223 N225 V231 E246 R252 E253 I254	A122-M250 HydrophobicContact CB-CG 3.92Å; A122-M250 HydrophobicContact CB-SD 3.43Å; A122-M250 WeakPolarHBondContact CB-SD 3.43Å; L223-M250 HydrophobicContact CD1-CE 4.46Å; L223-M250 HydrophobicContact CD1-SD 4Å; L223-M250 HydrophobicContact CD2-CE 3.83Å; L223-M250 HydrophobicContact CD2-SD 4.23Å; L223-M250 HydrophobicContact CG-CE 3.86Å; L223-M250 HydrophobicContact CG-SD 4.06Å; N225-M250 HydrophobicContact CB-CE 3.64Å; N225-M250 HydrophobicContact CB-SD 4.11Å; V231-M250 HydrophobicContact CB-CE 4.5Å; V231-M250 HydrophobicContact CG1-CE 4.29Å; V231-M250 HydrophobicContact CG2-CE 3.44Å; V231-M250 VanDerWaalsContact CG2-CE 3.44Å; E246-M250 PolarHBondContact O-N 3.12Å; M250-R252 VanDerWaalsContact C-N 3.31Å; M250-R252 PolarHBondContact O-N 3.31Å; M250-E253 PolarHBondContact O-N 3.11Å; M250-I254 HydrophobicContact CG-CD1 4.16Å; M250-I254 VanDerWaalsContact O-CG1 3.25Å; M250-I254 WeakPolarHBondContact O-CG1 3.44Å; M250-I254 PolarHBondContact O-N 3.04Å
251	V	96.5	Very high	95.2	Very high	13 Å²	13	76.1 Å²	76.1	8%	0.079	37%	0.374	C	S	.	.	H	α-helix	trans	-60.8	-40.3	175.1	163.5	0	0	0	0	111.6	A122 L149 H153 F154 A247 T248 A249 I254 I255	A122-V251 HydrophobicContact CB-CG2 4.28Å; L149-V251 HydrophobicContact CB-CG2 4.36Å; L149-V251 HydrophobicContact CD1-CG2 4.36Å; L149-V251 HydrophobicContact CD2-CG1 4.45Å; H153-V251 HydrophobicContact CB-CG1 4.21Å; H153-V251 HydrophobicContact CB-CG2 4.41Å; F154-V251 HydrophobicContact CB-CG2 3.83Å; A247-V251 WeakPolarHBondContact O-CB 3.45Å; A247-V251 VanDerWaalsContact O-CG2 3.26Å; A247-V251 WeakPolarHBondContact O-CG2 3.42Å; A247-V251 PolarHBondContact O-N 3.25Å; T248-V251 PolarHBondContact O-N 3.39Å; A249-V251 PolarHBondContact O-N 2.85Å; V251-I254 PolarHBondContact O-N 2.86Å; V251-I255 HydrophobicContact CG1-CD1 3.9Å; V251-I255 WeakPolarHBondContact O-CD1 3.35Å; V251-I255 VanDerWaalsContact O-CG1 3.29Å; V251-I255 WeakPolarHBondContact O-CG1 3.48Å; V251-I255 PolarHBondContact O-N 2.84Å; V251-I255 VanDerWaalsContact O-N 3.08Å
252	R	95.6	Very high	94.3	Very high	177 Å²	177	81.1 Å²	81.1	67%	0.668	40%	0.399	S	S	*	.	H	α-helix	trans	-64.1	-42.4	174.9	-178.2	-179.9	177.8	177.9	-0.8	111.8	T248 A249 M250 I255 L256	T248-R252 WeakPolarHBondContact O-CB 3.31Å; T248-R252 PolarHBondContact O-N 2.82Å; A249-R252 WeakPolarHBondContact O-CB 3.5Å; A249-R252 PolarHBondContact O-N 2.96Å; A249-R252 VanDerWaalsContact O-N 3.14Å; M250-R252 VanDerWaalsContact C-N 3.31Å; M250-R252 PolarHBondContact O-N 3.31Å; R252-I255 PolarHBondContact O-N 2.98Å; R252-L256 HydrophobicContact CG-CD1 4.02Å; R252-L256 HydrophobicContact CG-CG 4.47Å; R252-L256 VanDerWaalsContact O-CG 3.3Å; R252-L256 WeakPolarHBondContact O-CG 3.36Å; R252-L256 PolarHBondContact O-N 3.28Å
253	E	95.7	Very high	94.2	Very high	130 Å²	130	83.5 Å²	83.5	61%	0.607	41%	0.408	S	S	*	.	H	α-helix	trans	-62.1	-43.1	175.5	-70.8	176.4	168.6	0	0	112.1	A249 M250 I255 L256 K257	A249-E253 PolarHBondContact O-N 2.73Å; M250-E253 PolarHBondContact O-N 3.11Å; E253-I255 VanDerWaalsContact C-N 3.32Å; E253-I255 PolarHBondContact O-N 3.08Å; E253-L256 PolarHBondContact O-N 2.95Å; E253-K257 WeakPolarHBondContact O-CB 3.36Å; E253-K257 PolarHBondContact O-N 2.82Å
254	I	95.3	Very high	94.1	Very high	9 Å²	9	87.9 Å²	87.9	5%	0.046	43%	0.429	C	S	.	.	H	α-helix	trans	-57.9	-44.9	174.7	-65.8	162.4	0	0	0	111	A122 H153 P226 M250 V251 K258	A122-I254 HydrophobicContact CB-CD1 3.94Å; H153-I254 HydrophobicContact CB-CB 4.47Å; H153-I254 HydrophobicContact CB-CD1 4.42Å; H153-I254 HydrophobicContact CB-CG2 4.04Å; H153-I254 WeakPolarHBondContact ND1-CG2 3.25Å; P226-I254 HydrophobicContact CG-CD1 3.59Å; P226-I254 HydrophobicContact CG-CG1 3.46Å; P226-I254 VanDerWaalsContact CG-CG1 3.46Å; M250-I254 HydrophobicContact CG-CD1 4.16Å; M250-I254 VanDerWaalsContact O-CG1 3.25Å; M250-I254 WeakPolarHBondContact O-CG1 3.44Å; M250-I254 PolarHBondContact O-N 3.04Å; V251-I254 PolarHBondContact O-N 2.86Å; I254-K258 HydrophobicContact CG2-CD 4.22Å; I254-K258 WeakPolarHBondContact O-CB 3.31Å; I254-K258 WeakPolarHBondContact O-CG 3.5Å; I254-K258 PolarHBondContact O-N 2.76Å
255	I	94.5	Very high	94	Very high	50 Å²	50	89.8 Å²	89.8	26%	0.256	44%	0.442	S	S	.	.	H	α-helix	trans	-66.1	-41.6	179	-68.2	163.3	0	0	0	111	H153 V251 R252 E253 R259	H153-I255 WeakPolarHBondContact CD2-CG1 3.43Å; V251-I255 HydrophobicContact CG1-CD1 3.9Å; V251-I255 WeakPolarHBondContact O-CD1 3.35Å; V251-I255 VanDerWaalsContact O-CG1 3.29Å; V251-I255 WeakPolarHBondContact O-CG1 3.48Å; V251-I255 PolarHBondContact O-N 2.84Å; V251-I255 VanDerWaalsContact O-N 3.08Å; R252-I255 PolarHBondContact O-N 2.98Å; E253-I255 VanDerWaalsContact C-N 3.32Å; E253-I255 PolarHBondContact O-N 3.08Å; I255-R259 WeakPolarHBondContact O-CB 3.15Å; I255-R259 VanDerWaalsContact O-CG 3.23Å; I255-R259 WeakPolarHBondContact O-CG 3.38Å; I255-R259 PolarHBondContact O-N 3.4Å; I255-R259 VanDerWaalsContact O-N 3.12Å
256	L	94.8	Very high	93.8	Very high	95 Å²	95	86.5 Å²	86.5	50%	0.497	43%	0.428	S	S	.	.	H	α-helix	trans	-68.1	-45.7	179.2	-71.3	171.4	0	0	0	111.8	R252 E253 R259 A260	R252-L256 HydrophobicContact CG-CD1 4.02Å; R252-L256 HydrophobicContact CG-CG 4.47Å; R252-L256 VanDerWaalsContact O-CG 3.3Å; R252-L256 WeakPolarHBondContact O-CG 3.36Å; R252-L256 PolarHBondContact O-N 3.28Å; E253-L256 PolarHBondContact O-N 2.95Å; L256-R259 PolarHBondContact O-N 2.92Å; L256-R259 VanDerWaalsContact O-N 3.16Å; L256-A260 PolarHBondContact O-N 3.14Å; L256-A260 VanDerWaalsContact O-N 3.16Å
257	K	94.1	Very high	93.6	Very high	102 Å²	102	86.6 Å²	86.6	44%	0.443	43%	0.43	S	S	.	.	H	α-helix	trans	-57.2	-51.8	175.3	178.5	173.8	173.1	-179.5	0	111	E227 E253 R259 A260 E261	E227-K257 IonicContact OE1-NZ 3.72Å; E227-K257 PolarHBondContact OE1-NZ 3.2Å; E227-K257 VanDerWaalsContact OE1-NZ 3.09Å; E253-K257 WeakPolarHBondContact O-CB 3.36Å; E253-K257 PolarHBondContact O-N 2.82Å; K257-R259 PolarHBondContact O-N 3.4Å; K257-R259 VanDerWaalsContact O-N 3.16Å; K257-A260 PolarHBondContact O-N 3.34Å; K257-E261 WeakPolarHBondContact CE-OE1 3.42Å; K257-E261 VanDerWaalsContact CG-OE1 3.25Å; K257-E261 WeakPolarHBondContact CG-OE1 3.44Å; K257-E261 WeakPolarHBondContact O-CG 3.49Å; K257-E261 PolarHBondContact O-N 3Å; K257-E261 VanDerWaalsContact O-N 3.14Å
258	K	91.6	Very high	93.4	Very high	89 Å²	89	92.4 Å²	92.4	39%	0.387	46%	0.458	S	S	.	.	H	α-helix	trans	-64.4	-19.5	177.9	-71.7	-173.5	177.6	-167.9	0	114.5	G120 I254 L262	G120-K258 PolarHBondContact O-NZ 3.02Å; I254-K258 HydrophobicContact CG2-CD 4.22Å; I254-K258 WeakPolarHBondContact O-CB 3.31Å; I254-K258 WeakPolarHBondContact O-CG 3.5Å; I254-K258 PolarHBondContact O-N 2.76Å; K258-L262 VanDerWaalsContact O-CD1 3.28Å; K258-L262 WeakPolarHBondContact O-CD1 3.44Å; K258-L262 VanDerWaalsContact O-CG 3.3Å; K258-L262 WeakPolarHBondContact O-CG 2.97Å
259	R	92.8	Very high	93.2	Very high	180 Å²	180	94.6 Å²	94.6	68%	0.679	46%	0.464	S	S	*	.	H	α-helix	trans	-87.1	-13.2	172.8	-76.5	174.5	179.9	-172.3	1	113.9	I255 L256 K257	I255-R259 WeakPolarHBondContact O-CB 3.15Å; I255-R259 VanDerWaalsContact O-CG 3.23Å; I255-R259 WeakPolarHBondContact O-CG 3.38Å; I255-R259 PolarHBondContact O-N 3.4Å; I255-R259 VanDerWaalsContact O-N 3.12Å; L256-R259 PolarHBondContact O-N 2.92Å; L256-R259 VanDerWaalsContact O-N 3.16Å; K257-R259 PolarHBondContact O-N 3.4Å; K257-R259 VanDerWaalsContact O-N 3.16Å
260	A	94.3	Very high	93	Very high	87 Å²	87	98.5 Å²	98.5	72%	0.719	47%	0.471	S	S	*	.	H	α-helix	trans	-98.4	-10.4	173.5	0	0	0	0	0	112.6	L256 K257	L256-A260 PolarHBondContact O-N 3.14Å; L256-A260 VanDerWaalsContact O-N 3.16Å; K257-A260 PolarHBondContact O-N 3.34Å
261	E	90.7	Very high	92.6	Very high	126 Å²	126	105.2 Å²	105.2	59%	0.589	50%	0.503	S	S	*	.			trans	-96.2	8.5	175.2	-67.5	168.5	170.4	0	0	112.6	K257	K257-E261 WeakPolarHBondContact CE-OE1 3.42Å; K257-E261 VanDerWaalsContact CG-OE1 3.25Å; K257-E261 WeakPolarHBondContact CG-OE1 3.44Å; K257-E261 WeakPolarHBondContact O-CG 3.49Å; K257-E261 PolarHBondContact O-N 3Å; K257-E261 VanDerWaalsContact O-N 3.14Å
262	L	75.8	Confident	92.3	Very high	204 Å²	204	113.5 Å²	113.5	100%	1.068	54%	0.542	S	S	*	.			trans	-125.9	0	-177.6	-72.7	175	0	0	0	111.6	K258	K258-L262 VanDerWaalsContact O-CD1 3.28Å; K258-L262 WeakPolarHBondContact O-CD1 3.44Å; K258-L262 VanDerWaalsContact O-CG 3.3Å; K258-L262 WeakPolarHBondContact O-CG 2.97Å

Retrieved 262 of 262 residues in 631 ms (Link to these results)

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