A0A093HHF5_STRCA Loading...

Oxidoreductase NAD-binding domain-containing protein 1

AlphaFold DB , UniProt , Accession A0A093HHF5, Species STRCA (Struthio camelus australis), Gene n/a, Length 316 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37	Very low	28.9	Very low	240 Å²	240	130.5 Å²	130.5	100%	1.182	82%	0.815	S	S	*	*				0	95	0	-71.6	-169.6	-109.5	0	0	106.7
2	A	28.7	Very low	29.2	Very low	90 Å²	90	131.8 Å²	131.8	74%	0.744	81%	0.809	S	S	*	*				68.2	100.6	100.4	0	0	0	0	0	111.7
3	C	26.5	Very low	29.5	Very low	134 Å²	134	131.2 Å²	131.2	91%	0.905	81%	0.809	S	S	*	*				93.9	152.1	107.6	-84.8	0	0	0	0	111.2
4	A	28.1	Very low	29.4	Very low	81 Å²	81	133.6 Å²	133.6	67%	0.669	81%	0.806	S	S	*	*			cis	173.8	145.8	-19.6	0	0	0	0	0	104.7
5	A	31.1	Very low	29.4	Very low	96 Å²	96	134.6 Å²	134.6	79%	0.793	80%	0.804	S	S	*	*			trans	-179.4	88.4	153.3	0	0	0	0	0	106.7
6	I	29.8	Very low	29.4	Very low	160 Å²	160	136.4 Å²	136.4	82%	0.821	81%	0.808	S	S	*	*				63.4	111.5	83.6	-56.3	176.8	0	0	0	113.2
7	S	29.2	Very low	29.4	Very low	108 Å²	108	141.3 Å²	141.3	76%	0.755	81%	0.809	S	S	*	*			trans	-90.7	159.1	167.1	62.8	0	0	0	0	111.4
8	V	28.1	Very low	29.2	Very low	147 Å²	147	142.9 Å²	142.9	89%	0.891	81%	0.814	S	S	*	*			trans	-160.8	136.9	145.3	-167.1	0	0	0	0	105.9
9	G	27.6	Very low	29.7	Very low	53 Å²	53	142.4 Å²	142.4	55%	0.546	82%	0.815	S	S	.	*			cis	155.9	134.3	-0.8	0	0	0	0	0	110.4
10	F	25.7	Very low	29.7	Very low	200 Å²	200	140.5 Å²	140.5	88%	0.877	81%	0.81	S	S	*	*			trans	66.5	144	145.9	-69.8	-87.9	0	0	0	120.5
11	T	26.6	Very low	29.9	Very low	127 Å²	127	145.7 Å²	145.7	78%	0.779	82%	0.817	S	S	*	*			cis	-168.1	154.9	35.5	-16.3	0	0	0	0	111.7
12	I	32.6	Very low	29.6	Very low	145 Å²	145	141.1 Å²	141.1	74%	0.744	80%	0.796	S	S	*	*			trans	-107.1	157	168.2	-50.1	169.2	0	0	0	108.4
13	P	32.6	Very low	30	Very low	125 Å²	125	146.5 Å²	146.5	81%	0.812	80%	0.802	S	S	*	*				-147.7	133.5	103.4	30.4	-10.4	0	0	0	113.8
14	Q	28.1	Very low	30.3	Very low	164 Å²	164	145.4 Å²	145.4	77%	0.766	79%	0.794	S	S	*	*				71.7	136.5	83.2	-85.9	-144.4	-1.4	0	0	119.9
15	L	29.2	Very low	30.3	Very low	149 Å²	149	145.8 Å²	145.8	78%	0.78	80%	0.797	S	S	*	*			trans	93.1	129.1	160.3	-70.4	152.6	0	0	0	116.7
16	L	28.9	Very low	30.2	Very low	164 Å²	164	150.7 Å²	150.7	86%	0.859	80%	0.803	S	S	*	*				-157.3	160.7	52.1	-108.8	141.2	0	0	0	113.8
17	R	30.3	Very low	30.1	Very low	219 Å²	219	147.9 Å²	147.9	83%	0.826	80%	0.797	S	S	*	*			trans	-58.5	151.8	174.2	-78	172	168.5	169.7	-3.8	113.6
18	D	26.1	Very low	30.1	Very low	170 Å²	170	146.8 Å²	146.8	91%	0.909	80%	0.795	S	S	*	*				-154	139.9	129.1	-98	-30.4	0	0	0	112.7
19	T	39	Very low	30.1	Very low	134 Å²	134	146.8 Å²	146.8	82%	0.822	79%	0.79	S	S	*	*			trans	-95.4	131.8	177.1	45.8	0	0	0	0	110.4
20	S	28.6	Very low	30.1	Very low	104 Å²	104	149.8 Å²	149.8	73%	0.727	80%	0.797	S	S	*	*			trans	-154.8	115.2	154.7	59.5	0	0	0	0	111.3
21	R	34.2	Very low	30.3	Very low	250 Å²	250	145.7 Å²	145.7	94%	0.943	79%	0.788	S	S	*	*			trans	-67.3	125.4	160.9	-73.8	177.5	174.9	178.5	-1.9	108.8
22	I	30.4	Very low	30.4	Very low	144 Å²	144	146.3 Å²	146.3	74%	0.738	79%	0.786	S	S	*	*			trans	-145.6	114.9	159	-59.1	-176.8	0	0	0	108.5
23	F	37.2	Very low	30.5	Very low	202 Å²	202	147.6 Å²	147.6	89%	0.886	78%	0.781	S	S	*	*			trans	-70.4	143.9	157.9	-83.2	-89.9	0	0	0	108.7
24	P	33.3	Very low	30.3	Very low	112 Å²	112	150.2 Å²	150.2	73%	0.727	78%	0.782	S	S	*	*				-140.4	124.3	120.2	22.6	-2.2	0	0	0	111.5
25	A	27.9	Very low	30.5	Very low	89 Å²	89	146 Å²	146	74%	0.736	77%	0.771	S	S	*	*				90.8	100.3	93.5	0	0	0	0	0	111.4	S27	A25-S27 PolarHBondContact O-N 3.08Å; A25-S27 VanDerWaalsContact O-N 3.08Å
26	H	29.3	Very low	30.5	Very low	199 Å²	199	143.8 Å²	143.8	92%	0.921	77%	0.774	S	S	*	*			trans	-54.7	108.9	161.7	-82.9	-69	0	0	0	109.2	A28	H26-A28 PolarHBondContact O-N 3.28Å
27	S	26.4	Very low	30.6	Very low	100 Å²	100	141.7 Å²	141.7	70%	0.699	76%	0.758	S	S	*	*			trans	-79.7	98.9	159.6	-173.2	0	0	0	0	107.2	A25 L29	A25-S27 PolarHBondContact O-N 3.08Å; A25-S27 VanDerWaalsContact O-N 3.08Å; S27-L29 VanDerWaalsContact C-N 3.27Å; S27-L29 PolarHBondContact O-N 3.04Å
28	A	30.5	Very low	30.6	Very low	86 Å²	86	135.9 Å²	135.9	71%	0.711	75%	0.75	S	S	*	*			trans	-67.6	94.6	158.7	0	0	0	0	0	106.8	H26 V30	H26-A28 PolarHBondContact O-N 3.28Å; A28-V30 PolarHBondContact O-N 3Å
29	L	26.8	Very low	30.7	Very low	147 Å²	147	136.9 Å²	136.9	77%	0.77	74%	0.742	S	S	*	*			trans	-68.6	91.6	166.4	-108.6	131.7	0	0	0	107.3	S27 V31	S27-L29 VanDerWaalsContact C-N 3.27Å; S27-L29 PolarHBondContact O-N 3.04Å; L29-V31 PolarHBondContact O-N 2.92Å
30	V	28.6	Very low	30.4	Very low	116 Å²	116	135.8 Å²	135.8	70%	0.703	74%	0.739	S	S	*	*			trans	-61.2	102.2	162.6	174	0	0	0	0	106.2	A28 L32	A28-V30 PolarHBondContact O-N 3Å; V30-L32 PolarHBondContact O-N 3.3Å
31	V	30.5	Very low	30.6	Very low	113 Å²	113	137.1 Å²	137.1	69%	0.685	74%	0.743	S	S	*	*			trans	-66.8	102.1	169.5	176.3	0	0	0	0	106.8	L29 R33	L29-V31 PolarHBondContact O-N 2.92Å; V31-R33 VanDerWaalsContact C-N 3.28Å; V31-R33 HydrophobicContact CG1-CG 4.49Å; V31-R33 PolarHBondContact O-N 3.4Å
32	L	26.8	Very low	30.7	Very low	141 Å²	141	133.2 Å²	133.2	74%	0.738	74%	0.738	S	S	*	*			trans	-64.1	91.6	166.8	-105.6	119.1	0	0	0	108.1	V30 H34	V30-L32 PolarHBondContact O-N 3.3Å; L32-H34 PolarHBondContact O-N 2.9Å
33	R	35.1	Very low	30.8	Very low	171 Å²	171	134.3 Å²	134.3	65%	0.645	75%	0.745	S	S	*	*			trans	-61.9	116.9	162.9	-70.8	-168.2	175	-151.1	-1.2	106.9	V31 S35 D171	V31-R33 VanDerWaalsContact C-N 3.28Å; V31-R33 HydrophobicContact CG1-CG 4.49Å; V31-R33 PolarHBondContact O-N 3.4Å; R33-S35 PolarHBondContact O-N 2.91Å; R33-D171 IonicContact NH2-OD1 2.65Å; R33-D171 IonicContact NH2-OD2 3.92Å; R33-D171 PolarHBondContact NH2-OD2 2.95Å
34	H	28.3	Very low	30.8	Very low	181 Å²	181	128 Å²	128	84%	0.838	74%	0.737	S	S	*	*			trans	-64	98.8	173.3	-78.8	20.1	0	0	0	108.5	L32 A36	L32-H34 PolarHBondContact O-N 2.9Å; H34-A36 PolarHBondContact O-N 3.02Å
35	S	32.9	Very low	30.8	Very low	75 Å²	75	128.9 Å²	128.9	52%	0.524	74%	0.741	S	S	.	*			trans	-74.5	107.5	162.6	43.5	0	0	0	0	107.4	R33 F37	R33-S35 PolarHBondContact O-N 2.91Å; S35-F37 WeakPolarHBondContact O-CD2 3.46Å; S35-F37 PolarHBondContact O-N 2.9Å; S35-F37 WeakPolarHBondContact OG-CE2 3.38Å
36	A	29.8	Very low	31.5	Very low	102 Å²	102	131.9 Å²	131.9	84%	0.843	75%	0.75	S	S	*	*			trans	-66.3	101.2	167.6	0	0	0	0	0	108	H34 C38	H34-A36 PolarHBondContact O-N 3.02Å; A36-C38 PolarHBondContact O-N 3.44Å; A36-C38 VanDerWaalsContact O-N 3.14Å
37	F	30.2	Very low	31.9	Very low	121 Å²	121	131.2 Å²	131.2	53%	0.531	74%	0.744	S	S	.	*			trans	-69.5	105.2	175.6	-85.6	-91.2	0	0	0	109.8	S35 Y39	S35-F37 WeakPolarHBondContact O-CD2 3.46Å; S35-F37 PolarHBondContact O-N 2.9Å; S35-F37 WeakPolarHBondContact OG-CE2 3.38Å; F37-Y39 HydrophobicContact CB-CD2 4.15Å; F37-Y39 HydrophobicContact CB-CE2 3.87Å; F37-Y39 HydrophobicContact CD1-CE2 4.23Å; F37-Y39 HydrophobicContact CG-CE2 4.36Å; F37-Y39 PolarHBondContact O-N 2.99Å
38	C	30.5	Very low	32.4	Very low	97 Å²	97	130.8 Å²	130.8	66%	0.655	74%	0.741	S	S	*	*			trans	-85.2	103.3	171.1	-144.1	0	0	0	0	109	A36	A36-C38 PolarHBondContact O-N 3.44Å; A36-C38 VanDerWaalsContact O-N 3.14Å
39	Y	27.7	Very low	32.9	Very low	190 Å²	190	135 Å²	135	75%	0.745	75%	0.752	S	S	*	*			trans	-92.4	120.1	169.5	-77.1	-87.3	0	0	0	109.3	F37	F37-Y39 HydrophobicContact CB-CD2 4.15Å; F37-Y39 HydrophobicContact CB-CE2 3.87Å; F37-Y39 HydrophobicContact CD1-CE2 4.23Å; F37-Y39 HydrophobicContact CG-CE2 4.36Å; F37-Y39 PolarHBondContact O-N 2.99Å
40	C	32.7	Very low	33.9	Very low	111 Å²	111	134.3 Å²	134.3	75%	0.75	75%	0.747	S	S	*	*			trans	-119.1	103.4	163.9	-73	0	0	0	0	108.6
41	T	32.9	Very low	35.5	Very low	133 Å²	133	136.5 Å²	136.5	82%	0.816	75%	0.748	S	S	*	*			trans	-76.1	128.5	166.1	44.7	0	0	0	0	109.6
42	M	36	Very low	37.6	Very low	168 Å²	168	135.3 Å²	135.3	83%	0.828	74%	0.737	S	S	*	*			trans	-76.3	125	173.3	-68.6	-85.7	87.7	0	0	110
43	N	32.6	Very low	40.4	Very low	166 Å²	166	130.8 Å²	130.8	89%	0.888	71%	0.713	S	S	*	*			trans	-135.5	124.2	153	-95.4	-15	0	0	0	108.5
44	G	38.7	Very low	43	Very low	70 Å²	70	123.8 Å²	123.8	72%	0.722	69%	0.687	S	S	*	*			trans	-79.1	149.5	-175.8	0	0	0	0	0	113.2
45	T	31.7	Very low	45.9	Very low	131 Å²	131	117.9 Å²	117.9	80%	0.804	66%	0.662	S	S	*	*			trans	-167.1	137.1	140.8	9.7	0	0	0	0	108.5	K47	T45-K47 PolarHBondContact O-N 3.1Å
46	T	44.3	Very low	48.7	Very low	151 Å²	151	120.6 Å²	120.6	93%	0.926	67%	0.666	S	S	*	*			trans	-50.1	118.8	-174.9	-29.7	0	0	0	0	111.8
47	K	36.1	Very low	51.4	Low	185 Å²	185	119.6 Å²	119.6	80%	0.804	64%	0.641	S	S	*	*			trans	-137.1	137.9	173.8	-79.5	-175.7	177.2	178.1	0	110.4	T45	T45-K47 PolarHBondContact O-N 3.1Å
48	S	38.3	Very low	54.4	Low	92 Å²	92	114.3 Å²	114.3	64%	0.643	62%	0.618	S	S	*	*			trans	-37.2	141	170.5	48.5	0	0	0	0	112.9	I50	S48-I50 PolarHBondContact O-N 3.38Å
49	N	41.3	Very low	57.3	Low	173 Å²	173	112.7 Å²	112.7	93%	0.925	61%	0.612	S	S	*	*			trans	-64.2	57.2	175.2	-86.3	-26.1	0	0	0	113	K51	N49-K51 PolarHBondContact O-N 3.26Å
50	I	47.3	Very low	60.4	Low	133 Å²	133	111.3 Å²	111.3	68%	0.682	62%	0.617	S	S	*	*			trans	-72.6	108.3	164.7	-61.6	174.3	0	0	0	105.1	S48 I52	S48-I50 PolarHBondContact O-N 3.38Å; I50-I52 PolarHBondContact O-N 2.94Å
51	K	61.7	Low	63.4	Low	163 Å²	163	108.6 Å²	108.6	71%	0.709	60%	0.595	S	S	*	*			trans	-62.6	107.8	170.1	-74.3	-172.7	177.6	-171.3	0	107.1	N49 D53	N49-K51 PolarHBondContact O-N 3.26Å; K51-D53 PolarHBondContact O-N 3.39Å
52	I	74.3	Confident	66.4	Low	88 Å²	88	107 Å²	107	45%	0.451	58%	0.577	S	S	.	*			trans	-52.9	134.7	174.9	-57.8	170.6	0	0	0	108.6	I50 E56 R57	I50-I52 PolarHBondContact O-N 2.94Å; I52-E56 HydrophobicContact CG2-CB 3.59Å; I52-R57 HydrophobicContact CG2-CB 4.08Å; I52-R57 PolarHBondContact O-NH2 3.25Å
53	D	85.9	Confident	69.3	Low	45 Å²	45	101.4 Å²	101.4	24%	0.241	55%	0.547	C	S	.	.			trans	-63.8	156.2	179.5	-179	69.1	0	0	0	111.6	K51 L55 E56 R57	K51-D53 PolarHBondContact O-N 3.39Å; D53-L55 VanDerWaalsContact C-N 3.33Å; D53-L55 PolarHBondContact O-N 2.87Å; D53-L55 WeakPolarHBondContact OD2-CB 3.48Å; D53-L55 PolarHBondContact OD2-N 3.25Å; D53-E56 HydrophobicContact CB-CB 4.42Å; D53-E56 HydrophobicContact CB-CG 4.2Å; D53-E56 PolarHBondContact O-N 3.15Å; D53-R57 WeakPolarHBondContact O-CB 3.45Å; D53-R57 PolarHBondContact O-N 3.38Å
54	H	88.9	Confident	72.3	Confident	24 Å²	24	95.1 Å²	95.1	11%	0.111	51%	0.512	C	S	.	.	H	α-helix	trans	-56.9	-45.4	178.4	170.1	59.3	0	0	0	112	E56 R57 T58 W101 D103 G114	H54-E56 PolarHBondContact O-N 2.99Å; H54-R57 PolarHBondContact O-N 3.18Å; H54-T58 PolarHBondContact CE1-OG1 2.94Å; H54-T58 PolarHBondContact O-N 2.94Å; H54-T58 VanDerWaalsContact O-N 3.08Å; H54-T58 PolarHBondContact O-OG1 2.86Å; H54-W101 AromaticContact CE1-CE3 3.89Å; H54-W101 AromaticContact CE1-CH2 3.96Å; H54-W101 AromaticContact CE1-CZ3 3.85Å; H54-W101 AromaticContact NE2-CE3 3.77Å; H54-W101 AromaticContact NE2-CH2 3.81Å; H54-W101 AromaticContact NE2-CZ3 3.46Å; H54-W101 WeakPolarHBondContact NE2-CZ3 3.35Å; H54-D103 IonicContact CD2-OD1 3.61Å; H54-D103 PolarHBondContact CD2-OD1 2.94Å; H54-D103 IonicContact CE1-OD1 3.21Å; H54-D103 IonicContact NE2-OD1 2.7Å; H54-D103 PolarHBondContact NE2-OD1 2.77Å; H54-G114 VanDerWaalsContact CE1-CA 3.45Å; H54-G114 WeakPolarHBondContact CE1-CA 3.36Å; H54-G114 WeakPolarHBondContact NE2-CA 3.45Å
55	L	90.7	Very high	74.9	Confident	57 Å²	57	101.1 Å²	101.1	30%	0.298	52%	0.522	S	S	.	.	H	α-helix	trans	-64.7	-42.1	-178.6	-64.5	179.8	0	0	0	111.6	D53 A59 V112	D53-L55 VanDerWaalsContact C-N 3.33Å; D53-L55 PolarHBondContact O-N 2.87Å; D53-L55 WeakPolarHBondContact OD2-CB 3.48Å; D53-L55 PolarHBondContact OD2-N 3.25Å; L55-A59 WeakPolarHBondContact O-CA 3.48Å; L55-A59 PolarHBondContact O-N 3.29Å; L55-V112 HydrophobicContact CD1-CB 4.29Å; L55-V112 HydrophobicContact CD1-CG2 3.96Å; L55-V112 HydrophobicContact CD2-CB 4.46Å; L55-V112 HydrophobicContact CD2-CG1 4.26Å; L55-V112 HydrophobicContact CG-CB 4.19Å; L55-V112 HydrophobicContact CG-CG2 4.41Å
56	E	90.6	Very high	78	Confident	132 Å²	132	98.1 Å²	98.1	62%	0.617	50%	0.499	S	S	*	.	H	α-helix	trans	-64.6	-44.9	176.6	-68.2	-179.7	163.5	0	0	111.5	I52 D53 H54 T58 A59	I52-E56 HydrophobicContact CG2-CB 3.59Å; D53-E56 HydrophobicContact CB-CB 4.42Å; D53-E56 HydrophobicContact CB-CG 4.2Å; D53-E56 PolarHBondContact O-N 3.15Å; H54-E56 PolarHBondContact O-N 2.99Å; E56-T58 VanDerWaalsContact C-N 3.27Å; E56-T58 PolarHBondContact O-N 3.41Å; E56-A59 WeakPolarHBondContact O-CB 3.35Å; E56-A59 PolarHBondContact O-N 2.97Å
57	R	88	Confident	80.5	Confident	81 Å²	81	95 Å²	95	31%	0.306	48%	0.476	S	S	.	.	H	α-helix	trans	-65.3	-33.7	-176.8	-173.4	170.6	-61	144.4	6.4	112.8	I52 D53 H54 W316	I52-R57 HydrophobicContact CG2-CB 4.08Å; I52-R57 PolarHBondContact O-NH2 3.25Å; D53-R57 WeakPolarHBondContact O-CB 3.45Å; D53-R57 PolarHBondContact O-N 3.38Å; H54-R57 PolarHBondContact O-N 3.18Å; R57-W316 VanDerWaalsContact CD-NE1 3.31Å; R57-W316 HydrophobicContact CG-CZ2 4.4Å; R57-W316 VanDerWaalsContact NH1-CD1 3.3Å
58	T	91.5	Very high	83.5	Confident	11 Å²	11	86.4 Å²	86.4	7%	0.067	44%	0.439	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110	20.4	-175.6	57.1	0	0	0	0	111.9	H54 E56 N60 N61 R63 W101	H54-T58 PolarHBondContact CE1-OG1 2.94Å; H54-T58 PolarHBondContact O-N 2.94Å; H54-T58 VanDerWaalsContact O-N 3.08Å; H54-T58 PolarHBondContact O-OG1 2.86Å; E56-T58 VanDerWaalsContact C-N 3.27Å; E56-T58 PolarHBondContact O-N 3.41Å; T58-N60 PolarHBondContact O-N 2.84Å; T58-N60 VanDerWaalsContact O-N 3.13Å; T58-N61 VanDerWaalsContact CA-OD1 3.25Å; T58-N61 WeakPolarHBondContact CA-OD1 3.48Å; T58-N61 VanDerWaalsContact CB-OD1 3.29Å; T58-N61 WeakPolarHBondContact CB-OD1 3.38Å; T58-N61 WeakPolarHBondContact O-CB 3.34Å; T58-N61 PolarHBondContact O-N 2.89Å; T58-N61 PolarHBondContact O-OD1 2.5Å; T58-R63 PolarHBondContact O-NH1 2.97Å; T58-R63 PolarHBondContact OG1-NH2 3.44Å; T58-W101 HydrophobicContact CG2-CZ2 4.24Å
59	A	92.8	Very high	86.3	Confident	62 Å²	62	87.2 Å²	87.2	51%	0.512	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-30.4	-175.3	0	0	0	0	0	113.7	L55 E56	L55-A59 WeakPolarHBondContact O-CA 3.48Å; L55-A59 PolarHBondContact O-N 3.29Å; E56-A59 WeakPolarHBondContact O-CB 3.35Å; E56-A59 PolarHBondContact O-N 2.97Å
60	N	92.9	Very high	89.1	Confident	161 Å²	161	79 Å²	79	86%	0.861	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	-1.6	179.6	-62	-31.2	0	0	0	113.7	T58	T58-N60 PolarHBondContact O-N 2.84Å; T58-N60 VanDerWaalsContact O-N 3.13Å
61	N	94.1	Very high	91.5	Very high	55 Å²	55	76.8 Å²	76.8	29%	0.294	37%	0.374	S	S	.	.	S	Bend	trans	-81	152.1	176.1	-69.4	101.9	0	0	0	111	T58 R63 W101 D162	T58-N61 VanDerWaalsContact CA-OD1 3.25Å; T58-N61 WeakPolarHBondContact CA-OD1 3.48Å; T58-N61 VanDerWaalsContact CB-OD1 3.29Å; T58-N61 WeakPolarHBondContact CB-OD1 3.38Å; T58-N61 WeakPolarHBondContact O-CB 3.34Å; T58-N61 PolarHBondContact O-N 2.89Å; T58-N61 PolarHBondContact O-OD1 2.5Å; N61-R63 PolarHBondContact O-N 3.29Å; N61-W101 HydrophobicContact CB-CZ2 4.18Å; N61-D162 VanDerWaalsContact CA-OD2 3.25Å; N61-D162 WeakPolarHBondContact CA-OD2 3.38Å; N61-D162 WeakPolarHBondContact CB-OD2 3.48Å; N61-D162 PolarHBondContact ND2-OD2 2.79Å
62	F	96	Very high	93.3	Very high	99 Å²	99	69 Å²	69	43%	0.434	34%	0.341	S	S	.	.			trans	-52.8	138.6	169.2	173	-98.6	0	0	0	111.3	Q64 G160 G161 D162	F62-Q64 HydrophobicContact CE1-CG 3.67Å; F62-Q64 HydrophobicContact CZ-CG 3.71Å; F62-G160 CarbonylContact O-C 2.93Å; F62-G160 WeakPolarHBondContact O-CA 3.49Å; F62-G161 PolarHBondContact O-N 2.89Å; F62-D162 WeakPolarHBondContact CB-OD1 3.26Å; F62-D162 PolarHBondContact N-OD1 2.92Å; F62-D162 PolarHBondContact N-OD2 3.1Å
63	R	97	Very high	94.4	Very high	51 Å²	51	67.8 Å²	67.8	19%	0.192	34%	0.339	C	S	.	.	B	Isolated β-bridge	trans	-139.2	136.7	167.9	-76.7	-175.3	172.8	77.9	2.7	109.2	T58 N61 W101 D103 V159	T58-R63 PolarHBondContact O-NH1 2.97Å; T58-R63 PolarHBondContact OG1-NH2 3.44Å; N61-R63 PolarHBondContact O-N 3.29Å; R63-W101 HydrophobicContact CG-CH2 4.01Å; R63-D103 IonicContact CZ-OD2 3.92Å; R63-D103 IonicContact NE-OD1 2.67Å; R63-D103 IonicContact NE-OD2 3.15Å; R63-D103 PolarHBondContact NE-OD2 2.82Å; R63-D103 IonicContact NH2-OD1 2.73Å; R63-D103 PolarHBondContact NH2-OD1 3.03Å; R63-V159 WeakPolarHBondContact CA-O 3.49Å
64	Q	96	Very high	95.1	Very high	33 Å²	33	66.3 Å²	66.3	15%	0.154	33%	0.334	C	S	.	.			trans	-68.7	146.6	168	-65.1	-177.6	8.9	0	0	109.8	F62 M66 T95 R158 V159	F62-Q64 HydrophobicContact CE1-CG 3.67Å; F62-Q64 HydrophobicContact CZ-CG 3.71Å; Q64-M66 VanDerWaalsContact C-N 3.26Å; Q64-T95 PolarHBondContact NE2-O 3.38Å; Q64-R158 WeakPolarHBondContact O-CD 3.37Å; Q64-R158 VanDerWaalsContact O-CG 3.25Å; Q64-R158 WeakPolarHBondContact O-CG 3.25Å; Q64-V159 HydrophobicContact CG-CB 4.11Å; Q64-V159 PolarHBondContact N-O 3.29Å
65	E	94.4	Very high	95.5	Very high	197 Å²	197	67.7 Å²	67.7	92%	0.921	34%	0.342	S	S	*	.	S	Bend	trans	-70.1	-29.8	172.9	-64	-176	168.8	0	0	111.7
66	M	95.8	Very high	95.9	Very high	67 Å²	67	69.1 Å²	69.1	33%	0.33	35%	0.353	S	S	.	.			trans	-67.6	131.7	-177.4	-175.3	-179	-67.4	0	0	112	Q64 N91 D93 F94	Q64-M66 VanDerWaalsContact C-N 3.26Å; M66-N91 PolarHBondContact SD-ND2 2.86Å; M66-D93 HydrophobicContact CE-CB 4Å; M66-F94 HydrophobicContact SD-CD2 4.4Å
67	I	97.3	Very high	96.2	Very high	86 Å²	86	68.2 Å²	68.2	44%	0.441	35%	0.353	S	S	.	.			trans	-113.7	128.5	167	-56.5	-178.5	0	0	0	107.6	A156 L157 R158	I67-A156 HydrophobicContact CG2-CB 3.77Å; I67-L157 WeakPolarHBondContact CA-O 3.09Å; I67-R158 HydrophobicContact CG1-CB 4.19Å; I67-R158 HydrophobicContact CG1-CG 4.49Å
68	S	98.2	Very high	96.5	Very high	4 Å²	4	66.7 Å²	66.7	3%	0.028	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	139.3	174.9	-177.9	0	0	0	0	111.1	V89 N91 F94 A156 L157	S68-V89 VanDerWaalsContact OG-CG1 3.31Å; S68-V89 WeakPolarHBondContact OG-CG1 3.36Å; S68-N91 WeakPolarHBondContact OG-CB 3.43Å; S68-N91 PolarHBondContact OG-N 2.58Å; S68-F94 VanDerWaalsContact CB-CD2 3.47Å; S68-A156 CarbonylContact O-C 3.52Å; S68-A156 WeakPolarHBondContact O-CA 3.12Å; S68-L157 PolarHBondContact N-O 2.98Å; S68-L157 PolarHBondContact O-N 3.38Å
69	Q	98.5	Very high	96.7	Very high	109 Å²	109	66.8 Å²	66.8	51%	0.509	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	147.5	164.9	-62.2	-60.1	-32.5	0	0	110.3	T90 V155	Q69-T90 WeakPolarHBondContact O-CB 3.48Å; Q69-T90 PolarHBondContact O-N 2.96Å; Q69-T90 PolarHBondContact O-OG1 3.19Å; Q69-V155 PolarHBondContact OE1-O 3.43Å
70	A	98.7	Very high	96.8	Very high	1 Å²	1	71.6 Å²	71.6	1%	0.008	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	155.6	173.9	0	0	0	0	0	111.3	L87 A88 V89 V155 L157	A70-L87 HydrophobicContact CB-CB 4.33Å; A70-A88 CarbonylContact C-O 3.56Å; A70-A88 WeakPolarHBondContact CA-O 3.31Å; A70-A88 WeakPolarHBondContact CB-O 3.12Å; A70-V89 HydrophobicContact CB-CG2 4.42Å; A70-V155 HydrophobicContact CB-CG2 4.12Å; A70-V155 PolarHBondContact N-O 2.9Å; A70-V155 PolarHBondContact O-N 3.47Å; A70-V155 VanDerWaalsContact O-O 3.04Å; A70-L157 HydrophobicContact CB-CD1 3.75Å; A70-L157 HydrophobicContact CB-CG 4.05Å
71	K	98.7	Very high	97	Very high	87 Å²	87	65.9 Å²	65.9	38%	0.378	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	140.4	175.8	-63.5	-164.7	177.7	-150.1	0	111.4	C73 L87 A88 S153 E154	K71-C73 PolarHBondContact O-N 2.9Å; K71-C73 VanDerWaalsContact O-N 3.14Å; K71-L87 CarbonylContact O-C 3.51Å; K71-L87 WeakPolarHBondContact O-CA 3.5Å; K71-A88 PolarHBondContact N-O 3.13Å; K71-A88 PolarHBondContact O-N 3.11Å; K71-S153 WeakPolarHBondContact CA-O 3.33Å; K71-E154 HydrophobicContact CD-CG 4.47Å; K71-E154 WeakPolarHBondContact CE-OE1 3.03Å; K71-E154 HydrophobicContact CG-CG 4.32Å; K71-E154 IonicContact NZ-OE1 3.06Å; K71-E154 PolarHBondContact NZ-OE1 2.98Å
72	V	98.8	Very high	97.2	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	106.5	174.2	-178.5	0	0	0	0	109.3	I75 L85 L87 D152 S153	V72-I75 HydrophobicContact CG1-CD1 3.86Å; V72-I75 HydrophobicContact CG1-CG1 3.58Å; V72-L85 HydrophobicContact CG1-CD2 4.39Å; V72-L87 HydrophobicContact CB-CD2 4.42Å; V72-L87 HydrophobicContact CG2-CD2 3.72Å; V72-D152 PolarHBondContact O-N 2.73Å; V72-S153 PolarHBondContact N-O 2.85Å
73	C	98.7	Very high	97.3	Very high	61 Å²	61	60.1 Å²	60.1	41%	0.412	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	-3.6	-179.6	65.7	0	0	0	0	113.2	K71 R86 A88	K71-C73 PolarHBondContact O-N 2.9Å; K71-C73 VanDerWaalsContact O-N 3.14Å; C73-R86 PolarHBondContact N-O 2.83Å; C73-R86 PolarHBondContact SG-O 2.97Å; C73-R86 VanDerWaalsContact SG-O 3.39Å; C73-A88 HydrophobicContact CB-CB 4.32Å
74	G	98.6	Very high	97.4	Very high	14 Å²	14	59.6 Å²	59.6	14%	0.144	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.3	142.2	175.3	0	0	0	0	0	112.4	L85 R86	G74-L85 CarbonylContact O-C 3.5Å; G74-L85 WeakPolarHBondContact O-CA 3.39Å; G74-R86 PolarHBondContact N-O 3.23Å; G74-R86 PolarHBondContact O-N 3.32Å
75	I	98.6	Very high	97.5	Very high	54 Å²	54	58 Å²	58	28%	0.277	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	131.8	175.7	-55.1	-179.8	0	0	0	108.1	V72 K83 R84 L85 L151	V72-I75 HydrophobicContact CG1-CD1 3.86Å; V72-I75 HydrophobicContact CG1-CG1 3.58Å; I75-K83 HydrophobicContact CG2-CD 4.35Å; I75-R84 WeakPolarHBondContact CA-O 3.32Å; I75-L85 HydrophobicContact CB-CD2 4.5Å; I75-L85 HydrophobicContact CD1-CD2 4.41Å; I75-L85 HydrophobicContact CG1-CD2 3.89Å; I75-L85 HydrophobicContact CG2-CD2 4.26Å; I75-L151 HydrophobicContact CG1-CD2 4.39Å
76	T	97.9	Very high	97.7	Very high	87 Å²	87	53.5 Å²	53.5	53%	0.534	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	144.4	175.6	-56.1	0	0	0	0	109.9	E78 K83 R84	T76-E78 PolarHBondContact O-N 3.09Å; T76-K83 CarbonylContact O-C 3.52Å; T76-K83 WeakPolarHBondContact O-CA 3.43Å; T76-R84 PolarHBondContact N-O 3.46Å; T76-R84 PolarHBondContact O-N 3.01Å
77	N	97.4	Very high	97.8	Very high	113 Å²	113	50.3 Å²	50.3	60%	0.604	26%	0.255	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.3	110.3	169.6	-64.2	-38.2	0	0	0	108.4	K83	N77-K83 WeakPolarHBondContact OD1-CG 3.07Å
78	E	95.5	Very high	97.9	Very high	48 Å²	48	47.9 Å²	47.9	22%	0.224	25%	0.248	C	C	.	.	S	Bend	trans	-78.9	-29.9	176.5	-169.4	69.4	-138.8	0	0	110.6	T76 V82 R84 L227 F228	T76-E78 PolarHBondContact O-N 3.09Å; E78-V82 HydrophobicContact CB-CB 4.5Å; E78-V82 HydrophobicContact CB-CG1 4.28Å; E78-V82 PolarHBondContact N-O 3.47Å; E78-R84 HydrophobicContact CB-CB 4.43Å; E78-R84 WeakPolarHBondContact OE2-CD 3.4Å; E78-R84 IonicContact OE2-NH1 3.6Å; E78-R84 PolarHBondContact OE2-NH1 3.03Å; E78-L227 HydrophobicContact CB-CD2 4.23Å; E78-L227 HydrophobicContact CG-CB 3.9Å; E78-L227 HydrophobicContact CG-CD2 3.76Å; E78-L227 HydrophobicContact CG-CG 4.3Å; E78-F228 VanDerWaalsContact CD-CD1 3.5Å; E78-F228 HydrophobicContact CG-CD1 4.17Å; E78-F228 HydrophobicContact CG-CE1 4.02Å; E78-F228 WeakPolarHBondContact OE1-CA 3.21Å; E78-F228 WeakPolarHBondContact OE1-CD1 3.18Å; E78-F228 PolarHBondContact OE1-N 2.74Å
79	S	95.2	Very high	97.9	Very high	13 Å²	13	48.5 Å²	48.5	9%	0.091	25%	0.251	C	S	.	.	S	Bend	trans	-147.2	-178.9	163.7	78.3	0	0	0	0	110.1	T81 V82 N224	S79-T81 PolarHBondContact O-N 2.98Å; S79-T81 PolarHBondContact OG-N 3.32Å; S79-T81 VanDerWaalsContact OG-N 3.12Å; S79-T81 PolarHBondContact OG-OG1 3.33Å; S79-V82 PolarHBondContact N-O 2.89Å; S79-V82 PolarHBondContact O-N 3.13Å; S79-V82 PolarHBondContact OG-N 3.48Å; S79-V82 VanDerWaalsContact OG-N 3.11Å; S79-N224 WeakPolarHBondContact CB-O 3.47Å
80	E	94.3	Very high	97.7	Very high	163 Å²	163	48 Å²	48	76%	0.762	26%	0.255	S	S	*	.	S	Bend	trans	-57.7	-28.8	171.4	-67.4	179.3	-175.9	0	0	112.7
81	T	96.6	Very high	97.5	Very high	41 Å²	41	50.4 Å²	50.4	25%	0.252	27%	0.268	S	S	.	.	S	Bend	trans	-108.3	-7.3	-175.1	71	0	0	0	0	113.7	S79 K135 R136 H146 E225	S79-T81 PolarHBondContact O-N 2.98Å; S79-T81 PolarHBondContact OG-N 3.32Å; S79-T81 VanDerWaalsContact OG-N 3.12Å; S79-T81 PolarHBondContact OG-OG1 3.33Å; T81-K135 CarbonylContact O-C 3.52Å; T81-K135 WeakPolarHBondContact O-CA 3.43Å; T81-K135 WeakPolarHBondContact OG1-CE 3.4Å; T81-R136 PolarHBondContact O-N 2.91Å; T81-H146 PolarHBondContact O-CE1 2.94Å; T81-E225 WeakPolarHBondContact CG2-OE1 3.11Å; T81-E225 VanDerWaalsContact OG1-CD 3.31Å; T81-E225 PolarHBondContact OG1-OE1 2.67Å; T81-E225 PolarHBondContact OG1-OE2 3.18Å; T81-E225 VanDerWaalsContact OG1-OE2 3.13Å
82	V	98.3	Very high	97.3	Very high	3 Å²	3	56 Å²	56	2%	0.018	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	125.5	-174.6	-178	0	0	0	0	111.3	E78 S79 A133 V134 K135 V183 L227	E78-V82 HydrophobicContact CB-CB 4.5Å; E78-V82 HydrophobicContact CB-CG1 4.28Å; E78-V82 PolarHBondContact N-O 3.47Å; S79-V82 PolarHBondContact N-O 2.89Å; S79-V82 PolarHBondContact O-N 3.13Å; S79-V82 PolarHBondContact OG-N 3.48Å; S79-V82 VanDerWaalsContact OG-N 3.11Å; V82-A133 HydrophobicContact CG1-CB 3.96Å; V82-V134 WeakPolarHBondContact CA-O 3.42Å; V82-K135 HydrophobicContact CG2-CB 4.06Å; V82-K135 HydrophobicContact CG2-CG 4.21Å; V82-V183 HydrophobicContact CG2-CG1 4.05Å; V82-L227 HydrophobicContact CB-CD1 4.37Å; V82-L227 HydrophobicContact CB-CD2 3.84Å; V82-L227 HydrophobicContact CG1-CD1 3.89Å; V82-L227 HydrophobicContact CG1-CD2 4.12Å; V82-L227 HydrophobicContact CG2-CD1 4.14Å; V82-L227 HydrophobicContact CG2-CD2 3.86Å
83	K	98.5	Very high	97.1	Very high	30 Å²	30	61.6 Å²	61.6	13%	0.13	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	134.2	171.1	-79.8	-171.8	-172.6	-174.7	0	110.3	I75 T76 N77 A133 V134 I145 H146	I75-K83 HydrophobicContact CG2-CD 4.35Å; T76-K83 CarbonylContact O-C 3.52Å; T76-K83 WeakPolarHBondContact O-CA 3.43Å; N77-K83 WeakPolarHBondContact OD1-CG 3.07Å; K83-A133 CarbonylContact O-C 3.57Å; K83-A133 WeakPolarHBondContact O-CA 3.35Å; K83-V134 PolarHBondContact N-O 2.98Å; K83-V134 PolarHBondContact O-N 2.64Å; K83-I145 HydrophobicContact CB-CG2 4.34Å; K83-I145 WeakPolarHBondContact CD-O 3.38Å; K83-I145 PolarHBondContact NZ-O 3.29Å; K83-I145 VanDerWaalsContact NZ-O 3.17Å; K83-H146 VanDerWaalsContact NZ-C 3.29Å; K83-H146 PolarHBondContact NZ-O 3.46Å
84	R	98.6	Very high	97.1	Very high	40 Å²	40	58.9 Å²	58.9	15%	0.151	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	130.9	169.8	-171.5	176.8	-176.6	168.7	-3.4	109.8	I75 T76 E78 E131 L132	I75-R84 WeakPolarHBondContact CA-O 3.32Å; T76-R84 PolarHBondContact N-O 3.46Å; T76-R84 PolarHBondContact O-N 3.01Å; E78-R84 HydrophobicContact CB-CB 4.43Å; E78-R84 WeakPolarHBondContact OE2-CD 3.4Å; E78-R84 IonicContact OE2-NH1 3.6Å; E78-R84 PolarHBondContact OE2-NH1 3.03Å; R84-E131 IonicContact CZ-OE2 2.72Å; R84-E131 IonicContact NE-OE2 4Å; R84-E131 PolarHBondContact NE-OE2 2.84Å; R84-E131 IonicContact NH2-OE2 2.97Å; R84-E131 PolarHBondContact NH2-OE2 2.82Å; R84-L132 CarbonylContact C-O 3.59Å; R84-L132 WeakPolarHBondContact CA-O 3.4Å
85	L	98.9	Very high	97.1	Very high	0 Å²	0	62 Å²	62	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	138.1	173.3	-57.6	-176.7	0	0	0	109.3	V72 G74 I75 L87 F104 E131 L132 I145	V72-L85 HydrophobicContact CG1-CD2 4.39Å; G74-L85 CarbonylContact O-C 3.5Å; G74-L85 WeakPolarHBondContact O-CA 3.39Å; I75-L85 HydrophobicContact CB-CD2 4.5Å; I75-L85 HydrophobicContact CD1-CD2 4.41Å; I75-L85 HydrophobicContact CG1-CD2 3.89Å; I75-L85 HydrophobicContact CG2-CD2 4.26Å; L85-L87 HydrophobicContact CB-CD2 4.22Å; L85-L87 HydrophobicContact CB-CG 4.42Å; L85-F104 HydrophobicContact CD1-CZ 4.29Å; L85-E131 VanDerWaalsContact O-CA 3.24Å; L85-E131 WeakPolarHBondContact O-CA 3.46Å; L85-E131 WeakPolarHBondContact O-CB 3.26Å; L85-L132 PolarHBondContact N-O 3.21Å; L85-L132 PolarHBondContact O-N 3.38Å; L85-L132 VanDerWaalsContact O-N 3.09Å; L85-I145 HydrophobicContact CD1-CD1 3.88Å; L85-I145 HydrophobicContact CD1-CG1 3.92Å; L85-I145 HydrophobicContact CD1-CG2 3.91Å; L85-I145 HydrophobicContact CD2-CG2 4.2Å; L85-I145 HydrophobicContact CG-CG2 4.19Å
86	R	98.8	Very high	97.1	Very high	103 Å²	103	60 Å²	60	39%	0.389	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	126.5	163.2	-56.1	-173	67.3	161.5	-1.5	107.9	C73 G74 I129 E131	C73-R86 PolarHBondContact N-O 2.83Å; C73-R86 PolarHBondContact SG-O 2.97Å; C73-R86 VanDerWaalsContact SG-O 3.39Å; G74-R86 PolarHBondContact N-O 3.23Å; G74-R86 PolarHBondContact O-N 3.32Å; R86-I129 HydrophobicContact CB-CG2 4.31Å; R86-E131 HydrophobicContact CB-CG 4.49Å; R86-E131 WeakPolarHBondContact CD-OE1 3.47Å; R86-E131 HydrophobicContact CG-CG 4.09Å; R86-E131 WeakPolarHBondContact CG-OE1 3.44Å; R86-E131 IonicContact CZ-OE1 3.46Å; R86-E131 IonicContact NE-OE1 2.69Å; R86-E131 PolarHBondContact NE-OE1 3.43Å; R86-E131 IonicContact NH2-OE1 3.58Å
87	L	98.9	Very high	97.1	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	117.7	-173.7	-56.3	174.2	0	0	0	108.6	A70 K71 V72 L85 V89 F104 I129 L130 L132 V155 L157	A70-L87 HydrophobicContact CB-CB 4.33Å; K71-L87 CarbonylContact O-C 3.51Å; K71-L87 WeakPolarHBondContact O-CA 3.5Å; V72-L87 HydrophobicContact CB-CD2 4.42Å; V72-L87 HydrophobicContact CG2-CD2 3.72Å; L85-L87 HydrophobicContact CB-CD2 4.22Å; L85-L87 HydrophobicContact CB-CG 4.42Å; L87-V89 PolarHBondContact O-N 2.96Å; L87-F104 HydrophobicContact CD1-CE2 3.9Å; L87-F104 HydrophobicContact CD2-CE2 4.44Å; L87-I129 WeakPolarHBondContact O-CA 3.42Å; L87-L130 WeakPolarHBondContact CB-O 3.27Å; L87-L130 HydrophobicContact CD1-CD2 3.97Å; L87-L130 PolarHBondContact N-O 2.95Å; L87-L130 PolarHBondContact O-N 2.74Å; L87-L132 HydrophobicContact CD1-CD1 3.76Å; L87-L132 HydrophobicContact CD1-CG 4Å; L87-V155 HydrophobicContact CD2-CG2 4.36Å; L87-L157 HydrophobicContact CD1-CD1 4.04Å; L87-L157 HydrophobicContact CD1-CD2 4.15Å
88	A	98.8	Very high	97.2	Very high	35 Å²	35	54.2 Å²	54.2	29%	0.289	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	108.5	170.3	0	0	0	0	0	108.9	A70 K71 C73 I129	A70-A88 CarbonylContact C-O 3.56Å; A70-A88 WeakPolarHBondContact CA-O 3.31Å; A70-A88 WeakPolarHBondContact CB-O 3.12Å; K71-A88 PolarHBondContact N-O 3.13Å; K71-A88 PolarHBondContact O-N 3.11Å; C73-A88 HydrophobicContact CB-CB 4.32Å; A88-I129 HydrophobicContact CB-CD1 4.03Å
89	V	98.5	Very high	97.3	Very high	16 Å²	16	51.9 Å²	51.9	10%	0.097	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	127.9	-179	-174.9	0	0	0	0	109	S68 A70 L87 F94 L124 G128 L130 L157	S68-V89 VanDerWaalsContact OG-CG1 3.31Å; S68-V89 WeakPolarHBondContact OG-CG1 3.36Å; A70-V89 HydrophobicContact CB-CG2 4.42Å; L87-V89 PolarHBondContact O-N 2.96Å; V89-F94 HydrophobicContact CG1-CB 3.79Å; V89-F94 HydrophobicContact CG1-CD1 3.76Å; V89-F94 HydrophobicContact CG1-CD2 4.49Å; V89-F94 HydrophobicContact CG1-CE1 4.45Å; V89-F94 HydrophobicContact CG1-CG 3.78Å; V89-F94 HydrophobicContact CG2-CD1 4.47Å; V89-L124 HydrophobicContact CB-CD1 3.84Å; V89-L124 HydrophobicContact CG1-CD1 4.45Å; V89-L124 HydrophobicContact CG2-CD1 3.74Å; V89-G128 PolarHBondContact N-O 3.13Å; V89-L130 HydrophobicContact CG2-CB 3.93Å; V89-L157 HydrophobicContact CG2-CD1 4.12Å
90	T	94.1	Very high	97.5	Very high	98 Å²	98	51.5 Å²	51.5	60%	0.601	26%	0.257	S	S	*	.	S	Bend	trans	-80	-35.2	-172.1	-54.2	0	0	0	0	112.4	Q69	Q69-T90 WeakPolarHBondContact O-CB 3.48Å; Q69-T90 PolarHBondContact O-N 2.96Å; Q69-T90 PolarHBondContact O-OG1 3.19Å
91	N	94.9	Very high	97.7	Very high	53 Å²	53	44.1 Å²	44.1	28%	0.283	22%	0.222	S	C	.	.			trans	-84	122.5	-179.1	-169.9	-14.9	0	0	0	111	M66 S68 D93 F94	M66-N91 PolarHBondContact SD-ND2 2.86Å; S68-N91 WeakPolarHBondContact OG-CB 3.43Å; S68-N91 PolarHBondContact OG-N 2.58Å; N91-D93 VanDerWaalsContact C-N 3.3Å; N91-D93 PolarHBondContact O-N 3.23Å; N91-D93 PolarHBondContact OD1-N 3.32Å; N91-F94 HydrophobicContact CB-CB 4.36Å; N91-F94 VanDerWaalsContact O-CB 3.25Å; N91-F94 WeakPolarHBondContact O-CB 3.29Å; N91-F94 PolarHBondContact O-N 3.48Å
92	K	93.4	Very high	97.7	Very high	203 Å²	203	42.1 Å²	42.1	88%	0.883	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73	-20.3	179.3	-64.4	-175.2	178.4	-178.3	0	113.9	F94	K92-F94 VanDerWaalsContact C-N 3.27Å
93	D	95.6	Very high	97.8	Very high	118 Å²	118	42 Å²	42	63%	0.631	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-4.2	177	-57.4	-33.6	0	0	0	111.9	M66 N91 T95	M66-D93 HydrophobicContact CE-CB 4Å; N91-D93 VanDerWaalsContact C-N 3.3Å; N91-D93 PolarHBondContact O-N 3.23Å; N91-D93 PolarHBondContact OD1-N 3.32Å; D93-T95 PolarHBondContact O-N 2.94Å
94	F	97.6	Very high	97.8	Very high	5 Å²	5	40.6 Å²	40.6	2%	0.022	20%	0.203	C	C	.	.			trans	-67.4	123.9	175.3	-165.9	-97.1	0	0	0	109.3	M66 S68 V89 N91 K92 L124 L130 L157 V159	M66-F94 HydrophobicContact SD-CD2 4.4Å; S68-F94 VanDerWaalsContact CB-CD2 3.47Å; V89-F94 HydrophobicContact CG1-CB 3.79Å; V89-F94 HydrophobicContact CG1-CD1 3.76Å; V89-F94 HydrophobicContact CG1-CD2 4.49Å; V89-F94 HydrophobicContact CG1-CE1 4.45Å; V89-F94 HydrophobicContact CG1-CG 3.78Å; V89-F94 HydrophobicContact CG2-CD1 4.47Å; N91-F94 HydrophobicContact CB-CB 4.36Å; N91-F94 VanDerWaalsContact O-CB 3.25Å; N91-F94 WeakPolarHBondContact O-CB 3.29Å; N91-F94 PolarHBondContact O-N 3.48Å; K92-F94 VanDerWaalsContact C-N 3.27Å; F94-L124 HydrophobicContact CD1-CD2 3.83Å; F94-L124 WeakPolarHBondContact O-CD2 3.46Å; F94-L130 HydrophobicContact CE1-CD1 3.96Å; F94-L157 HydrophobicContact CE2-CB 4.26Å; F94-L157 HydrophobicContact CZ-CB 3.81Å; F94-V159 HydrophobicContact CD1-CG2 4.49Å; F94-V159 HydrophobicContact CE1-CG2 3.63Å; F94-V159 HydrophobicContact CE2-CG2 3.87Å; F94-V159 HydrophobicContact CZ-CG2 3.28Å
95	T	98	Very high	97.8	Very high	78 Å²	78	41.1 Å²	41.1	48%	0.479	21%	0.207	S	C	.	.			trans	-138.7	154.4	-177.8	55.3	0	0	0	0	110	Q64 D93	Q64-T95 PolarHBondContact NE2-O 3.38Å; D93-T95 PolarHBondContact O-N 2.94Å
96	F	98.6	Very high	97.7	Very high	12 Å²	12	41.5 Å²	41.5	5%	0.053	21%	0.209	C	C	.	.			trans	-146.7	160.9	173.9	73.4	-83.6	0	0	0	110.6	I117 S119 S120 P121 L124 L130 V159	F96-I117 HydrophobicContact CB-CD1 3.87Å; F96-I117 HydrophobicContact CD1-CD1 4.15Å; F96-I117 HydrophobicContact CD2-CB 4.42Å; F96-I117 HydrophobicContact CD2-CD1 3.44Å; F96-I117 VanDerWaalsContact CD2-CD1 3.44Å; F96-I117 HydrophobicContact CD2-CG2 4.22Å; F96-I117 HydrophobicContact CE1-CG2 4.34Å; F96-I117 HydrophobicContact CE2-CB 4.16Å; F96-I117 HydrophobicContact CE2-CD1 3.97Å; F96-I117 HydrophobicContact CE2-CG2 3.58Å; F96-I117 HydrophobicContact CG-CD1 3.55Å; F96-I117 HydrophobicContact CZ-CG2 3.64Å; F96-S119 WeakPolarHBondContact CZ-O 3.25Å; F96-S120 VanDerWaalsContact CZ-C 3.44Å; F96-S120 WeakPolarHBondContact CZ-O 3.21Å; F96-P121 HydrophobicContact CD2-CG 4.31Å; F96-P121 HydrophobicContact CE2-CG 3.93Å; F96-P121 HydrophobicContact CZ-CB 4.4Å; F96-P121 HydrophobicContact CZ-CG 4.15Å; F96-P121 WeakPolarHBondContact O-CG 3.29Å; F96-L124 HydrophobicContact CD1-CD2 3.52Å; F96-L124 HydrophobicContact CE1-CB 3.88Å; F96-L124 HydrophobicContact CE1-CD2 3.73Å; F96-L124 HydrophobicContact CE1-CG 4.48Å; F96-L130 HydrophobicContact CD1-CD1 4.27Å; F96-L130 HydrophobicContact CE1-CD1 4.33Å; F96-V159 HydrophobicContact CB-CG1 3.84Å; F96-V159 HydrophobicContact CB-CG2 3.94Å
97	K	98.8	Very high	97.7	Very high	79 Å²	79	41.2 Å²	41.2	34%	0.343	22%	0.22	S	C	.	.			trans	-98.5	141.2	172.7	-58.9	-176.2	179.6	-157.6	0	110.3	G99 Q100 F164 D166	K97-G99 PolarHBondContact O-N 3.17Å; K97-G99 VanDerWaalsContact O-N 3.13Å; K97-Q100 HydrophobicContact CB-CG 4.21Å; K97-Q100 WeakPolarHBondContact O-CB 3.38Å; K97-Q100 WeakPolarHBondContact O-CG 3.46Å; K97-Q100 PolarHBondContact O-N 3.29Å; K97-F164 HydrophobicContact CB-CB 3.72Å; K97-F164 HydrophobicContact CB-CD1 4.4Å; K97-F164 HydrophobicContact CB-CD2 3.99Å; K97-F164 HydrophobicContact CB-CG 3.78Å; K97-F164 HydrophobicContact CD-CD1 4.17Å; K97-F164 HydrophobicContact CD-CD2 3.51Å; K97-F164 HydrophobicContact CD-CE1 4.15Å; K97-F164 HydrophobicContact CD-CE2 3.49Å; K97-F164 VanDerWaalsContact CD-CE2 3.49Å; K97-F164 HydrophobicContact CD-CG 3.87Å; K97-F164 HydrophobicContact CD-CZ 3.82Å; K97-F164 HydrophobicContact CG-CD2 4.4Å; K97-F164 HydrophobicContact CG-CG 4.49Å; K97-D166 HydrophobicContact CB-CB 4.49Å; K97-D166 HydrophobicContact CD-CB 3.89Å; K97-D166 WeakPolarHBondContact CD-OD2 2.98Å; K97-D166 WeakPolarHBondContact CE-OD2 3.43Å; K97-D166 HydrophobicContact CG-CB 4.38Å; K97-D166 IonicContact NZ-OD2 3.73Å; K97-D166 PolarHBondContact NZ-OD2 3.39Å
98	A	98.8	Very high	97.6	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	119	-177	0	0	0	0	0	111.2	P121 F164 F165 S190 I191 H194	A98-P121 HydrophobicContact CB-CG 4.11Å; A98-F164 CarbonylContact O-C 3.57Å; A98-F164 WeakPolarHBondContact O-CA 3.43Å; A98-F164 VanDerWaalsContact O-CB 3.25Å; A98-F164 WeakPolarHBondContact O-CB 3.31Å; A98-F165 PolarHBondContact O-N 3.48Å; A98-S190 WeakPolarHBondContact CA-OG 3.34Å; A98-I191 HydrophobicContact CB-CG1 4.19Å; A98-I191 VanDerWaalsContact O-CG1 3.24Å; A98-I191 WeakPolarHBondContact O-CG1 3.28Å; A98-H194 HydrophobicContact CB-CB 3.43Å; A98-H194 VanDerWaalsContact CB-CB 3.43Å
99	G	98.5	Very high	97.4	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	113.8	-19	-173.6	0	0	0	0	0	114.9	K97 F163 P187 S190	K97-G99 PolarHBondContact O-N 3.17Å; K97-G99 VanDerWaalsContact O-N 3.13Å; G99-F163 CarbonylContact C-O 3.53Å; G99-F163 VanDerWaalsContact CA-O 3.29Å; G99-F163 WeakPolarHBondContact CA-O 3.48Å; G99-P187 WeakPolarHBondContact O-CB 3.26Å; G99-S190 PolarHBondContact N-OG 2.81Å
100	Q	98.6	Very high	97.2	Very high	4 Å²	4	50.6 Å²	50.6	2%	0.019	30%	0.297	C	S	.	.			trans	-67.9	166.6	178.5	-71.8	-171.1	-58.7	0	0	113.3	K97 I117 V159 G160 G161 F163 F164	K97-Q100 HydrophobicContact CB-CG 4.21Å; K97-Q100 WeakPolarHBondContact O-CB 3.38Å; K97-Q100 WeakPolarHBondContact O-CG 3.46Å; K97-Q100 PolarHBondContact O-N 3.29Å; Q100-I117 WeakPolarHBondContact O-CB 3.41Å; Q100-I117 WeakPolarHBondContact O-CG1 3.25Å; Q100-I117 PolarHBondContact O-N 2.96Å; Q100-V159 HydrophobicContact CB-CG1 4.03Å; Q100-V159 HydrophobicContact CG-CG1 4.43Å; Q100-V159 VanDerWaalsContact OE1-CG1 3.27Å; Q100-G160 WeakPolarHBondContact CB-O 3.38Å; Q100-G161 PolarHBondContact NE2-O 3.23Å; Q100-F163 PolarHBondContact N-O 3Å; Q100-F164 HydrophobicContact CG-CB 4.24Å; Q100-F164 HydrophobicContact CG-CD1 4.21Å
101	W	98.3	Very high	97.3	Very high	8 Å²	8	47.7 Å²	47.7	3%	0.03	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	170.3	174.6	52.8	-103.8	0	0	0	111.5	H54 T58 N61 R63 D103 F115 G160 G161 E313	H54-W101 AromaticContact CE1-CE3 3.89Å; H54-W101 AromaticContact CE1-CH2 3.96Å; H54-W101 AromaticContact CE1-CZ3 3.85Å; H54-W101 AromaticContact NE2-CE3 3.77Å; H54-W101 AromaticContact NE2-CH2 3.81Å; H54-W101 AromaticContact NE2-CZ3 3.46Å; H54-W101 WeakPolarHBondContact NE2-CZ3 3.35Å; T58-W101 HydrophobicContact CG2-CZ2 4.24Å; N61-W101 HydrophobicContact CB-CZ2 4.18Å; R63-W101 HydrophobicContact CG-CH2 4.01Å; W101-D103 HydrophobicContact CZ3-CB 4.45Å; W101-D103 WeakPolarHBondContact CZ3-OD1 3.07Å; W101-F115 CarbonylContact C-O 3.56Å; W101-F115 VanDerWaalsContact CA-O 3.3Å; W101-F115 WeakPolarHBondContact CA-O 3.39Å; W101-F115 WeakPolarHBondContact CB-O 3.22Å; W101-G160 VanDerWaalsContact CE2-C 3.45Å; W101-G160 PolarHBondContact N-O 2.78Å; W101-G160 PolarHBondContact O-N 3.23Å; W101-G160 VanDerWaalsContact O-O 3.09Å; W101-G161 VanDerWaalsContact NE1-CA 3.28Å; W101-E313 VanDerWaalsContact CD1-OE2 3.29Å
102	V	98.6	Very high	97.4	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	137	169.6	-63.5	0	0	0	0	111.3	F104 F115 I117 L130 L132 L157 R158 V159	V102-F104 PolarHBondContact O-N 2.65Å; V102-F115 PolarHBondContact N-O 2.94Å; V102-F115 PolarHBondContact O-N 3.38Å; V102-F115 VanDerWaalsContact O-N 3.12Å; V102-I117 HydrophobicContact CG1-CD1 3.89Å; V102-I117 HydrophobicContact CG1-CG1 3.99Å; V102-L130 HydrophobicContact CG1-CD1 4.09Å; V102-L132 HydrophobicContact CG2-CD1 4Å; V102-L132 HydrophobicContact CG2-CD2 3.87Å; V102-L157 HydrophobicContact CB-CB 4.5Å; V102-L157 HydrophobicContact CB-CD2 4.4Å; V102-L157 HydrophobicContact CG1-CB 4.44Å; V102-L157 HydrophobicContact CG2-CD2 4.07Å; V102-R158 CarbonylContact C-O 3.58Å; V102-R158 VanDerWaalsContact CA-O 3.26Å; V102-R158 WeakPolarHBondContact CA-O 3.42Å; V102-V159 HydrophobicContact CG1-CG2 4.47Å
103	D	98.5	Very high	97.5	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	122.3	152.4	-68.3	-29	0	0	0	106.3	H54 R63 W101 F105 V112 G113 L157 R158	H54-D103 IonicContact CD2-OD1 3.61Å; H54-D103 PolarHBondContact CD2-OD1 2.94Å; H54-D103 IonicContact CE1-OD1 3.21Å; H54-D103 IonicContact NE2-OD1 2.7Å; H54-D103 PolarHBondContact NE2-OD1 2.77Å; R63-D103 IonicContact CZ-OD2 3.92Å; R63-D103 IonicContact NE-OD1 2.67Å; R63-D103 IonicContact NE-OD2 3.15Å; R63-D103 PolarHBondContact NE-OD2 2.82Å; R63-D103 IonicContact NH2-OD1 2.73Å; R63-D103 PolarHBondContact NH2-OD1 3.03Å; W101-D103 HydrophobicContact CZ3-CB 4.45Å; W101-D103 WeakPolarHBondContact CZ3-OD1 3.07Å; D103-F105 HydrophobicContact CB-CD2 4.39Å; D103-F105 HydrophobicContact CB-CE2 3.54Å; D103-F105 HydrophobicContact CB-CZ 3.67Å; D103-V112 HydrophobicContact CB-CG1 3.77Å; D103-G113 CarbonylContact C-O 3.57Å; D103-G113 WeakPolarHBondContact CA-O 3.41Å; D103-L157 WeakPolarHBondContact O-CA 3.48Å; D103-R158 HydrophobicContact CB-CB 4.16Å; D103-R158 PolarHBondContact N-O 2.82Å; D103-R158 PolarHBondContact O-N 3.14Å; D103-R158 VanDerWaalsContact O-N 3.1Å; D103-R158 IonicContact OD2-CZ 2.85Å; D103-R158 IonicContact OD2-NE 2.89Å; D103-R158 PolarHBondContact OD2-NE 3.43Å; D103-R158 IonicContact OD2-NH2 3.22Å; D103-R158 PolarHBondContact OD2-NH2 2.88Å
104	F	98.5	Very high	97.6	Very high	0 Å²	0	32 Å²	32	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	103.8	-174.8	-169.7	-95.4	0	0	0	109.2	L85 L87 V102 I106 G113 F115 L132 W144 I145 V155 L157	L85-F104 HydrophobicContact CD1-CZ 4.29Å; L87-F104 HydrophobicContact CD1-CE2 3.9Å; L87-F104 HydrophobicContact CD2-CE2 4.44Å; V102-F104 PolarHBondContact O-N 2.65Å; F104-I106 HydrophobicContact CD1-CD1 3.81Å; F104-I106 HydrophobicContact CD1-CG1 3.58Å; F104-I106 HydrophobicContact CE1-CD1 3.73Å; F104-I106 HydrophobicContact CE1-CG1 3.43Å; F104-I106 VanDerWaalsContact CE1-CG1 3.43Å; F104-G113 PolarHBondContact N-O 2.95Å; F104-G113 PolarHBondContact O-N 3.36Å; F104-F115 HydrophobicContact CB-CD2 3.69Å; F104-F115 HydrophobicContact CB-CE2 3.96Å; F104-F115 HydrophobicContact CD1-CD2 4.35Å; F104-F115 AromaticContact CD1-CE2 4Å; F104-F115 HydrophobicContact CD1-CE2 4Å; F104-F115 HydrophobicContact CD2-CD2 4.44Å; F104-F115 AromaticContact CG-CD2 3.93Å; F104-F115 HydrophobicContact CG-CD2 3.93Å; F104-F115 HydrophobicContact CG-CE2 4.05Å; F104-L132 HydrophobicContact CD2-CD1 3.68Å; F104-L132 HydrophobicContact CE2-CD1 3.85Å; F104-W144 HydrophobicContact CE1-CE3 4.48Å; F104-W144 HydrophobicContact CE1-CZ3 4.21Å; F104-W144 HydrophobicContact CZ-CZ3 4.46Å; F104-I145 HydrophobicContact CD1-CD1 4.46Å; F104-I145 HydrophobicContact CE1-CD1 4Å; F104-I145 HydrophobicContact CE1-CG1 4.22Å; F104-I145 HydrophobicContact CZ-CD1 4.3Å; F104-V155 HydrophobicContact CE1-CB 4.48Å; F104-V155 HydrophobicContact CE1-CG1 3.93Å; F104-V155 HydrophobicContact CE2-CB 4.17Å; F104-V155 HydrophobicContact CE2-CG1 4.24Å; F104-V155 HydrophobicContact CE2-CG2 3.79Å; F104-V155 HydrophobicContact CZ-CB 4.02Å; F104-V155 HydrophobicContact CZ-CG1 3.59Å; F104-V155 HydrophobicContact CZ-CG2 3.99Å; F104-L157 HydrophobicContact CD2-CD2 3.45Å; F104-L157 VanDerWaalsContact CD2-CD2 3.45Å; F104-L157 HydrophobicContact CE2-CD2 3.93Å; F104-L157 HydrophobicContact CG-CD2 4.44Å
105	F	98.5	Very high	97.6	Very high	51 Å²	51	32.8 Å²	32.8	22%	0.224	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	124.8	-177.4	-55.6	-88.4	0	0	0	109.8	D103 V112 V155 A156 R158	D103-F105 HydrophobicContact CB-CD2 4.39Å; D103-F105 HydrophobicContact CB-CE2 3.54Å; D103-F105 HydrophobicContact CB-CZ 3.67Å; F105-V112 HydrophobicContact CD1-CG1 4.04Å; F105-V112 HydrophobicContact CD1-CG2 3.68Å; F105-V112 HydrophobicContact CE1-CB 4.39Å; F105-V112 HydrophobicContact CE1-CG1 3.81Å; F105-V112 HydrophobicContact CE1-CG2 3.58Å; F105-V112 HydrophobicContact CZ-CG1 4.14Å; F105-V155 WeakPolarHBondContact O-CA 3.18Å; F105-V155 WeakPolarHBondContact O-CB 3.34Å; F105-A156 HydrophobicContact CB-CB 4.1Å; F105-A156 HydrophobicContact CD2-CB 4.28Å; F105-A156 WeakPolarHBondContact CD2-O 3.25Å; F105-A156 PolarHBondContact N-O 2.9Å; F105-A156 PolarHBondContact O-N 3.48Å; F105-R158 HydrophobicContact CE2-CB 3.93Å
106	I	98.5	Very high	97.6	Very high	9 Å²	9	30.1 Å²	30.1	5%	0.046	20%	0.2	C	C	.	.			trans	-113.9	125.5	179.8	-57.5	157.8	0	0	0	108.1	F104 G108 V109 P141 W144 V155	F104-I106 HydrophobicContact CD1-CD1 3.81Å; F104-I106 HydrophobicContact CD1-CG1 3.58Å; F104-I106 HydrophobicContact CE1-CD1 3.73Å; F104-I106 HydrophobicContact CE1-CG1 3.43Å; F104-I106 VanDerWaalsContact CE1-CG1 3.43Å; I106-G108 PolarHBondContact O-N 3.38Å; I106-V109 HydrophobicContact CB-CB 3.95Å; I106-V109 HydrophobicContact CB-CG2 3.87Å; I106-V109 HydrophobicContact CD1-CG2 4.41Å; I106-V109 HydrophobicContact CG2-CB 4.25Å; I106-V109 HydrophobicContact CG2-CG2 3.61Å; I106-V109 PolarHBondContact O-N 3.32Å; I106-V109 VanDerWaalsContact O-N 3.08Å; I106-P141 HydrophobicContact CD1-CB 3.85Å; I106-P141 HydrophobicContact CD1-CG 4.49Å; I106-W144 HydrophobicContact CD1-CB 4.17Å; I106-W144 HydrophobicContact CD1-CD2 3.9Å; I106-W144 HydrophobicContact CD1-CE3 3.61Å; I106-W144 HydrophobicContact CD1-CG 4.12Å; I106-W144 HydrophobicContact CD1-CZ3 4.33Å; I106-W144 HydrophobicContact CG1-CD2 4.35Å; I106-W144 HydrophobicContact CG1-CE3 4Å; I106-W144 HydrophobicContact CG1-CZ3 4.26Å; I106-W144 HydrophobicContact CG2-CD2 3.71Å; I106-W144 HydrophobicContact CG2-CE3 4.1Å; I106-W144 HydrophobicContact CG2-CG 4.14Å; I106-W144 HydrophobicContact CG2-CH2 4.27Å; I106-W144 HydrophobicContact CG2-CZ2 3.89Å; I106-W144 HydrophobicContact CG2-CZ3 4.36Å; I106-V155 HydrophobicContact CG1-CG1 4.42Å
107	P	97.8	Very high	97.6	Very high	96 Å²	96	29.5 Å²	29.5	62%	0.623	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.7	127.4	174.9	-26.7	35.4	0	0	0	111.9	V109 E154	P107-V109 VanDerWaalsContact C-N 3.31Å; P107-V109 PolarHBondContact O-N 2.95Å; P107-E154 WeakPolarHBondContact CD-O 3.45Å
108	G	95.9	Very high	97.6	Very high	91 Å²	91	25.8 Å²	25.8	94%	0.938	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	82.5	-5.4	-180	0	0	0	0	0	115.7	I106	I106-G108 PolarHBondContact O-N 3.38Å
109	V	96.4	Very high	97.6	Very high	38 Å²	38	25.8 Å²	25.8	23%	0.23	18%	0.181	C	C	.	.			trans	-103.7	120.5	173.4	-176.1	0	0	0	0	109.1	I106 P107 V111 P140	I106-V109 HydrophobicContact CB-CB 3.95Å; I106-V109 HydrophobicContact CB-CG2 3.87Å; I106-V109 HydrophobicContact CD1-CG2 4.41Å; I106-V109 HydrophobicContact CG2-CB 4.25Å; I106-V109 HydrophobicContact CG2-CG2 3.61Å; I106-V109 PolarHBondContact O-N 3.32Å; I106-V109 VanDerWaalsContact O-N 3.08Å; P107-V109 VanDerWaalsContact C-N 3.31Å; P107-V109 PolarHBondContact O-N 2.95Å; V109-V111 VanDerWaalsContact C-N 3.32Å; V109-V111 PolarHBondContact O-N 3.05Å; V109-P140 HydrophobicContact CG1-CB 4.01Å
110	S	94.1	Very high	97.6	Very high	120 Å²	120	26.2 Å²	26.2	84%	0.839	18%	0.184	S	C	*	.			trans	-74.5	-20.6	-175.9	55.6	0	0	0	0	114.4
111	V	95.5	Very high	97.6	Very high	36 Å²	36	26.5 Å²	26.5	22%	0.218	19%	0.186	C	C	.	.	S	Bend	trans	-92.9	133.2	-178.7	179.1	0	0	0	0	109.7	V109 H139 P140 P141	V109-V111 VanDerWaalsContact C-N 3.32Å; V109-V111 PolarHBondContact O-N 3.05Å; V111-H139 WeakPolarHBondContact CG1-NE2 3.38Å; V111-P140 HydrophobicContact CB-CB 4.45Å; V111-P140 HydrophobicContact CB-CG 4.31Å; V111-P140 HydrophobicContact CG2-CG 4.07Å; V111-P141 HydrophobicContact CB-CG 4.38Å; V111-P141 HydrophobicContact CG1-CG 4.15Å; V111-P141 WeakPolarHBondContact O-CG 3.26Å
112	V	96.8	Very high	97.6	Very high	16 Å²	16	30.2 Å²	30.2	10%	0.097	20%	0.2	C	C	.	.	P	Polyproline II helix	trans	-89.5	128.8	178.1	-179.2	0	0	0	0	110	L55 D103 F105	L55-V112 HydrophobicContact CD1-CB 4.29Å; L55-V112 HydrophobicContact CD1-CG2 3.96Å; L55-V112 HydrophobicContact CD2-CB 4.46Å; L55-V112 HydrophobicContact CD2-CG1 4.26Å; L55-V112 HydrophobicContact CG-CB 4.19Å; L55-V112 HydrophobicContact CG-CG2 4.41Å; D103-V112 HydrophobicContact CB-CG1 3.77Å; F105-V112 HydrophobicContact CD1-CG1 4.04Å; F105-V112 HydrophobicContact CD1-CG2 3.68Å; F105-V112 HydrophobicContact CE1-CB 4.39Å; F105-V112 HydrophobicContact CE1-CG1 3.81Å; F105-V112 HydrophobicContact CE1-CG2 3.58Å; F105-V112 HydrophobicContact CZ-CG1 4.14Å
113	G	96.6	Very high	97.6	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	140.8	175.8	0	0	0	0	0	111.9	D103 F104	D103-G113 CarbonylContact C-O 3.57Å; D103-G113 WeakPolarHBondContact CA-O 3.41Å; F104-G113 PolarHBondContact N-O 2.95Å; F104-G113 PolarHBondContact O-N 3.36Å
114	G	96.5	Very high	97.6	Very high	28 Å²	28	32.1 Å²	32.1	29%	0.289	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	113	166.5	0	0	0	0	0	110	H54	H54-G114 VanDerWaalsContact CE1-CA 3.45Å; H54-G114 WeakPolarHBondContact CE1-CA 3.36Å; H54-G114 WeakPolarHBondContact NE2-CA 3.45Å
115	F	98	Very high	97.6	Very high	23 Å²	23	39 Å²	39	10%	0.101	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	121.6	-177.5	-58.3	-58.7	0	0	0	111.9	W101 V102 F104 L132 V134 P141 A142 I145	W101-F115 CarbonylContact C-O 3.56Å; W101-F115 VanDerWaalsContact CA-O 3.3Å; W101-F115 WeakPolarHBondContact CA-O 3.39Å; W101-F115 WeakPolarHBondContact CB-O 3.22Å; V102-F115 PolarHBondContact N-O 2.94Å; V102-F115 PolarHBondContact O-N 3.38Å; V102-F115 VanDerWaalsContact O-N 3.12Å; F104-F115 HydrophobicContact CB-CD2 3.69Å; F104-F115 HydrophobicContact CB-CE2 3.96Å; F104-F115 HydrophobicContact CD1-CD2 4.35Å; F104-F115 AromaticContact CD1-CE2 4Å; F104-F115 HydrophobicContact CD1-CE2 4Å; F104-F115 HydrophobicContact CD2-CD2 4.44Å; F104-F115 AromaticContact CG-CD2 3.93Å; F104-F115 HydrophobicContact CG-CD2 3.93Å; F104-F115 HydrophobicContact CG-CE2 4.05Å; F115-L132 HydrophobicContact CB-CD1 4.03Å; F115-L132 HydrophobicContact CB-CD2 4.05Å; F115-L132 HydrophobicContact CB-CG 4.5Å; F115-L132 HydrophobicContact CD2-CD1 4.21Å; F115-L132 HydrophobicContact CG-CD1 4.5Å; F115-V134 HydrophobicContact CB-CG2 4.43Å; F115-V134 HydrophobicContact CD1-CB 4.44Å; F115-V134 HydrophobicContact CD1-CG1 4Å; F115-V134 HydrophobicContact CD1-CG2 3.68Å; F115-V134 HydrophobicContact CD2-CG2 4.2Å; F115-V134 HydrophobicContact CE1-CB 4.32Å; F115-V134 HydrophobicContact CE1-CG1 3.44Å; F115-V134 VanDerWaalsContact CE1-CG1 3.44Å; F115-V134 HydrophobicContact CE1-CG2 3.92Å; F115-V134 HydrophobicContact CE2-CG2 4.39Å; F115-V134 HydrophobicContact CG-CG2 3.84Å; F115-V134 HydrophobicContact CZ-CG1 3.83Å; F115-V134 HydrophobicContact CZ-CG2 4.26Å; F115-P141 HydrophobicContact CE2-CB 4.06Å; F115-P141 HydrophobicContact CZ-CB 3.95Å; F115-A142 HydrophobicContact CE1-CB 4.4Å; F115-A142 HydrophobicContact CZ-CB 4.28Å; F115-I145 HydrophobicContact CD2-CD1 4.34Å; F115-I145 HydrophobicContact CE2-CD1 3.67Å; F115-I145 HydrophobicContact CZ-CD1 3.95Å
116	S	98.5	Very high	97.5	Very high	21 Å²	21	44.4 Å²	44.4	15%	0.147	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	134.5	173.8	-45.6	0	0	0	0	111	E313	S116-E313 PolarHBondContact OG-OE1 3.36Å
117	I	98.9	Very high	97.5	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-70.9	136.2	179.7	-57.2	164.5	0	0	0	108.5	F96 Q100 V102 L130 L132 N186 S190	F96-I117 HydrophobicContact CB-CD1 3.87Å; F96-I117 HydrophobicContact CD1-CD1 4.15Å; F96-I117 HydrophobicContact CD2-CB 4.42Å; F96-I117 HydrophobicContact CD2-CD1 3.44Å; F96-I117 VanDerWaalsContact CD2-CD1 3.44Å; F96-I117 HydrophobicContact CD2-CG2 4.22Å; F96-I117 HydrophobicContact CE1-CG2 4.34Å; F96-I117 HydrophobicContact CE2-CB 4.16Å; F96-I117 HydrophobicContact CE2-CD1 3.97Å; F96-I117 HydrophobicContact CE2-CG2 3.58Å; F96-I117 HydrophobicContact CG-CD1 3.55Å; F96-I117 HydrophobicContact CZ-CG2 3.64Å; Q100-I117 WeakPolarHBondContact O-CB 3.41Å; Q100-I117 WeakPolarHBondContact O-CG1 3.25Å; Q100-I117 PolarHBondContact O-N 2.96Å; V102-I117 HydrophobicContact CG1-CD1 3.89Å; V102-I117 HydrophobicContact CG1-CG1 3.99Å; I117-L130 HydrophobicContact CD1-CD1 3.79Å; I117-L130 HydrophobicContact CG1-CD1 4.02Å; I117-L130 HydrophobicContact CG1-CD2 4.3Å; I117-L130 HydrophobicContact CG1-CG 4.34Å; I117-L130 HydrophobicContact CG2-CD1 4.27Å; I117-L130 HydrophobicContact CG2-CD2 4.31Å; I117-L130 HydrophobicContact CG2-CG 3.92Å; I117-L132 HydrophobicContact CG1-CD2 4.37Å; I117-N186 CarbonylContact O-C 3.59Å; I117-N186 VanDerWaalsContact O-O 3.14Å; I117-S190 WeakPolarHBondContact O-CB 3.4Å
118	C	98.8	Very high	97.5	Very high	0 Å²	0	44 Å²	44	0%	0	26%	0.26	C	S	.	.			trans	-112.5	1.2	178.8	68.1	0	0	0	0	114.2	E131 N186 F189 F228	C118-E131 PolarHBondContact N-O 3.18Å; C118-E131 VanDerWaalsContact SG-C 3.55Å; C118-E131 PolarHBondContact SG-O 3.38Å; C118-E131 VanDerWaalsContact SG-O 3.39Å; C118-N186 HydrophobicContact CB-CB 4.01Å; C118-F189 HydrophobicContact CB-CD1 4.4Å; C118-F189 WeakPolarHBondContact O-CD1 3.33Å; C118-F228 HydrophobicContact CB-CE2 4.26Å; C118-F228 HydrophobicContact CB-CZ 3.83Å
119	S	98.8	Very high	97.7	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.007	22%	0.219	C	C	.	.	S	Bend	trans	-96.7	162.8	169.7	54.6	0	0	0	0	112.1	F96 E131 S190	F96-S119 WeakPolarHBondContact CZ-O 3.25Å; S119-E131 PolarHBondContact OG-N 3.33Å; S119-S190 VanDerWaalsContact O-CB 3.26Å; S119-S190 WeakPolarHBondContact O-CB 3.29Å; S119-S190 PolarHBondContact O-OG 2.91Å
120	S	98.6	Very high	97.8	Very high	8 Å²	8	38.7 Å²	38.7	6%	0.056	21%	0.208	C	C	.	.			trans	-80.5	157.4	170.8	62.4	0	0	0	0	112.4	F96 R122 L123 D197	F96-S120 VanDerWaalsContact CZ-C 3.44Å; F96-S120 WeakPolarHBondContact CZ-O 3.21Å; S120-R122 PolarHBondContact O-N 2.87Å; S120-L123 WeakPolarHBondContact O-CB 3.36Å; S120-L123 PolarHBondContact O-N 3.19Å; S120-D197 WeakPolarHBondContact CB-OD2 3.41Å; S120-D197 PolarHBondContact OG-OD2 3.36Å
121	P	98.6	Very high	98	Very high	10 Å²	10	33.3 Å²	33.3	7%	0.065	17%	0.17	C	C	.	.	H	α-helix	trans	-55.1	-37.6	172.9	-27.5	36	0	0	0	113.4	F96 A98 L123 L124 E125	F96-P121 HydrophobicContact CD2-CG 4.31Å; F96-P121 HydrophobicContact CE2-CG 3.93Å; F96-P121 HydrophobicContact CZ-CB 4.4Å; F96-P121 HydrophobicContact CZ-CG 4.15Å; F96-P121 WeakPolarHBondContact O-CG 3.29Å; A98-P121 HydrophobicContact CB-CG 4.11Å; P121-L123 PolarHBondContact O-N 3.29Å; P121-L124 WeakPolarHBondContact O-CB 3.41Å; P121-L124 PolarHBondContact O-N 2.82Å; P121-E125 WeakPolarHBondContact O-CG 3.31Å; P121-E125 PolarHBondContact O-N 3.31Å
122	R	97.9	Very high	98.2	Very high	86 Å²	86	31.6 Å²	31.6	33%	0.325	16%	0.16	S	C	.	.	H	α-helix	trans	-59.1	-33.1	179.1	-169.4	172.1	69.3	149	-3.9	113	S120 L124 E125 R126 D197 E200	S120-R122 PolarHBondContact O-N 2.87Å; R122-L124 VanDerWaalsContact C-N 3.32Å; R122-E125 PolarHBondContact O-N 3.49Å; R122-R126 VanDerWaalsContact O-CB 3.29Å; R122-R126 WeakPolarHBondContact O-CB 3.35Å; R122-R126 PolarHBondContact O-N 3Å; R122-D197 HydrophobicContact CB-CB 4.18Å; R122-D197 WeakPolarHBondContact CB-OD2 3.41Å; R122-D197 IonicContact CZ-OD1 3.02Å; R122-D197 IonicContact NE-OD1 2.94Å; R122-D197 PolarHBondContact NE-OD1 3.39Å; R122-D197 IonicContact NE-OD2 3.89Å; R122-D197 IonicContact NH2-OD1 3.19Å; R122-D197 PolarHBondContact NH2-OD1 2.59Å; R122-E200 IonicContact CZ-OE2 2.6Å; R122-E200 IonicContact NH1-OE2 2.86Å; R122-E200 PolarHBondContact NH1-OE2 2.81Å; R122-E200 IonicContact NH2-OE2 3.48Å; R122-E200 PolarHBondContact NH2-OE2 3.36Å
123	L	98.5	Very high	98.2	Very high	29 Å²	29	31 Å²	31	15%	0.152	16%	0.156	C	C	.	.	H	α-helix	trans	-64.7	-40	177.3	-176	67	0	0	0	111.4	S120 P121 D127 I129 E131	S120-L123 WeakPolarHBondContact O-CB 3.36Å; S120-L123 PolarHBondContact O-N 3.19Å; P121-L123 PolarHBondContact O-N 3.29Å; L123-D127 HydrophobicContact CD1-CB 4.44Å; L123-D127 VanDerWaalsContact CD1-OD2 3.26Å; L123-D127 WeakPolarHBondContact CD1-OD2 3.24Å; L123-D127 WeakPolarHBondContact O-CB 3.37Å; L123-D127 PolarHBondContact O-N 3.01Å; L123-I129 CarbonylContact C-O 3.57Å; L123-I129 HydrophobicContact CD2-CB 4.27Å; L123-I129 HydrophobicContact CD2-CG2 3.98Å; L123-I129 HydrophobicContact CG-CB 4.09Å; L123-I129 HydrophobicContact CG-CG2 4.37Å; L123-E131 HydrophobicContact CD2-CG 4.08Å
124	L	98.6	Very high	98.3	Very high	12 Å²	12	31.2 Å²	31.2	6%	0.063	16%	0.157	C	C	.	.	H	α-helix	trans	-69.1	-46.5	176.1	175.7	67	0	0	0	110.9	V89 F94 F96 P121 R122 R126 G128 I129	V89-L124 HydrophobicContact CB-CD1 3.84Å; V89-L124 HydrophobicContact CG1-CD1 4.45Å; V89-L124 HydrophobicContact CG2-CD1 3.74Å; F94-L124 HydrophobicContact CD1-CD2 3.83Å; F94-L124 WeakPolarHBondContact O-CD2 3.46Å; F96-L124 HydrophobicContact CD1-CD2 3.52Å; F96-L124 HydrophobicContact CE1-CB 3.88Å; F96-L124 HydrophobicContact CE1-CD2 3.73Å; F96-L124 HydrophobicContact CE1-CG 4.48Å; P121-L124 WeakPolarHBondContact O-CB 3.41Å; P121-L124 PolarHBondContact O-N 2.82Å; R122-L124 VanDerWaalsContact C-N 3.32Å; L124-R126 VanDerWaalsContact C-N 3.32Å; L124-R126 PolarHBondContact O-N 3.02Å; L124-G128 WeakPolarHBondContact O-CA 3.15Å; L124-G128 PolarHBondContact O-N 3.2Å; L124-I129 VanDerWaalsContact CA-O 3.27Å; L124-I129 WeakPolarHBondContact CA-O 3.16Å; L124-I129 PolarHBondContact N-O 2.81Å
125	E	97.4	Very high	98.4	Very high	145 Å²	145	33 Å²	33	68%	0.678	16%	0.158	S	C	*	.	H	α-helix	trans	-59.3	-42	179.4	-69.6	168.8	-172	0	0	112.5	P121 R122	P121-E125 WeakPolarHBondContact O-CG 3.31Å; P121-E125 PolarHBondContact O-N 3.31Å; R122-E125 PolarHBondContact O-N 3.49Å
126	R	97.1	Very high	98.3	Very high	164 Å²	164	38.8 Å²	38.8	62%	0.619	18%	0.178	S	C	*	.	H	α-helix	trans	-81.2	-46.7	-176.6	-169.6	-171	69.6	-161.3	-4.7	112.7	R122 L124	R122-R126 VanDerWaalsContact O-CB 3.29Å; R122-R126 WeakPolarHBondContact O-CB 3.35Å; R122-R126 PolarHBondContact O-N 3Å; L124-R126 VanDerWaalsContact C-N 3.32Å; L124-R126 PolarHBondContact O-N 3.02Å
127	D	98.1	Very high	98.2	Very high	71 Å²	71	39.8 Å²	39.8	38%	0.38	19%	0.188	S	C	.	.	H	α-helix	trans	-113.4	-6.2	-166.5	-57.8	-20.7	0	0	0	113.2	L123 I129	L123-D127 HydrophobicContact CD1-CB 4.44Å; L123-D127 VanDerWaalsContact CD1-OD2 3.26Å; L123-D127 WeakPolarHBondContact CD1-OD2 3.24Å; L123-D127 WeakPolarHBondContact O-CB 3.37Å; L123-D127 PolarHBondContact O-N 3.01Å; D127-I129 HydrophobicContact CB-CB 4.28Å; D127-I129 HydrophobicContact CB-CG1 3.81Å; D127-I129 PolarHBondContact O-N 2.8Å
128	G	98.4	Very high	98	Very high	24 Å²	24	45.8 Å²	45.8	25%	0.247	22%	0.224	C	C	.	.	S	Bend	trans	67	21.2	-170.5	0	0	0	0	0	112.8	V89 L124	V89-G128 PolarHBondContact N-O 3.13Å; L124-G128 WeakPolarHBondContact O-CA 3.15Å; L124-G128 PolarHBondContact O-N 3.2Å
129	I	98.8	Very high	97.8	Very high	18 Å²	18	48.8 Å²	48.8	9%	0.092	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	130.2	-174.7	-57.9	-54.8	0	0	0	112	R86 L87 A88 L123 L124 D127 E131	R86-I129 HydrophobicContact CB-CG2 4.31Å; L87-I129 WeakPolarHBondContact O-CA 3.42Å; A88-I129 HydrophobicContact CB-CD1 4.03Å; L123-I129 CarbonylContact C-O 3.57Å; L123-I129 HydrophobicContact CD2-CB 4.27Å; L123-I129 HydrophobicContact CD2-CG2 3.98Å; L123-I129 HydrophobicContact CG-CB 4.09Å; L123-I129 HydrophobicContact CG-CG2 4.37Å; L124-I129 VanDerWaalsContact CA-O 3.27Å; L124-I129 WeakPolarHBondContact CA-O 3.16Å; L124-I129 PolarHBondContact N-O 2.81Å; D127-I129 HydrophobicContact CB-CB 4.28Å; D127-I129 HydrophobicContact CB-CG1 3.81Å; D127-I129 PolarHBondContact O-N 2.8Å; I129-E131 HydrophobicContact CG2-CG 4.03Å
130	L	98.7	Very high	97.7	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	143.8	167.6	-177.8	152	0	0	0	109.5	L87 V89 F94 F96 V102 I117 L132 L157	L87-L130 WeakPolarHBondContact CB-O 3.27Å; L87-L130 HydrophobicContact CD1-CD2 3.97Å; L87-L130 PolarHBondContact N-O 2.95Å; L87-L130 PolarHBondContact O-N 2.74Å; V89-L130 HydrophobicContact CG2-CB 3.93Å; F94-L130 HydrophobicContact CE1-CD1 3.96Å; F96-L130 HydrophobicContact CD1-CD1 4.27Å; F96-L130 HydrophobicContact CE1-CD1 4.33Å; V102-L130 HydrophobicContact CG1-CD1 4.09Å; I117-L130 HydrophobicContact CD1-CD1 3.79Å; I117-L130 HydrophobicContact CG1-CD1 4.02Å; I117-L130 HydrophobicContact CG1-CD2 4.3Å; I117-L130 HydrophobicContact CG1-CG 4.34Å; I117-L130 HydrophobicContact CG2-CD1 4.27Å; I117-L130 HydrophobicContact CG2-CD2 4.31Å; I117-L130 HydrophobicContact CG2-CG 3.92Å; L130-L132 HydrophobicContact CD2-CD2 3.77Å; L130-L132 HydrophobicContact CD2-CG 3.97Å; L130-L157 HydrophobicContact CD2-CD1 4.44Å
131	E	98.9	Very high	97.6	Very high	8 Å²	8	51.1 Å²	51.1	4%	0.037	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	143.5	179.7	-55	-173.1	161	0	0	113.4	R84 L85 R86 C118 S119 L123 I129	R84-E131 IonicContact CZ-OE2 2.72Å; R84-E131 IonicContact NE-OE2 4Å; R84-E131 PolarHBondContact NE-OE2 2.84Å; R84-E131 IonicContact NH2-OE2 2.97Å; R84-E131 PolarHBondContact NH2-OE2 2.82Å; L85-E131 VanDerWaalsContact O-CA 3.24Å; L85-E131 WeakPolarHBondContact O-CA 3.46Å; L85-E131 WeakPolarHBondContact O-CB 3.26Å; R86-E131 HydrophobicContact CB-CG 4.49Å; R86-E131 WeakPolarHBondContact CD-OE1 3.47Å; R86-E131 HydrophobicContact CG-CG 4.09Å; R86-E131 WeakPolarHBondContact CG-OE1 3.44Å; R86-E131 IonicContact CZ-OE1 3.46Å; R86-E131 IonicContact NE-OE1 2.69Å; R86-E131 PolarHBondContact NE-OE1 3.43Å; R86-E131 IonicContact NH2-OE1 3.58Å; C118-E131 PolarHBondContact N-O 3.18Å; C118-E131 VanDerWaalsContact SG-C 3.55Å; C118-E131 PolarHBondContact SG-O 3.38Å; C118-E131 VanDerWaalsContact SG-O 3.39Å; S119-E131 PolarHBondContact OG-N 3.33Å; L123-E131 HydrophobicContact CD2-CG 4.08Å; I129-E131 HydrophobicContact CG2-CG 4.03Å
132	L	98.9	Very high	97.6	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	145	176.1	-57.2	179.6	0	0	0	109.5	R84 L85 L87 V102 F104 F115 I117 L130 V134	R84-L132 CarbonylContact C-O 3.59Å; R84-L132 WeakPolarHBondContact CA-O 3.4Å; L85-L132 PolarHBondContact N-O 3.21Å; L85-L132 PolarHBondContact O-N 3.38Å; L85-L132 VanDerWaalsContact O-N 3.09Å; L87-L132 HydrophobicContact CD1-CD1 3.76Å; L87-L132 HydrophobicContact CD1-CG 4Å; V102-L132 HydrophobicContact CG2-CD1 4Å; V102-L132 HydrophobicContact CG2-CD2 3.87Å; F104-L132 HydrophobicContact CD2-CD1 3.68Å; F104-L132 HydrophobicContact CE2-CD1 3.85Å; F115-L132 HydrophobicContact CB-CD1 4.03Å; F115-L132 HydrophobicContact CB-CD2 4.05Å; F115-L132 HydrophobicContact CB-CG 4.5Å; F115-L132 HydrophobicContact CD2-CD1 4.21Å; F115-L132 HydrophobicContact CG-CD1 4.5Å; I117-L132 HydrophobicContact CG1-CD2 4.37Å; L130-L132 HydrophobicContact CD2-CD2 3.77Å; L130-L132 HydrophobicContact CD2-CG 3.97Å; L132-V134 HydrophobicContact CB-CG2 4.21Å
133	A	98.6	Very high	97.6	Very high	3 Å²	3	50.8 Å²	50.8	3%	0.025	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	104.6	170.4	0	0	0	0	0	110.4	V82 K83 N186 F228	V82-A133 HydrophobicContact CG1-CB 3.96Å; K83-A133 CarbonylContact O-C 3.57Å; K83-A133 WeakPolarHBondContact O-CA 3.35Å; A133-N186 PolarHBondContact O-ND2 3.37Å; A133-F228 HydrophobicContact CB-CE1 4.35Å; A133-F228 HydrophobicContact CB-CZ 3.64Å
134	V	98.4	Very high	97.6	Very high	4 Å²	4	50.8 Å²	50.8	2%	0.024	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	122.9	-167.1	-178.5	0	0	0	0	110.6	V82 K83 F115 L132 A142 I145 H146	V82-V134 WeakPolarHBondContact CA-O 3.42Å; K83-V134 PolarHBondContact N-O 2.98Å; K83-V134 PolarHBondContact O-N 2.64Å; F115-V134 HydrophobicContact CB-CG2 4.43Å; F115-V134 HydrophobicContact CD1-CB 4.44Å; F115-V134 HydrophobicContact CD1-CG1 4Å; F115-V134 HydrophobicContact CD1-CG2 3.68Å; F115-V134 HydrophobicContact CD2-CG2 4.2Å; F115-V134 HydrophobicContact CE1-CB 4.32Å; F115-V134 HydrophobicContact CE1-CG1 3.44Å; F115-V134 VanDerWaalsContact CE1-CG1 3.44Å; F115-V134 HydrophobicContact CE1-CG2 3.92Å; F115-V134 HydrophobicContact CE2-CG2 4.39Å; F115-V134 HydrophobicContact CG-CG2 3.84Å; F115-V134 HydrophobicContact CZ-CG1 3.83Å; F115-V134 HydrophobicContact CZ-CG2 4.26Å; L132-V134 HydrophobicContact CB-CG2 4.21Å; V134-A142 HydrophobicContact CG1-CB 3.86Å; V134-I145 HydrophobicContact CB-CD1 4.16Å; V134-I145 HydrophobicContact CB-CG2 4.28Å; V134-I145 HydrophobicContact CG1-CD1 4.1Å; V134-I145 HydrophobicContact CG2-CD1 3.79Å; V134-H146 PolarHBondContact O-NE2 3.44Å
135	K	97.4	Very high	97.6	Very high	67 Å²	67	50.2 Å²	50.2	29%	0.291	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	140.3	172.6	-170.7	163.7	-164.9	149.8	0	111	T81 V82 A137 V183 E225	T81-K135 CarbonylContact O-C 3.52Å; T81-K135 WeakPolarHBondContact O-CA 3.43Å; T81-K135 WeakPolarHBondContact OG1-CE 3.4Å; V82-K135 HydrophobicContact CG2-CB 4.06Å; V82-K135 HydrophobicContact CG2-CG 4.21Å; K135-A137 PolarHBondContact O-N 2.91Å; K135-V183 HydrophobicContact CB-CG1 3.72Å; K135-V183 HydrophobicContact CD-CG1 4.38Å; K135-E225 IonicContact NZ-OE2 2.76Å; K135-E225 PolarHBondContact NZ-OE2 2.96Å
136	R	97.1	Very high	97.6	Very high	143 Å²	143	43.9 Å²	43.9	54%	0.54	22%	0.221	S	C	.	.			trans	-58.8	127.8	174.6	-169.6	176.5	-63.1	-148.5	6.2	109.9	T81 H146	T81-R136 PolarHBondContact O-N 2.91Å; R136-H146 HydrophobicContact CG-CB 4.22Å; R136-H146 PolarHBondContact N-NE2 3.38Å; R136-H146 PolarHBondContact NE-ND1 2.83Å
137	A	95.4	Very high	97.7	Very high	43 Å²	43	39.8 Å²	39.8	36%	0.355	21%	0.214	S	C	.	.			trans	-149.5	167	175.1	0	0	0	0	0	110.2	K135 H139 A142 H143	K135-A137 PolarHBondContact O-N 2.91Å; A137-H139 HydrophobicContact CB-CB 4.27Å; A137-H139 PolarHBondContact O-N 3.22Å; A137-A142 HydrophobicContact CB-CB 4.06Å; A137-H143 PolarHBondContact O-N 2.81Å
138	V	94.8	Very high	97.7	Very high	125 Å²	125	41.8 Å²	41.8	76%	0.758	22%	0.221	S	C	*	.	S	Bend	trans	-75.6	-11.1	170.8	-61.7	0	0	0	0	112.8
139	H	94.4	Very high	97.7	Very high	64 Å²	64	41.1 Å²	41.1	30%	0.296	21%	0.212	S	C	.	.	S	Bend	trans	-59.3	126.4	175.9	177.4	-120.7	0	0	0	109.8	V111 A137 P141 A142 H143	V111-H139 WeakPolarHBondContact CG1-NE2 3.38Å; A137-H139 HydrophobicContact CB-CB 4.27Å; A137-H139 PolarHBondContact O-N 3.22Å; H139-P141 VanDerWaalsContact CE1-CD 3.45Å; H139-P141 WeakPolarHBondContact CE1-CD 3.48Å; H139-A142 HydrophobicContact CB-CB 4.36Å; H139-A142 PolarHBondContact O-N 2.89Å; H139-H143 PolarHBondContact O-N 3.46Å
140	P	96.9	Very high	97.7	Very high	58 Å²	58	44.3 Å²	44.3	38%	0.377	23%	0.233	S	C	.	.	H	α-helix	trans	-55.6	-45.3	-163.3	-23.9	31.6	0	0	0	115	V109 V111 A142 H143 W144	V109-P140 HydrophobicContact CG1-CB 4.01Å; V111-P140 HydrophobicContact CB-CB 4.45Å; V111-P140 HydrophobicContact CB-CG 4.31Å; V111-P140 HydrophobicContact CG2-CG 4.07Å; P140-A142 PolarHBondContact O-N 3.41Å; P140-H143 PolarHBondContact O-N 2.91Å; P140-W144 WeakPolarHBondContact O-CB 3.32Å; P140-W144 PolarHBondContact O-N 3.46Å
141	P	97.5	Very high	97.7	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-59.7	-42.7	174.3	-27.4	36.3	0	0	0	114.2	I106 V111 F115 H139 I145	I106-P141 HydrophobicContact CD1-CB 3.85Å; I106-P141 HydrophobicContact CD1-CG 4.49Å; V111-P141 HydrophobicContact CB-CG 4.38Å; V111-P141 HydrophobicContact CG1-CG 4.15Å; V111-P141 WeakPolarHBondContact O-CG 3.26Å; F115-P141 HydrophobicContact CE2-CB 4.06Å; F115-P141 HydrophobicContact CZ-CB 3.95Å; H139-P141 VanDerWaalsContact CE1-CD 3.45Å; H139-P141 WeakPolarHBondContact CE1-CD 3.48Å; P141-I145 VanDerWaalsContact O-CG1 3.26Å; P141-I145 WeakPolarHBondContact O-CG1 3.4Å; P141-I145 PolarHBondContact O-N 3.24Å
142	A	97.5	Very high	97.6	Very high	4 Å²	4	54.2 Å²	54.2	3%	0.033	29%	0.285	C	S	.	.	H	α-helix	trans	-71	-35.2	178.4	0	0	0	0	0	111.5	F115 V134 A137 H139 P140 H146	F115-A142 HydrophobicContact CE1-CB 4.4Å; F115-A142 HydrophobicContact CZ-CB 4.28Å; V134-A142 HydrophobicContact CG1-CB 3.86Å; A137-A142 HydrophobicContact CB-CB 4.06Å; H139-A142 HydrophobicContact CB-CB 4.36Å; H139-A142 PolarHBondContact O-N 2.89Å; P140-A142 PolarHBondContact O-N 3.41Å; A142-H146 PolarHBondContact O-CD2 2.84Å; A142-H146 PolarHBondContact O-N 2.95Å
143	H	97.9	Very high	97.6	Very high	85 Å²	85	55 Å²	55	39%	0.394	29%	0.291	S	S	.	.	H	α-helix	trans	-62.3	-53.1	173.8	-171.9	72.4	0	0	0	110.3	A137 H139 P140 I145 H146 T147	A137-H143 PolarHBondContact O-N 2.81Å; H139-H143 PolarHBondContact O-N 3.46Å; P140-H143 PolarHBondContact O-N 2.91Å; H143-I145 VanDerWaalsContact C-N 3.31Å; H143-I145 PolarHBondContact O-N 2.91Å; H143-H146 CarbonylContact O-C 3.45Å; H143-H146 WeakPolarHBondContact O-CA 3.35Å; H143-H146 PolarHBondContact O-N 3.11Å; H143-T147 PolarHBondContact O-N 3.36Å; H143-T147 PolarHBondContact O-OG1 3.46Å
144	W	98.5	Very high	97.6	Very high	28 Å²	28	59.9 Å²	59.9	11%	0.106	31%	0.313	C	S	.	.	H	α-helix	trans	-53.9	-44.8	178.1	-178.5	90.6	0	0	0	112.1	F104 I106 P140 H146 T147 E148 C149 V155	F104-W144 HydrophobicContact CE1-CE3 4.48Å; F104-W144 HydrophobicContact CE1-CZ3 4.21Å; F104-W144 HydrophobicContact CZ-CZ3 4.46Å; I106-W144 HydrophobicContact CD1-CB 4.17Å; I106-W144 HydrophobicContact CD1-CD2 3.9Å; I106-W144 HydrophobicContact CD1-CE3 3.61Å; I106-W144 HydrophobicContact CD1-CG 4.12Å; I106-W144 HydrophobicContact CD1-CZ3 4.33Å; I106-W144 HydrophobicContact CG1-CD2 4.35Å; I106-W144 HydrophobicContact CG1-CE3 4Å; I106-W144 HydrophobicContact CG1-CZ3 4.26Å; I106-W144 HydrophobicContact CG2-CD2 3.71Å; I106-W144 HydrophobicContact CG2-CE3 4.1Å; I106-W144 HydrophobicContact CG2-CG 4.14Å; I106-W144 HydrophobicContact CG2-CH2 4.27Å; I106-W144 HydrophobicContact CG2-CZ2 3.89Å; I106-W144 HydrophobicContact CG2-CZ3 4.36Å; P140-W144 WeakPolarHBondContact O-CB 3.32Å; P140-W144 PolarHBondContact O-N 3.46Å; W144-H146 PolarHBondContact O-N 3.11Å; W144-T147 PolarHBondContact O-N 2.82Å; W144-E148 VanDerWaalsContact CD1-OE2 3.25Å; W144-E148 HydrophobicContact CG-CB 4.09Å; W144-E148 PolarHBondContact O-N 3.49Å; W144-C149 HydrophobicContact CD2-CB 4.35Å; W144-C149 HydrophobicContact CE3-CB 3.8Å; W144-C149 HydrophobicContact CH2-CB 3.72Å; W144-C149 HydrophobicContact CZ2-CB 4.28Å; W144-C149 HydrophobicContact CZ3-CB 3.46Å; W144-C149 VanDerWaalsContact CZ3-CB 3.46Å; W144-C149 PolarHBondContact O-N 2.92Å; W144-V155 HydrophobicContact CH2-CG1 4.24Å; W144-V155 HydrophobicContact CZ3-CG1 4.35Å
145	I	98.6	Very high	97.6	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-57	-36	174.2	-71.2	172.1	0	0	0	112	K83 L85 F104 F115 V134 P141 H143	K83-I145 HydrophobicContact CB-CG2 4.34Å; K83-I145 WeakPolarHBondContact CD-O 3.38Å; K83-I145 PolarHBondContact NZ-O 3.29Å; K83-I145 VanDerWaalsContact NZ-O 3.17Å; L85-I145 HydrophobicContact CD1-CD1 3.88Å; L85-I145 HydrophobicContact CD1-CG1 3.92Å; L85-I145 HydrophobicContact CD1-CG2 3.91Å; L85-I145 HydrophobicContact CD2-CG2 4.2Å; L85-I145 HydrophobicContact CG-CG2 4.19Å; F104-I145 HydrophobicContact CD1-CD1 4.46Å; F104-I145 HydrophobicContact CE1-CD1 4Å; F104-I145 HydrophobicContact CE1-CG1 4.22Å; F104-I145 HydrophobicContact CZ-CD1 4.3Å; F115-I145 HydrophobicContact CD2-CD1 4.34Å; F115-I145 HydrophobicContact CE2-CD1 3.67Å; F115-I145 HydrophobicContact CZ-CD1 3.95Å; V134-I145 HydrophobicContact CB-CD1 4.16Å; V134-I145 HydrophobicContact CB-CG2 4.28Å; V134-I145 HydrophobicContact CG1-CD1 4.1Å; V134-I145 HydrophobicContact CG2-CD1 3.79Å; P141-I145 VanDerWaalsContact O-CG1 3.26Å; P141-I145 WeakPolarHBondContact O-CG1 3.4Å; P141-I145 PolarHBondContact O-N 3.24Å; H143-I145 VanDerWaalsContact C-N 3.31Å; H143-I145 PolarHBondContact O-N 2.91Å
146	H	98.5	Very high	97.7	Very high	13 Å²	13	57 Å²	57	6%	0.06	30%	0.303	C	S	.	.	H	α-helix	trans	-85.6	-24.8	-177	-82	-101.8	0	0	0	114.3	T81 K83 V134 R136 A142 H143 W144	T81-H146 PolarHBondContact O-CE1 2.94Å; K83-H146 VanDerWaalsContact NZ-C 3.29Å; K83-H146 PolarHBondContact NZ-O 3.46Å; V134-H146 PolarHBondContact O-NE2 3.44Å; R136-H146 HydrophobicContact CG-CB 4.22Å; R136-H146 PolarHBondContact N-NE2 3.38Å; R136-H146 PolarHBondContact NE-ND1 2.83Å; A142-H146 PolarHBondContact O-CD2 2.84Å; A142-H146 PolarHBondContact O-N 2.95Å; H143-H146 CarbonylContact O-C 3.45Å; H143-H146 WeakPolarHBondContact O-CA 3.35Å; H143-H146 PolarHBondContact O-N 3.11Å; W144-H146 PolarHBondContact O-N 3.11Å
147	T	97.9	Very high	97.7	Very high	77 Å²	77	50.2 Å²	50.2	47%	0.472	28%	0.277	S	S	.	.	H	α-helix	trans	-116.9	-32.4	-171.3	52.9	0	0	0	0	115	H143 W144	H143-T147 PolarHBondContact O-N 3.36Å; H143-T147 PolarHBondContact O-OG1 3.46Å; W144-T147 PolarHBondContact O-N 2.82Å
148	E	98.1	Very high	97.9	Very high	114 Å²	114	50.8 Å²	50.8	53%	0.533	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.4	-29.1	-166.9	-69.3	168.8	-117.4	0	0	113.1	W144 T150	W144-E148 VanDerWaalsContact CD1-OE2 3.25Å; W144-E148 HydrophobicContact CG-CB 4.09Å; W144-E148 PolarHBondContact O-N 3.49Å; E148-T150 PolarHBondContact O-N 3.37Å
149	C	98.4	Very high	98.1	Very high	10 Å²	10	44.8 Å²	44.8	7%	0.068	23%	0.234	C	C	.	.			trans	-61.3	125.1	-179.6	-179.8	0	0	0	0	112.1	W144	W144-C149 HydrophobicContact CD2-CB 4.35Å; W144-C149 HydrophobicContact CE3-CB 3.8Å; W144-C149 HydrophobicContact CH2-CB 3.72Å; W144-C149 HydrophobicContact CZ2-CB 4.28Å; W144-C149 HydrophobicContact CZ3-CB 3.46Å; W144-C149 VanDerWaalsContact CZ3-CB 3.46Å; W144-C149 PolarHBondContact O-N 2.92Å
150	T	98.5	Very high	98.2	Very high	84 Å²	84	41.8 Å²	41.8	52%	0.515	22%	0.22	S	C	.	.			trans	-121.4	172	175	64.7	0	0	0	0	111	E148 S153	E148-T150 PolarHBondContact O-N 3.37Å; T150-S153 PolarHBondContact N-OG 3.31Å; T150-S153 VanDerWaalsContact N-OG 3.08Å; T150-S153 VanDerWaalsContact O-CB 3.27Å; T150-S153 WeakPolarHBondContact O-CB 3.39Å; T150-S153 PolarHBondContact O-N 3.44Å; T150-S153 PolarHBondContact O-OG 2.92Å; T150-S153 PolarHBondContact OG1-OG 3.2Å
151	L	98.5	Very high	98.2	Very high	97 Å²	97	39 Å²	39	51%	0.508	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	148.4	163	-64.4	177.2	0	0	0	110.3	I75 S153	I75-L151 HydrophobicContact CG1-CD2 4.39Å; L151-S153 PolarHBondContact O-N 3.29Å; L151-S153 VanDerWaalsContact O-N 3.09Å
152	D	98.3	Very high	98.1	Very high	119 Å²	119	43 Å²	43	64%	0.636	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.8	3.5	-177.6	-55.4	-52.7	0	0	0	115.7	V72 E154	V72-D152 PolarHBondContact O-N 2.73Å; D152-E154 PolarHBondContact O-N 3.25Å
153	S	98.6	Very high	98.1	Very high	18 Å²	18	43.3 Å²	43.3	13%	0.126	22%	0.224	C	C	.	.			trans	-56.2	131.3	170.6	-68.6	0	0	0	0	110.3	K71 V72 T150 L151	K71-S153 WeakPolarHBondContact CA-O 3.33Å; V72-S153 PolarHBondContact N-O 2.85Å; T150-S153 PolarHBondContact N-OG 3.31Å; T150-S153 VanDerWaalsContact N-OG 3.08Å; T150-S153 VanDerWaalsContact O-CB 3.27Å; T150-S153 WeakPolarHBondContact O-CB 3.39Å; T150-S153 PolarHBondContact O-N 3.44Å; T150-S153 PolarHBondContact O-OG 2.92Å; T150-S153 PolarHBondContact OG1-OG 3.2Å; L151-S153 PolarHBondContact O-N 3.29Å; L151-S153 VanDerWaalsContact O-N 3.09Å
154	E	98.5	Very high	98.2	Very high	105 Å²	105	42.2 Å²	42.2	49%	0.491	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	134.9	-178.6	-57.6	-170.4	152.4	0	0	110.8	K71 P107 D152	K71-E154 HydrophobicContact CD-CG 4.47Å; K71-E154 WeakPolarHBondContact CE-OE1 3.03Å; K71-E154 HydrophobicContact CG-CG 4.32Å; K71-E154 IonicContact NZ-OE1 3.06Å; K71-E154 PolarHBondContact NZ-OE1 2.98Å; P107-E154 WeakPolarHBondContact CD-O 3.45Å; D152-E154 PolarHBondContact O-N 3.25Å
155	V	98.6	Very high	98.2	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	163.3	178.9	-61.9	0	0	0	0	109.3	Q69 A70 L87 F104 F105 I106 W144 L157	Q69-V155 PolarHBondContact OE1-O 3.43Å; A70-V155 HydrophobicContact CB-CG2 4.12Å; A70-V155 PolarHBondContact N-O 2.9Å; A70-V155 PolarHBondContact O-N 3.47Å; A70-V155 VanDerWaalsContact O-O 3.04Å; L87-V155 HydrophobicContact CD2-CG2 4.36Å; F104-V155 HydrophobicContact CE1-CB 4.48Å; F104-V155 HydrophobicContact CE1-CG1 3.93Å; F104-V155 HydrophobicContact CE2-CB 4.17Å; F104-V155 HydrophobicContact CE2-CG1 4.24Å; F104-V155 HydrophobicContact CE2-CG2 3.79Å; F104-V155 HydrophobicContact CZ-CB 4.02Å; F104-V155 HydrophobicContact CZ-CG1 3.59Å; F104-V155 HydrophobicContact CZ-CG2 3.99Å; F105-V155 WeakPolarHBondContact O-CA 3.18Å; F105-V155 WeakPolarHBondContact O-CB 3.34Å; I106-V155 HydrophobicContact CG1-CG1 4.42Å; W144-V155 HydrophobicContact CH2-CG1 4.24Å; W144-V155 HydrophobicContact CZ3-CG1 4.35Å; V155-L157 HydrophobicContact CG2-CD2 4.33Å
156	A	98.6	Very high	98.1	Very high	11 Å²	11	43.6 Å²	43.6	9%	0.091	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	149.8	168.8	0	0	0	0	0	110.7	I67 S68 F105	I67-A156 HydrophobicContact CG2-CB 3.77Å; S68-A156 CarbonylContact O-C 3.52Å; S68-A156 WeakPolarHBondContact O-CA 3.12Å; F105-A156 HydrophobicContact CB-CB 4.1Å; F105-A156 HydrophobicContact CD2-CB 4.28Å; F105-A156 WeakPolarHBondContact CD2-O 3.25Å; F105-A156 PolarHBondContact N-O 2.9Å; F105-A156 PolarHBondContact O-N 3.48Å
157	L	98.6	Very high	98	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	140.3	-175.1	-53.3	179	0	0	0	110.1	I67 S68 A70 L87 V89 F94 V102 D103 F104 L130 V155	I67-L157 WeakPolarHBondContact CA-O 3.09Å; S68-L157 PolarHBondContact N-O 2.98Å; S68-L157 PolarHBondContact O-N 3.38Å; A70-L157 HydrophobicContact CB-CD1 3.75Å; A70-L157 HydrophobicContact CB-CG 4.05Å; L87-L157 HydrophobicContact CD1-CD1 4.04Å; L87-L157 HydrophobicContact CD1-CD2 4.15Å; V89-L157 HydrophobicContact CG2-CD1 4.12Å; F94-L157 HydrophobicContact CE2-CB 4.26Å; F94-L157 HydrophobicContact CZ-CB 3.81Å; V102-L157 HydrophobicContact CB-CB 4.5Å; V102-L157 HydrophobicContact CB-CD2 4.4Å; V102-L157 HydrophobicContact CG1-CB 4.44Å; V102-L157 HydrophobicContact CG2-CD2 4.07Å; D103-L157 WeakPolarHBondContact O-CA 3.48Å; F104-L157 HydrophobicContact CD2-CD2 3.45Å; F104-L157 VanDerWaalsContact CD2-CD2 3.45Å; F104-L157 HydrophobicContact CE2-CD2 3.93Å; F104-L157 HydrophobicContact CG-CD2 4.44Å; L130-L157 HydrophobicContact CD2-CD1 4.44Å; V155-L157 HydrophobicContact CG2-CD2 4.33Å
158	R	98.4	Very high	97.9	Very high	54 Å²	54	44.5 Å²	44.5	20%	0.204	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	126.7	166.5	177.1	172.4	64.8	-177.8	2.5	109.3	Q64 I67 V102 D103 F105	Q64-R158 WeakPolarHBondContact O-CD 3.37Å; Q64-R158 VanDerWaalsContact O-CG 3.25Å; Q64-R158 WeakPolarHBondContact O-CG 3.25Å; I67-R158 HydrophobicContact CG1-CB 4.19Å; I67-R158 HydrophobicContact CG1-CG 4.49Å; V102-R158 CarbonylContact C-O 3.58Å; V102-R158 VanDerWaalsContact CA-O 3.26Å; V102-R158 WeakPolarHBondContact CA-O 3.42Å; D103-R158 HydrophobicContact CB-CB 4.16Å; D103-R158 PolarHBondContact N-O 2.82Å; D103-R158 PolarHBondContact O-N 3.14Å; D103-R158 VanDerWaalsContact O-N 3.1Å; D103-R158 IonicContact OD2-CZ 2.85Å; D103-R158 IonicContact OD2-NE 2.89Å; D103-R158 PolarHBondContact OD2-NE 3.43Å; D103-R158 IonicContact OD2-NH2 3.22Å; D103-R158 PolarHBondContact OD2-NH2 2.88Å; F105-R158 HydrophobicContact CE2-CB 3.93Å
159	V	98.4	Very high	97.7	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	138.7	179.9	-178.5	0	0	0	0	110.3	R63 Q64 F94 F96 Q100 V102	R63-V159 WeakPolarHBondContact CA-O 3.49Å; Q64-V159 HydrophobicContact CG-CB 4.11Å; Q64-V159 PolarHBondContact N-O 3.29Å; F94-V159 HydrophobicContact CD1-CG2 4.49Å; F94-V159 HydrophobicContact CE1-CG2 3.63Å; F94-V159 HydrophobicContact CE2-CG2 3.87Å; F94-V159 HydrophobicContact CZ-CG2 3.28Å; F96-V159 HydrophobicContact CB-CG1 3.84Å; F96-V159 HydrophobicContact CB-CG2 3.94Å; Q100-V159 HydrophobicContact CB-CG1 4.03Å; Q100-V159 HydrophobicContact CG-CG1 4.43Å; Q100-V159 VanDerWaalsContact OE1-CG1 3.27Å; V102-V159 HydrophobicContact CG1-CG2 4.47Å
160	G	97.7	Very high	97.6	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	177	168.6	0	0	0	0	0	112.9	F62 Q100 W101	F62-G160 CarbonylContact O-C 2.93Å; F62-G160 WeakPolarHBondContact O-CA 3.49Å; Q100-G160 WeakPolarHBondContact CB-O 3.38Å; W101-G160 VanDerWaalsContact CE2-C 3.45Å; W101-G160 PolarHBondContact N-O 2.78Å; W101-G160 PolarHBondContact O-N 3.23Å; W101-G160 VanDerWaalsContact O-O 3.09Å
161	G	96.4	Very high	97.5	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.248	C	C	.	.			trans	102.6	147.6	177.5	0	0	0	0	0	113.9	F62 Q100 W101	F62-G161 PolarHBondContact O-N 2.89Å; Q100-G161 PolarHBondContact NE2-O 3.23Å; W101-G161 VanDerWaalsContact NE1-CA 3.28Å
162	D	96.1	Very high	97.3	Very high	83 Å²	83	47.6 Å²	47.6	44%	0.444	25%	0.253	S	S	.	.	S	Bend	trans	-107	-0	-177.5	-53	-71.4	0	0	0	112	N61 F62 F164	N61-D162 VanDerWaalsContact CA-OD2 3.25Å; N61-D162 WeakPolarHBondContact CA-OD2 3.38Å; N61-D162 WeakPolarHBondContact CB-OD2 3.48Å; N61-D162 PolarHBondContact ND2-OD2 2.79Å; F62-D162 WeakPolarHBondContact CB-OD1 3.26Å; F62-D162 PolarHBondContact N-OD1 2.92Å; F62-D162 PolarHBondContact N-OD2 3.1Å; D162-F164 PolarHBondContact O-N 2.97Å
163	F	97.8	Very high	97.2	Very high	11 Å²	11	44.8 Å²	44.8	5%	0.048	24%	0.241	C	C	.	.			trans	-90.3	92.4	179.3	-176.4	-102.3	0	0	0	110	G99 Q100 P187 L188 I191 Y285 C287 F311 E313	G99-F163 CarbonylContact C-O 3.53Å; G99-F163 VanDerWaalsContact CA-O 3.29Å; G99-F163 WeakPolarHBondContact CA-O 3.48Å; Q100-F163 PolarHBondContact N-O 3Å; F163-P187 HydrophobicContact CD1-CB 3.97Å; F163-P187 HydrophobicContact CD1-CG 4.3Å; F163-P187 HydrophobicContact CE1-CB 3.88Å; F163-P187 HydrophobicContact CE1-CG 3.96Å; F163-L188 HydrophobicContact CE1-CD2 3.88Å; F163-L188 HydrophobicContact CZ-CD2 3.75Å; F163-I191 HydrophobicContact CE1-CD1 4.4Å; F163-Y285 HydrophobicContact CD2-CD1 4.18Å; F163-Y285 HydrophobicContact CE1-CD1 4.3Å; F163-Y285 AromaticContact CE2-CD1 3.55Å; F163-Y285 HydrophobicContact CE2-CD1 3.55Å; F163-Y285 HydrophobicContact CE2-CE1 4.4Å; F163-Y285 HydrophobicContact CE2-CG 4.32Å; F163-Y285 AromaticContact CZ-CD1 3.64Å; F163-Y285 HydrophobicContact CZ-CD1 3.64Å; F163-Y285 HydrophobicContact CZ-CG 4.27Å; F163-C287 HydrophobicContact CE1-CB 4.22Å; F163-C287 HydrophobicContact CZ-CB 4.24Å; F163-F311 HydrophobicContact CD2-CB 4.18Å; F163-F311 HydrophobicContact CE2-CB 4.02Å; F163-E313 HydrophobicContact CB-CB 3.95Å; F163-E313 HydrophobicContact CD1-CB 3.98Å; F163-E313 HydrophobicContact CD2-CB 3.99Å; F163-E313 HydrophobicContact CE1-CB 4.45Å; F163-E313 HydrophobicContact CE2-CB 4.46Å; F163-E313 HydrophobicContact CG-CB 3.7Å
164	F	98.4	Very high	97.1	Very high	62 Å²	62	45.3 Å²	45.3	27%	0.272	24%	0.243	S	C	.	.			trans	-149.3	160.9	179.1	58.9	-97.2	0	0	0	113.4	K97 A98 Q100 D162 D166 Y285	K97-F164 HydrophobicContact CB-CB 3.72Å; K97-F164 HydrophobicContact CB-CD1 4.4Å; K97-F164 HydrophobicContact CB-CD2 3.99Å; K97-F164 HydrophobicContact CB-CG 3.78Å; K97-F164 HydrophobicContact CD-CD1 4.17Å; K97-F164 HydrophobicContact CD-CD2 3.51Å; K97-F164 HydrophobicContact CD-CE1 4.15Å; K97-F164 HydrophobicContact CD-CE2 3.49Å; K97-F164 VanDerWaalsContact CD-CE2 3.49Å; K97-F164 HydrophobicContact CD-CG 3.87Å; K97-F164 HydrophobicContact CD-CZ 3.82Å; K97-F164 HydrophobicContact CG-CD2 4.4Å; K97-F164 HydrophobicContact CG-CG 4.49Å; A98-F164 CarbonylContact O-C 3.57Å; A98-F164 WeakPolarHBondContact O-CA 3.43Å; A98-F164 VanDerWaalsContact O-CB 3.25Å; A98-F164 WeakPolarHBondContact O-CB 3.31Å; Q100-F164 HydrophobicContact CG-CB 4.24Å; Q100-F164 HydrophobicContact CG-CD1 4.21Å; D162-F164 PolarHBondContact O-N 2.97Å; F164-D166 HydrophobicContact CD2-CB 3.65Å; F164-D166 HydrophobicContact CE2-CB 3.92Å; F164-Y285 VanDerWaalsContact O-CE1 3.31Å; F164-Y285 WeakPolarHBondContact O-CE1 3.18Å; F164-Y285 PolarHBondContact O-OH 3.07Å
165	F	98.3	Very high	97.1	Very high	9 Å²	9	43.9 Å²	43.9	4%	0.039	24%	0.236	C	C	.	.			trans	-115.7	116	167.6	-177.8	-107.7	0	0	0	109	A98 P167 V174 L176 I191 I195 Y209 L283 Y285	A98-F165 PolarHBondContact O-N 3.48Å; F165-P167 HydrophobicContact CD1-CG 4.25Å; F165-P167 HydrophobicContact CE1-CB 4.31Å; F165-P167 VanDerWaalsContact CE1-CD 3.47Å; F165-P167 HydrophobicContact CE1-CG 3.51Å; F165-P167 HydrophobicContact CE2-CB 4.44Å; F165-P167 HydrophobicContact CE2-CG 4.45Å; F165-P167 HydrophobicContact CZ-CB 3.91Å; F165-P167 HydrophobicContact CZ-CG 3.62Å; F165-V174 HydrophobicContact CE2-CG2 3.93Å; F165-V174 HydrophobicContact CZ-CG2 4.12Å; F165-L176 HydrophobicContact CD1-CD1 4.09Å; F165-L176 HydrophobicContact CD2-CD1 4.2Å; F165-L176 HydrophobicContact CD2-CD2 4.15Å; F165-L176 HydrophobicContact CE1-CD1 3.88Å; F165-L176 HydrophobicContact CE2-CD1 4.02Å; F165-L176 HydrophobicContact CE2-CD2 3.95Å; F165-L176 HydrophobicContact CG-CD1 4.24Å; F165-L176 HydrophobicContact CZ-CD1 3.86Å; F165-L176 HydrophobicContact CZ-CD2 4.5Å; F165-I191 HydrophobicContact CB-CD1 4.09Å; F165-I191 HydrophobicContact CB-CG1 3.96Å; F165-I191 HydrophobicContact CB-CG2 3.82Å; F165-I191 HydrophobicContact CD1-CG2 4.28Å; F165-I191 HydrophobicContact CG-CG2 4.3Å; F165-I195 HydrophobicContact CD1-CD1 4.24Å; F165-I195 HydrophobicContact CD1-CG1 3.91Å; F165-I195 HydrophobicContact CE1-CD1 4.32Å; F165-I195 HydrophobicContact CE1-CG1 3.79Å; F165-Y209 HydrophobicContact CE1-CE1 4.28Å; F165-Y209 HydrophobicContact CZ-CE1 4.11Å; F165-L283 HydrophobicContact CE2-CD1 4.48Å; F165-Y285 HydrophobicContact CB-CE1 4.45Å; F165-Y285 HydrophobicContact CD2-CE2 4.23Å
166	D	96.5	Very high	97.1	Very high	48 Å²	48	44.1 Å²	44.1	26%	0.257	24%	0.237	S	C	.	.			trans	-144.1	71.5	-173.3	179.4	35.2	0	0	0	110	K97 F164	K97-D166 HydrophobicContact CB-CB 4.49Å; K97-D166 HydrophobicContact CD-CB 3.89Å; K97-D166 WeakPolarHBondContact CD-OD2 2.98Å; K97-D166 WeakPolarHBondContact CE-OD2 3.43Å; K97-D166 HydrophobicContact CG-CB 4.38Å; K97-D166 IonicContact NZ-OD2 3.73Å; K97-D166 PolarHBondContact NZ-OD2 3.39Å; F164-D166 HydrophobicContact CD2-CB 3.65Å; F164-D166 HydrophobicContact CE2-CB 3.92Å
167	P	96.9	Very high	97.1	Very high	12 Å²	12	43.7 Å²	43.7	8%	0.078	23%	0.233	C	C	.	.			trans	-72.7	144	-179.3	33.4	-36.8	0	0	0	110.7	F165 D171 L198 Y209	F165-P167 HydrophobicContact CD1-CG 4.25Å; F165-P167 HydrophobicContact CE1-CB 4.31Å; F165-P167 VanDerWaalsContact CE1-CD 3.47Å; F165-P167 HydrophobicContact CE1-CG 3.51Å; F165-P167 HydrophobicContact CE2-CB 4.44Å; F165-P167 HydrophobicContact CE2-CG 4.45Å; F165-P167 HydrophobicContact CZ-CB 3.91Å; F165-P167 HydrophobicContact CZ-CG 3.62Å; P167-D171 HydrophobicContact CB-CB 4.44Å; P167-L198 HydrophobicContact CG-CD1 3.62Å; P167-Y209 HydrophobicContact CB-CD1 4.09Å; P167-Y209 HydrophobicContact CB-CD2 3.5Å; P167-Y209 VanDerWaalsContact CB-CD2 3.5Å; P167-Y209 HydrophobicContact CB-CE1 4.12Å; P167-Y209 HydrophobicContact CB-CE2 3.54Å; P167-Y209 HydrophobicContact CB-CG 3.77Å; P167-Y209 HydrophobicContact CG-CD1 3.59Å; P167-Y209 HydrophobicContact CG-CD2 3.95Å; P167-Y209 HydrophobicContact CG-CE1 3.77Å; P167-Y209 HydrophobicContact CG-CE2 4.12Å; P167-Y209 HydrophobicContact CG-CG 3.66Å
168	Q	96.1	Very high	97.1	Very high	97 Å²	97	43.7 Å²	43.7	45%	0.453	23%	0.233	S	C	.	.			trans	-81.3	157.4	173	-59.3	-54	-65	0	0	111	D170 D171	Q168-D170 PolarHBondContact O-N 2.93Å; Q168-D170 VanDerWaalsContact O-N 3.1Å; Q168-D171 PolarHBondContact N-OD2 2.94Å; Q168-D171 WeakPolarHBondContact O-CB 3.38Å; Q168-D171 PolarHBondContact O-N 3.26Å
169	P	94.8	Very high	97.2	Very high	71 Å²	71	41.1 Å²	41.1	46%	0.461	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.4	-36.9	-177.4	-31.8	37.7	0	0	0	115.1	G208 Y209	P169-G208 CarbonylContact O-C 3.36Å; P169-Y209 WeakPolarHBondContact O-CA 3.37Å; P169-Y209 PolarHBondContact O-N 3.08Å
170	D	94.8	Very high	97.2	Very high	161 Å²	161	41.1 Å²	41.1	86%	0.861	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.4	1.7	-177.3	-57.3	-43.8	0	0	0	113.3	Q168	Q168-D170 PolarHBondContact O-N 2.93Å; Q168-D170 VanDerWaalsContact O-N 3.1Å
171	D	96.4	Very high	97.2	Very high	44 Å²	44	41.3 Å²	41.3	24%	0.235	23%	0.225	C	C	.	.	S	Bend	trans	-62.6	141.8	175.5	-81.8	-17.7	0	0	0	110	R33 P167 Q168 Y209	R33-D171 IonicContact NH2-OD1 2.65Å; R33-D171 IonicContact NH2-OD2 3.92Å; R33-D171 PolarHBondContact NH2-OD2 2.95Å; P167-D171 HydrophobicContact CB-CB 4.44Å; Q168-D171 PolarHBondContact N-OD2 2.94Å; Q168-D171 WeakPolarHBondContact O-CB 3.38Å; Q168-D171 PolarHBondContact O-N 3.26Å; D171-Y209 HydrophobicContact CB-CD2 4.23Å; D171-Y209 HydrophobicContact CB-CE2 4.25Å
172	P	95.5	Very high	97.2	Very high	94 Å²	94	42.2 Å²	42.2	61%	0.61	24%	0.235	S	C	*	.	P	Polyproline II helix	trans	-65.1	147.1	176.4	28	-34.5	0	0	0	110.9	V174	P172-V174 PolarHBondContact O-N 2.98Å
173	P	95.7	Very high	97.3	Very high	61 Å²	61	39.1 Å²	39.1	40%	0.396	22%	0.219	S	C	.	.	P	Polyproline II helix	trans	-61.9	132.7	176	25.7	-33.9	0	0	0	110.5	K210	P173-K210 WeakPolarHBondContact CB-O 3.37Å
174	V	97.1	Very high	97.3	Very high	28 Å²	28	38.7 Å²	38.7	17%	0.17	22%	0.217	C	C	.	.			trans	-110.8	157.2	174	-63.8	0	0	0	0	112.1	F165 P172 L176 Y209 G212 D281 L283	F165-V174 HydrophobicContact CE2-CG2 3.93Å; F165-V174 HydrophobicContact CZ-CG2 4.12Å; P172-V174 PolarHBondContact O-N 2.98Å; V174-L176 HydrophobicContact CG2-CD2 3.78Å; V174-L176 HydrophobicContact CG2-CG 4.15Å; V174-Y209 WeakPolarHBondContact CG2-OH 3.5Å; V174-Y209 PolarHBondContact N-OH 3.29Å; V174-G212 WeakPolarHBondContact O-CA 3.29Å; V174-D281 WeakPolarHBondContact CB-O 3.3Å; V174-L283 HydrophobicContact CB-CD1 4.38Å; V174-L283 HydrophobicContact CB-CG 4.33Å; V174-L283 HydrophobicContact CG1-CD1 4.34Å; V174-L283 HydrophobicContact CG1-CG 4.45Å; V174-L283 HydrophobicContact CG2-CD1 3.98Å; V174-L283 HydrophobicContact CG2-CG 4.34Å
175	K	98.3	Very high	97.3	Very high	75 Å²	75	35.7 Å²	35.7	33%	0.326	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	132.9	165.1	-58.7	-178.1	-173.8	117.3	0	108.5	T213 D281 T282 L283	K175-T213 CarbonylContact C-O 3.55Å; K175-T213 WeakPolarHBondContact CA-O 3.37Å; K175-D281 VanDerWaalsContact CE-OD2 3.31Å; K175-D281 WeakPolarHBondContact CE-OD2 3.37Å; K175-D281 PolarHBondContact N-O 3.21Å; K175-D281 VanDerWaalsContact NZ-CG 3.3Å; K175-D281 IonicContact NZ-OD1 3.12Å; K175-D281 PolarHBondContact NZ-OD1 3.09Å; K175-D281 IonicContact NZ-OD2 2.82Å; K175-D281 PolarHBondContact NZ-OD2 3.47Å; K175-T282 HydrophobicContact CB-CG2 4.39Å; K175-T282 CarbonylContact O-C 3.55Å; K175-T282 VanDerWaalsContact O-CA 3.29Å; K175-T282 WeakPolarHBondContact O-CA 3.49Å; K175-L283 PolarHBondContact O-N 3.27Å
176	L	98.6	Very high	97.3	Very high	5 Å²	5	35.6 Å²	35.6	3%	0.026	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	128.4	177.3	-63.8	179.1	0	0	0	110.1	F165 V174 L178 I195 T213 V214 K215 L283 Y285	F165-L176 HydrophobicContact CD1-CD1 4.09Å; F165-L176 HydrophobicContact CD2-CD1 4.2Å; F165-L176 HydrophobicContact CD2-CD2 4.15Å; F165-L176 HydrophobicContact CE1-CD1 3.88Å; F165-L176 HydrophobicContact CE2-CD1 4.02Å; F165-L176 HydrophobicContact CE2-CD2 3.95Å; F165-L176 HydrophobicContact CG-CD1 4.24Å; F165-L176 HydrophobicContact CZ-CD1 3.86Å; F165-L176 HydrophobicContact CZ-CD2 4.5Å; V174-L176 HydrophobicContact CG2-CD2 3.78Å; V174-L176 HydrophobicContact CG2-CG 4.15Å; L176-L178 HydrophobicContact CB-CD2 4.21Å; L176-I195 HydrophobicContact CD1-CD1 3.3Å; L176-I195 HydrophobicContact CD1-CG1 4.16Å; L176-T213 PolarHBondContact N-O 2.74Å; L176-V214 HydrophobicContact CB-CG1 4.26Å; L176-V214 HydrophobicContact CB-CG2 4.31Å; L176-V214 HydrophobicContact CD1-CG2 4.38Å; L176-V214 CarbonylContact O-C 3.55Å; L176-V214 WeakPolarHBondContact O-CA 3.35Å; L176-K215 PolarHBondContact O-N 2.69Å; L176-L283 WeakPolarHBondContact CA-O 3.41Å; L176-L283 HydrophobicContact CD2-CB 3.78Å; L176-L283 HydrophobicContact CD2-CD1 4.18Å; L176-L283 HydrophobicContact CD2-CG 4.32Å; L176-Y285 HydrophobicContact CD2-CD2 4.29Å; L176-Y285 HydrophobicContact CD2-CE2 4.06Å
177	V	98.8	Very high	97.4	Very high	2 Å²	2	33.3 Å²	33.3	1%	0.012	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	111.1	166.2	-175.4	0	0	0	0	108.3	I179 K215 Y217 H277 T282 L283 W284 Y285	V177-I179 HydrophobicContact CG1-CD1 4.23Å; V177-I179 HydrophobicContact CG1-CG1 3.96Å; V177-K215 CarbonylContact C-O 3.44Å; V177-K215 WeakPolarHBondContact CA-O 3.39Å; V177-K215 HydrophobicContact CG2-CB 4.48Å; V177-Y217 HydrophobicContact CG1-CD2 3.91Å; V177-Y217 HydrophobicContact CG1-CE2 4.1Å; V177-H277 HydrophobicContact CG2-CB 3.62Å; V177-T282 HydrophobicContact CB-CG2 4.49Å; V177-T282 HydrophobicContact CG2-CG2 3.68Å; V177-L283 PolarHBondContact N-O 3.43Å; V177-W284 HydrophobicContact CB-CD2 4.04Å; V177-W284 HydrophobicContact CB-CE3 3.51Å; V177-W284 HydrophobicContact CB-CH2 4.4Å; V177-W284 HydrophobicContact CB-CZ3 3.73Å; V177-W284 HydrophobicContact CG1-CE3 3.58Å; V177-W284 HydrophobicContact CG1-CH2 4.38Å; V177-W284 HydrophobicContact CG1-CZ3 3.48Å; V177-W284 VanDerWaalsContact CG1-CZ3 3.48Å; V177-W284 HydrophobicContact CG2-CD2 4.41Å; V177-W284 HydrophobicContact CG2-CE3 4.08Å; V177-W284 HydrophobicContact CG2-CH2 4.1Å; V177-W284 HydrophobicContact CG2-CZ2 4.4Å; V177-W284 HydrophobicContact CG2-CZ3 3.93Å; V177-W284 WeakPolarHBondContact O-CA 3.21Å; V177-Y285 PolarHBondContact O-N 3.45Å
178	L	98.9	Very high	97.5	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	125.3	179.5	-47.8	-176.5	0	0	0	108.3	L176 L188 I191 L192 V214 K215 L216 Y217 Y285	L176-L178 HydrophobicContact CB-CD2 4.21Å; L178-L188 HydrophobicContact CB-CB 4.39Å; L178-L188 HydrophobicContact CB-CD1 4.2Å; L178-L188 HydrophobicContact CB-CD2 4.3Å; L178-L188 HydrophobicContact CD2-CD2 4.31Å; L178-I191 HydrophobicContact CD1-CG2 4.3Å; L178-I191 HydrophobicContact CD2-CG2 4.21Å; L178-L192 HydrophobicContact CD1-CB 4.34Å; L178-L192 HydrophobicContact CD1-CD1 4.39Å; L178-V214 HydrophobicContact CD1-CG1 3.75Å; L178-V214 HydrophobicContact CG-CG1 3.97Å; L178-K215 PolarHBondContact N-O 3.15Å; L178-L216 HydrophobicContact CB-CD1 3.81Å; L178-L216 CarbonylContact O-C 3.57Å; L178-L216 WeakPolarHBondContact O-CA 3.34Å; L178-Y217 PolarHBondContact O-N 2.7Å; L178-Y285 CarbonylContact C-O 3.49Å; L178-Y285 WeakPolarHBondContact CA-O 3.4Å; L178-Y285 HydrophobicContact CD2-CD2 4.34Å; L178-Y285 HydrophobicContact CD2-CG 4.32Å
179	I	98.9	Very high	97.7	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	104.5	-176	-51.4	-177.7	0	0	0	109.1	V177 L188 Y217 I269 L274 W284 Y285 I286 C287 M292 I296	V177-I179 HydrophobicContact CG1-CD1 4.23Å; V177-I179 HydrophobicContact CG1-CG1 3.96Å; I179-L188 WeakPolarHBondContact O-CD1 3.46Å; I179-Y217 CarbonylContact C-O 3.49Å; I179-Y217 WeakPolarHBondContact CA-O 3.4Å; I179-I269 HydrophobicContact CG2-CD1 3.64Å; I179-L274 HydrophobicContact CD1-CD1 4.01Å; I179-L274 HydrophobicContact CD1-CD2 4Å; I179-W284 HydrophobicContact CD1-CE3 4.01Å; I179-W284 HydrophobicContact CD1-CZ3 4.27Å; I179-Y285 PolarHBondContact N-O 3.08Å; I179-I286 HydrophobicContact CB-CG1 4.31Å; I179-I286 HydrophobicContact CB-CG2 4.21Å; I179-I286 HydrophobicContact CD1-CG1 4.36Å; I179-I286 HydrophobicContact CG2-CG2 4.43Å; I179-I286 WeakPolarHBondContact O-CA 3.41Å; I179-C287 PolarHBondContact O-N 2.86Å; I179-M292 HydrophobicContact CB-CE 4.48Å; I179-M292 HydrophobicContact CG2-CE 3.43Å; I179-M292 VanDerWaalsContact CG2-CE 3.43Å; I179-I296 HydrophobicContact CD1-CG2 3.65Å; I179-I296 HydrophobicContact CG2-CD1 4.43Å; I179-I296 HydrophobicContact CG2-CG1 4.33Å; I179-I296 HydrophobicContact CG2-CG2 4.44Å
180	A	98.7	Very high	97.9	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	140.9	-174.2	0	0	0	0	0	112.6	I185 L188 L216 Y217 Y218 S219 C287	A180-I185 HydrophobicContact CB-CB 3.95Å; A180-I185 HydrophobicContact CB-CD1 3.71Å; A180-I185 HydrophobicContact CB-CG1 4.41Å; A180-L188 HydrophobicContact CB-CD1 3.63Å; A180-L216 HydrophobicContact CB-CD1 4.32Å; A180-Y217 PolarHBondContact N-O 2.96Å; A180-Y218 HydrophobicContact CB-CD2 3.53Å; A180-Y218 HydrophobicContact CB-CE2 4.2Å; A180-Y218 HydrophobicContact CB-CG 4.12Å; A180-S219 PolarHBondContact O-N 3.31Å; A180-C287 CarbonylContact C-O 3.48Å; A180-C287 WeakPolarHBondContact CA-O 3.41Å
181	G	98.1	Very high	98	Very high	4 Å²	4	17.1 Å²	17.1	4%	0.041	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	115.6	170	0	0	0	0	0	112.5	V183 G184 S219 C287 M292 W315	G181-V183 PolarHBondContact O-N 2.88Å; G181-G184 PolarHBondContact O-N 3.05Å; G181-S219 WeakPolarHBondContact CA-O 3.11Å; G181-C287 PolarHBondContact N-O 3.26Å; G181-M292 WeakPolarHBondContact CA-SD 3.48Å; G181-W315 PolarHBondContact O-NE1 2.93Å
182	G	96.9	Very high	98.1	Very high	19 Å²	19	15.1 Å²	15.1	20%	0.196	9%	0.093	C	C	.	.	G	3₁₀ helix	trans	59.9	-124	-179.7	0	0	0	0	0	112.2	G184 I185 Y218 S219	G182-G184 PolarHBondContact O-N 3.18Å; G182-I185 VanDerWaalsContact O-CG2 3.28Å; G182-I185 WeakPolarHBondContact O-CG2 3.32Å; G182-I185 PolarHBondContact O-N 3.37Å; G182-Y218 VanDerWaalsContact O-CE2 3.23Å; G182-Y218 WeakPolarHBondContact O-CE2 3.46Å; G182-Y218 PolarHBondContact O-OH 2.92Å; G182-S219 PolarHBondContact N-O 2.68Å
183	V	97.3	Very high	98.3	Very high	19 Å²	19	12.3 Å²	12.3	12%	0.115	7%	0.073	C	C	.	.	G	3₁₀ helix	trans	-74.5	-7.2	175.7	-71.3	0	0	0	0	114.3	V82 K135 G181 I185 N186 L227 W315	V82-V183 HydrophobicContact CG2-CG1 4.05Å; K135-V183 HydrophobicContact CB-CG1 3.72Å; K135-V183 HydrophobicContact CD-CG1 4.38Å; G181-V183 PolarHBondContact O-N 2.88Å; V183-I185 PolarHBondContact O-N 3.46Å; V183-N186 WeakPolarHBondContact O-CB 3.47Å; V183-N186 PolarHBondContact O-N 3.06Å; V183-N186 PolarHBondContact O-OD1 2.86Å; V183-L227 HydrophobicContact CG1-CD1 4.21Å; V183-W315 HydrophobicContact CG2-CD2 3.63Å; V183-W315 HydrophobicContact CG2-CE3 3.72Å; V183-W315 HydrophobicContact CG2-CG 4.15Å; V183-W315 HydrophobicContact CG2-CH2 4.14Å; V183-W315 HydrophobicContact CG2-CZ2 4.04Å; V183-W315 HydrophobicContact CG2-CZ3 3.97Å
184	G	98.1	Very high	98.4	Very high	1 Å²	1	10.5 Å²	10.5	1%	0.01	6%	0.059	C	C	.	.	G	3₁₀ helix	trans	-62	-6.6	168.6	0	0	0	0	0	113.6	G181 G182 N186 P187 C287	G181-G184 PolarHBondContact O-N 3.05Å; G182-G184 PolarHBondContact O-N 3.18Å; G184-N186 VanDerWaalsContact C-N 3.26Å; G184-N186 PolarHBondContact O-N 3.34Å; G184-P187 WeakPolarHBondContact O-CD 3.39Å; G184-C287 WeakPolarHBondContact CA-O 3.41Å; G184-C287 WeakPolarHBondContact CA-SG 3.39Å; G184-C287 VanDerWaalsContact O-CB 3.28Å; G184-C287 WeakPolarHBondContact O-CB 3.38Å
185	I	98.8	Very high	98.5	Very high	0 Å²	0	9.3 Å²	9.3	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-64.6	-27	167.7	-171.1	56.6	0	0	0	113	A180 G182 V183 L188 F189 L216 Y218 L227 F228 I232	A180-I185 HydrophobicContact CB-CB 3.95Å; A180-I185 HydrophobicContact CB-CD1 3.71Å; A180-I185 HydrophobicContact CB-CG1 4.41Å; G182-I185 VanDerWaalsContact O-CG2 3.28Å; G182-I185 WeakPolarHBondContact O-CG2 3.32Å; G182-I185 PolarHBondContact O-N 3.37Å; V183-I185 PolarHBondContact O-N 3.46Å; I185-L188 CarbonylContact O-C 3.52Å; I185-L188 PolarHBondContact O-N 3.4Å; I185-F189 HydrophobicContact CG1-CB 4.31Å; I185-F189 VanDerWaalsContact O-CB 3.25Å; I185-F189 WeakPolarHBondContact O-CB 3.39Å; I185-F189 PolarHBondContact O-N 2.83Å; I185-L216 HydrophobicContact CD1-CD1 3.97Å; I185-L216 HydrophobicContact CD1-CD2 3.94Å; I185-Y218 HydrophobicContact CB-CD2 4.22Å; I185-Y218 HydrophobicContact CB-CE1 4.14Å; I185-Y218 HydrophobicContact CB-CE2 3.75Å; I185-Y218 HydrophobicContact CD1-CD1 4.09Å; I185-Y218 HydrophobicContact CD1-CD2 4.4Å; I185-Y218 HydrophobicContact CD1-CE1 4.39Å; I185-Y218 HydrophobicContact CD1-CG 4.11Å; I185-Y218 HydrophobicContact CG1-CD1 4.11Å; I185-Y218 HydrophobicContact CG1-CE1 3.9Å; I185-Y218 HydrophobicContact CG1-CE2 4.32Å; I185-Y218 HydrophobicContact CG1-CG 4.43Å; I185-Y218 HydrophobicContact CG2-CE1 4.35Å; I185-Y218 HydrophobicContact CG2-CE2 4.18Å; I185-Y218 WeakPolarHBondContact CG2-OH 3.48Å; I185-L227 HydrophobicContact CG2-CB 4.11Å; I185-L227 HydrophobicContact CG2-CD1 3.84Å; I185-L227 HydrophobicContact CG2-CG 4.3Å; I185-F228 HydrophobicContact CG1-CD2 4.12Å; I185-F228 HydrophobicContact CG2-CD2 4.2Å; I185-F228 HydrophobicContact CG2-CE2 4Å; I185-I232 HydrophobicContact CD1-CD1 4.49Å
186	N	98.8	Very high	98.4	Very high	7 Å²	7	5.9 Å²	5.9	4%	0.037	4%	0.037	C	C	.	.	H	α-helix	trans	-54.5	-58.8	-173.1	-70	5.9	0	0	0	114	I117 C118 A133 V183 G184 L188 F189 S190	I117-N186 CarbonylContact O-C 3.59Å; I117-N186 VanDerWaalsContact O-O 3.14Å; C118-N186 HydrophobicContact CB-CB 4.01Å; A133-N186 PolarHBondContact O-ND2 3.37Å; V183-N186 WeakPolarHBondContact O-CB 3.47Å; V183-N186 PolarHBondContact O-N 3.06Å; V183-N186 PolarHBondContact O-OD1 2.86Å; G184-N186 VanDerWaalsContact C-N 3.26Å; G184-N186 PolarHBondContact O-N 3.34Å; N186-L188 VanDerWaalsContact C-N 3.25Å; N186-L188 PolarHBondContact O-N 3.04Å; N186-F189 PolarHBondContact O-N 3.01Å; N186-S190 PolarHBondContact O-N 3.33Å
187	P	98.8	Very high	98.4	Very high	0 Å²	0	6.4 Å²	6.4	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-66.1	-32.6	-179.1	28.2	-35.1	0	0	0	111.6	G99 F163 G184 S190 I191 C287	G99-P187 WeakPolarHBondContact O-CB 3.26Å; F163-P187 HydrophobicContact CD1-CB 3.97Å; F163-P187 HydrophobicContact CD1-CG 4.3Å; F163-P187 HydrophobicContact CE1-CB 3.88Å; F163-P187 HydrophobicContact CE1-CG 3.96Å; G184-P187 WeakPolarHBondContact O-CD 3.39Å; P187-S190 WeakPolarHBondContact O-CB 3.41Å; P187-S190 PolarHBondContact O-N 2.95Å; P187-I191 WeakPolarHBondContact O-CG1 3.39Å; P187-I191 PolarHBondContact O-N 2.94Å; P187-C287 HydrophobicContact CG-CB 3.88Å; P187-C287 VanDerWaalsContact CG-SG 3.6Å
188	L	98.9	Very high	98.3	Very high	0 Å²	0	7.9 Å²	7.9	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-71	-31.9	178.1	-60.3	-176	0	0	0	112.6	F163 L178 I179 A180 I185 N186 I191 L192 C287	F163-L188 HydrophobicContact CE1-CD2 3.88Å; F163-L188 HydrophobicContact CZ-CD2 3.75Å; L178-L188 HydrophobicContact CB-CB 4.39Å; L178-L188 HydrophobicContact CB-CD1 4.2Å; L178-L188 HydrophobicContact CB-CD2 4.3Å; L178-L188 HydrophobicContact CD2-CD2 4.31Å; I179-L188 WeakPolarHBondContact O-CD1 3.46Å; A180-L188 HydrophobicContact CB-CD1 3.63Å; I185-L188 CarbonylContact O-C 3.52Å; I185-L188 PolarHBondContact O-N 3.4Å; N186-L188 VanDerWaalsContact C-N 3.25Å; N186-L188 PolarHBondContact O-N 3.04Å; L188-I191 HydrophobicContact CD2-CD1 4.3Å; L188-L192 VanDerWaalsContact O-CB 3.32Å; L188-L192 WeakPolarHBondContact O-CB 3.41Å; L188-L192 PolarHBondContact O-N 3.39Å; L188-C287 HydrophobicContact CD1-CB 4.31Å; L188-C287 HydrophobicContact CG-CB 4.25Å
189	F	98.9	Very high	98.1	Very high	1 Å²	1	9.7 Å²	9.7	0%	0.004	6%	0.056	C	C	.	.	H	α-helix	trans	-72.9	-38.1	174.1	-174.9	-120.3	0	0	0	111	C118 I185 N186 L192 L193 F228 N231 I232 L235	C118-F189 HydrophobicContact CB-CD1 4.4Å; C118-F189 WeakPolarHBondContact O-CD1 3.33Å; I185-F189 HydrophobicContact CG1-CB 4.31Å; I185-F189 VanDerWaalsContact O-CB 3.25Å; I185-F189 WeakPolarHBondContact O-CB 3.39Å; I185-F189 PolarHBondContact O-N 2.83Å; N186-F189 PolarHBondContact O-N 3.01Å; F189-L192 HydrophobicContact CD2-CD2 4.44Å; F189-L192 PolarHBondContact O-N 2.95Å; F189-L193 HydrophobicContact CD1-CD1 4Å; F189-L193 HydrophobicContact CD2-CG 4.48Å; F189-L193 HydrophobicContact CE1-CD1 3.59Å; F189-L193 HydrophobicContact CE1-CG 4.22Å; F189-L193 HydrophobicContact CE2-CD1 4.38Å; F189-L193 HydrophobicContact CE2-CD2 4.23Å; F189-L193 HydrophobicContact CE2-CG 4.12Å; F189-L193 HydrophobicContact CZ-CD1 3.79Å; F189-L193 HydrophobicContact CZ-CD2 4.01Å; F189-L193 HydrophobicContact CZ-CG 3.97Å; F189-L193 WeakPolarHBondContact O-CG 3.35Å; F189-L193 PolarHBondContact O-N 3.37Å; F189-F228 HydrophobicContact CB-CD2 4.06Å; F189-F228 HydrophobicContact CB-CE2 4.25Å; F189-F228 HydrophobicContact CD1-CB 4.32Å; F189-F228 HydrophobicContact CD1-CD1 4.05Å; F189-F228 AromaticContact CD1-CD2 3.58Å; F189-F228 HydrophobicContact CD1-CD2 3.58Å; F189-F228 HydrophobicContact CD1-CE1 4.24Å; F189-F228 AromaticContact CD1-CE2 3.78Å; F189-F228 HydrophobicContact CD1-CE2 3.78Å; F189-F228 AromaticContact CD1-CG 3.71Å; F189-F228 HydrophobicContact CD1-CG 3.71Å; F189-F228 HydrophobicContact CD1-CZ 4.1Å; F189-F228 HydrophobicContact CD2-CB 4.2Å; F189-F228 HydrophobicContact CD2-CD2 4.3Å; F189-F228 HydrophobicContact CD2-CG 4.39Å; F189-F228 HydrophobicContact CE1-CB 4.09Å; F189-F228 AromaticContact CE1-CD1 3.79Å; F189-F228 HydrophobicContact CE1-CD1 3.79Å; F189-F228 HydrophobicContact CE1-CD2 4.09Å; F189-F228 HydrophobicContact CE1-CE1 4.2Å; F189-F228 HydrophobicContact CE1-CE2 4.48Å; F189-F228 AromaticContact CE1-CG 3.72Å; F189-F228 HydrophobicContact CE1-CG 3.72Å; F189-F228 HydrophobicContact CE2-CB 3.97Å; F189-F228 HydrophobicContact CE2-CG 4.4Å; F189-F228 HydrophobicContact CG-CB 4.39Å; F189-F228 AromaticContact CG-CD2 3.71Å; F189-F228 HydrophobicContact CG-CD2 3.71Å; F189-F228 HydrophobicContact CG-CE2 4.17Å; F189-F228 HydrophobicContact CG-CG 4.08Å; F189-F228 HydrophobicContact CZ-CB 3.92Å; F189-F228 HydrophobicContact CZ-CD1 4.37Å; F189-F228 HydrophobicContact CZ-CG 4.08Å; F189-N231 HydrophobicContact CE2-CB 3.85Å; F189-N231 HydrophobicContact CZ-CB 3.55Å; F189-I232 HydrophobicContact CD2-CG1 4.2Å; F189-I232 HydrophobicContact CE2-CG1 4.17Å; F189-L235 HydrophobicContact CE2-CD1 4.36Å
190	S	98.9	Very high	97.9	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-57.1	-48.7	168.9	179.3	0	0	0	0	111.5	A98 G99 I117 S119 N186 P187 L192 L193 H194	A98-S190 WeakPolarHBondContact CA-OG 3.34Å; G99-S190 PolarHBondContact N-OG 2.81Å; I117-S190 WeakPolarHBondContact O-CB 3.4Å; S119-S190 VanDerWaalsContact O-CB 3.26Å; S119-S190 WeakPolarHBondContact O-CB 3.29Å; S119-S190 PolarHBondContact O-OG 2.91Å; N186-S190 PolarHBondContact O-N 3.33Å; P187-S190 WeakPolarHBondContact O-CB 3.41Å; P187-S190 PolarHBondContact O-N 2.95Å; S190-L192 PolarHBondContact O-N 3.01Å; S190-L193 PolarHBondContact O-N 3.03Å; S190-H194 WeakPolarHBondContact O-CB 3.48Å; S190-H194 PolarHBondContact O-N 3.33Å
191	I	98.9	Very high	97.7	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-58.4	-46.5	174.4	-70.4	169.7	0	0	0	111	A98 F163 F165 L178 P187 L188 L193 H194 I195 Y285	A98-I191 HydrophobicContact CB-CG1 4.19Å; A98-I191 VanDerWaalsContact O-CG1 3.24Å; A98-I191 WeakPolarHBondContact O-CG1 3.28Å; F163-I191 HydrophobicContact CE1-CD1 4.4Å; F165-I191 HydrophobicContact CB-CD1 4.09Å; F165-I191 HydrophobicContact CB-CG1 3.96Å; F165-I191 HydrophobicContact CB-CG2 3.82Å; F165-I191 HydrophobicContact CD1-CG2 4.28Å; F165-I191 HydrophobicContact CG-CG2 4.3Å; L178-I191 HydrophobicContact CD1-CG2 4.3Å; L178-I191 HydrophobicContact CD2-CG2 4.21Å; P187-I191 WeakPolarHBondContact O-CG1 3.39Å; P187-I191 PolarHBondContact O-N 2.94Å; L188-I191 HydrophobicContact CD2-CD1 4.3Å; I191-L193 PolarHBondContact O-N 3.22Å; I191-H194 PolarHBondContact O-N 3.21Å; I191-I195 HydrophobicContact CG2-CD1 3.6Å; I191-I195 HydrophobicContact CG2-CG1 4.43Å; I191-I195 VanDerWaalsContact O-CD1 3.28Å; I191-I195 WeakPolarHBondContact O-CD1 3.16Å; I191-I195 VanDerWaalsContact O-CG1 3.26Å; I191-I195 WeakPolarHBondContact O-CG1 3.24Å; I191-I195 PolarHBondContact O-N 2.95Å; I191-Y285 HydrophobicContact CD1-CD1 3.86Å; I191-Y285 HydrophobicContact CD1-CE1 4.19Å; I191-Y285 HydrophobicContact CD1-CG 4.39Å
192	L	98.6	Very high	97.5	Very high	2 Å²	2	20.6 Å²	20.6	1%	0.01	10%	0.102	C	C	.	.	H	α-helix	trans	-61.3	-44.7	-178.7	-172.1	66.7	0	0	0	112.4	L178 L188 F189 S190 I195 A196 V214 L216 I232 L235 I243	L178-L192 HydrophobicContact CD1-CB 4.34Å; L178-L192 HydrophobicContact CD1-CD1 4.39Å; L188-L192 VanDerWaalsContact O-CB 3.32Å; L188-L192 WeakPolarHBondContact O-CB 3.41Å; L188-L192 PolarHBondContact O-N 3.39Å; F189-L192 HydrophobicContact CD2-CD2 4.44Å; F189-L192 PolarHBondContact O-N 2.95Å; S190-L192 PolarHBondContact O-N 3.01Å; L192-I195 PolarHBondContact O-N 2.8Å; L192-A196 PolarHBondContact O-N 2.86Å; L192-V214 HydrophobicContact CD1-CB 4.33Å; L192-V214 HydrophobicContact CD1-CG1 3.69Å; L192-L216 HydrophobicContact CD2-CD2 4.43Å; L192-I232 HydrophobicContact CD2-CG1 4.5Å; L192-L235 HydrophobicContact CD2-CD1 3.72Å; L192-L235 HydrophobicContact CG-CD1 3.85Å; L192-I243 HydrophobicContact CD1-CD1 4.1Å; L192-I243 HydrophobicContact CD1-CG1 4.46Å; L192-I243 HydrophobicContact CD1-CG2 3.81Å
193	L	98.8	Very high	97.3	Very high	35 Å²	35	25.7 Å²	25.7	18%	0.183	12%	0.121	C	C	.	.	H	α-helix	trans	-64.4	-42.6	175.1	-69.9	171.6	0	0	0	111.3	F189 S190 I191 I195 A196 D197 L235	F189-L193 HydrophobicContact CD1-CD1 4Å; F189-L193 HydrophobicContact CD2-CG 4.48Å; F189-L193 HydrophobicContact CE1-CD1 3.59Å; F189-L193 HydrophobicContact CE1-CG 4.22Å; F189-L193 HydrophobicContact CE2-CD1 4.38Å; F189-L193 HydrophobicContact CE2-CD2 4.23Å; F189-L193 HydrophobicContact CE2-CG 4.12Å; F189-L193 HydrophobicContact CZ-CD1 3.79Å; F189-L193 HydrophobicContact CZ-CD2 4.01Å; F189-L193 HydrophobicContact CZ-CG 3.97Å; F189-L193 WeakPolarHBondContact O-CG 3.35Å; F189-L193 PolarHBondContact O-N 3.37Å; S190-L193 PolarHBondContact O-N 3.03Å; I191-L193 PolarHBondContact O-N 3.22Å; L193-I195 VanDerWaalsContact C-N 3.31Å; L193-I195 PolarHBondContact O-N 3.39Å; L193-A196 WeakPolarHBondContact O-CB 3.33Å; L193-A196 PolarHBondContact O-N 2.6Å; L193-A196 VanDerWaalsContact O-N 3.17Å; L193-D197 PolarHBondContact O-N 2.82Å; L193-L235 HydrophobicContact CD2-CD1 4.02Å
194	H	98.5	Very high	97.1	Very high	22 Å²	22	28.9 Å²	28.9	10%	0.102	14%	0.144	C	C	.	.	H	α-helix	trans	-61.9	-38.7	178.9	-177.3	47.7	0	0	0	112.5	A98 S190 I191 A196 D197 L198	A98-H194 HydrophobicContact CB-CB 3.43Å; A98-H194 VanDerWaalsContact CB-CB 3.43Å; S190-H194 WeakPolarHBondContact O-CB 3.48Å; S190-H194 PolarHBondContact O-N 3.33Å; I191-H194 PolarHBondContact O-N 3.21Å; H194-A196 VanDerWaalsContact C-N 3.34Å; H194-A196 PolarHBondContact O-N 2.73Å; H194-D197 WeakPolarHBondContact O-CB 3.25Å; H194-D197 PolarHBondContact O-N 2.78Å; H194-L198 WeakPolarHBondContact O-CG 3.22Å; H194-L198 PolarHBondContact O-N 3.44Å
195	I	97.7	Very high	96.9	Very high	3 Å²	3	34.8 Å²	34.8	2%	0.015	17%	0.169	C	C	.	.	H	α-helix	trans	-64	-40.5	175.7	-66.8	153.7	0	0	0	111.5	F165 L176 I191 L192 L193 D197 L198 H199 M211 V214	F165-I195 HydrophobicContact CD1-CD1 4.24Å; F165-I195 HydrophobicContact CD1-CG1 3.91Å; F165-I195 HydrophobicContact CE1-CD1 4.32Å; F165-I195 HydrophobicContact CE1-CG1 3.79Å; L176-I195 HydrophobicContact CD1-CD1 3.3Å; L176-I195 HydrophobicContact CD1-CG1 4.16Å; I191-I195 HydrophobicContact CG2-CD1 3.6Å; I191-I195 HydrophobicContact CG2-CG1 4.43Å; I191-I195 VanDerWaalsContact O-CD1 3.28Å; I191-I195 WeakPolarHBondContact O-CD1 3.16Å; I191-I195 VanDerWaalsContact O-CG1 3.26Å; I191-I195 WeakPolarHBondContact O-CG1 3.24Å; I191-I195 PolarHBondContact O-N 2.95Å; L192-I195 PolarHBondContact O-N 2.8Å; L193-I195 VanDerWaalsContact C-N 3.31Å; L193-I195 PolarHBondContact O-N 3.39Å; I195-D197 VanDerWaalsContact C-N 3.34Å; I195-L198 PolarHBondContact O-N 3.22Å; I195-H199 PolarHBondContact O-N 3.02Å; I195-M211 HydrophobicContact CG2-CE 3.61Å; I195-M211 HydrophobicContact CG2-CG 3.62Å; I195-M211 HydrophobicContact CG2-SD 3.69Å; I195-V214 HydrophobicContact CD1-CG2 3.81Å; I195-V214 HydrophobicContact CG2-CG2 3.97Å
196	A	97.6	Very high	96.6	Very high	3 Å²	3	38 Å²	38	3%	0.025	20%	0.203	C	C	.	.	H	α-helix	trans	-62.6	-43	174.1	0	0	0	0	0	111.2	L192 L193 H194 L198 H199 E200 L235 F239	L192-A196 PolarHBondContact O-N 2.86Å; L193-A196 WeakPolarHBondContact O-CB 3.33Å; L193-A196 PolarHBondContact O-N 2.6Å; L193-A196 VanDerWaalsContact O-N 3.17Å; H194-A196 VanDerWaalsContact C-N 3.34Å; H194-A196 PolarHBondContact O-N 2.73Å; A196-L198 PolarHBondContact O-N 3.16Å; A196-H199 PolarHBondContact O-N 3.17Å; A196-E200 WeakPolarHBondContact O-CG 3.46Å; A196-E200 PolarHBondContact O-N 3.01Å; A196-L235 HydrophobicContact CB-CD2 3.88Å; A196-F239 HydrophobicContact CB-CD2 4.49Å; A196-F239 HydrophobicContact CB-CE2 3.67Å; A196-F239 HydrophobicContact CB-CZ 3.85Å
197	D	97.6	Very high	96.3	Very high	16 Å²	16	43.1 Å²	43.1	9%	0.086	23%	0.226	C	C	.	.	H	α-helix	trans	-60.9	-43.6	176.7	-64.3	-25.9	0	0	0	112.3	S120 R122 L193 H194 I195 E200 Y201	S120-D197 WeakPolarHBondContact CB-OD2 3.41Å; S120-D197 PolarHBondContact OG-OD2 3.36Å; R122-D197 HydrophobicContact CB-CB 4.18Å; R122-D197 WeakPolarHBondContact CB-OD2 3.41Å; R122-D197 IonicContact CZ-OD1 3.02Å; R122-D197 IonicContact NE-OD1 2.94Å; R122-D197 PolarHBondContact NE-OD1 3.39Å; R122-D197 IonicContact NE-OD2 3.89Å; R122-D197 IonicContact NH2-OD1 3.19Å; R122-D197 PolarHBondContact NH2-OD1 2.59Å; L193-D197 PolarHBondContact O-N 2.82Å; H194-D197 WeakPolarHBondContact O-CB 3.25Å; H194-D197 PolarHBondContact O-N 2.78Å; I195-D197 VanDerWaalsContact C-N 3.34Å; D197-E200 PolarHBondContact O-N 3.45Å; D197-Y201 WeakPolarHBondContact O-CB 3.43Å; D197-Y201 PolarHBondContact O-N 2.89Å
198	L	96.4	Very high	96.1	Very high	34 Å²	34	44 Å²	44	18%	0.178	24%	0.235	C	C	.	.	H	α-helix	trans	-63.7	-41.7	176.8	-71.5	173.4	0	0	0	111.8	P167 H194 I195 A196 Y201 Q202 Y209	P167-L198 HydrophobicContact CG-CD1 3.62Å; H194-L198 WeakPolarHBondContact O-CG 3.22Å; H194-L198 PolarHBondContact O-N 3.44Å; I195-L198 PolarHBondContact O-N 3.22Å; A196-L198 PolarHBondContact O-N 3.16Å; L198-Y201 PolarHBondContact O-N 3.44Å; L198-Q202 WeakPolarHBondContact O-CB 3.42Å; L198-Q202 PolarHBondContact O-N 2.94Å; L198-Y209 HydrophobicContact CB-CD1 4.48Å; L198-Y209 HydrophobicContact CD1-CD1 3.93Å
199	H	95	Very high	95.9	Very high	37 Å²	37	44.5 Å²	44.5	17%	0.171	24%	0.237	C	C	.	.	H	α-helix	trans	-62.6	-48.7	175.9	-178.5	-57	0	0	0	111.3	I195 A196 Y201 Q202 E203 M211 F239	I195-H199 PolarHBondContact O-N 3.02Å; A196-H199 PolarHBondContact O-N 3.17Å; H199-Y201 VanDerWaalsContact C-N 3.27Å; H199-Y201 PolarHBondContact O-N 2.89Å; H199-Q202 PolarHBondContact O-N 2.63Å; H199-E203 WeakPolarHBondContact CE1-CG 3.36Å; H199-E203 WeakPolarHBondContact O-CG 3.48Å; H199-E203 PolarHBondContact O-N 3.13Å; H199-M211 HydrophobicContact CB-CB 4.17Å; H199-M211 HydrophobicContact CB-SD 4.02Å; H199-M211 VanDerWaalsContact CD2-SD 3.59Å; H199-F239 HydrophobicContact CB-CE1 4.22Å; H199-F239 AromaticContact CG-CE1 3.87Å; H199-F239 AromaticContact ND1-CE1 3.87Å
200	E	94.7	Very high	95.7	Very high	86 Å²	86	50.7 Å²	50.7	40%	0.402	26%	0.264	S	S	.	.	H	α-helix	trans	-58	-41.9	176.9	-74	178.2	-172.4	0	0	111.6	R122 A196 D197 S204 F239	R122-E200 IonicContact CZ-OE2 2.6Å; R122-E200 IonicContact NH1-OE2 2.86Å; R122-E200 PolarHBondContact NH1-OE2 2.81Å; R122-E200 IonicContact NH2-OE2 3.48Å; R122-E200 PolarHBondContact NH2-OE2 3.36Å; A196-E200 WeakPolarHBondContact O-CG 3.46Å; A196-E200 PolarHBondContact O-N 3.01Å; D197-E200 PolarHBondContact O-N 3.45Å; E200-S204 WeakPolarHBondContact O-CB 3.24Å; E200-S204 PolarHBondContact O-N 2.72Å; E200-S204 PolarHBondContact O-OG 3.46Å; E200-F239 HydrophobicContact CG-CZ 4.46Å
201	Y	94.7	Very high	95.4	Very high	110 Å²	110	50.9 Å²	50.9	43%	0.431	27%	0.265	S	S	.	.	H	α-helix	trans	-60	-51	175.7	-176	-87.4	0	0	0	111.2	D197 L198 H199 E203 S204 K205	D197-Y201 WeakPolarHBondContact O-CB 3.43Å; D197-Y201 PolarHBondContact O-N 2.89Å; L198-Y201 PolarHBondContact O-N 3.44Å; H199-Y201 VanDerWaalsContact C-N 3.27Å; H199-Y201 PolarHBondContact O-N 2.89Å; Y201-E203 PolarHBondContact O-N 3.49Å; Y201-S204 PolarHBondContact O-N 2.97Å; Y201-S204 VanDerWaalsContact O-N 3.15Å; Y201-S204 PolarHBondContact O-OG 2.68Å; Y201-K205 HydrophobicContact CD1-CB 4.47Å; Y201-K205 HydrophobicContact CD1-CG 4.19Å; Y201-K205 HydrophobicContact CD2-CG 4.17Å; Y201-K205 HydrophobicContact CE1-CB 4.1Å; Y201-K205 HydrophobicContact CE1-CG 3.83Å; Y201-K205 HydrophobicContact CE2-CG 3.82Å; Y201-K205 HydrophobicContact CG-CG 4.35Å; Y201-K205 WeakPolarHBondContact O-CB 3.33Å; Y201-K205 WeakPolarHBondContact O-CG 3.5Å; Y201-K205 PolarHBondContact O-N 2.73Å
202	Q	94.3	Very high	95.3	Very high	38 Å²	38	51.6 Å²	51.6	18%	0.178	27%	0.272	C	S	.	.	H	α-helix	trans	-60.9	-41.3	-179.3	-179.5	-94.5	-77	0	0	112.6	L198 H199 G206	L198-Q202 WeakPolarHBondContact O-CB 3.42Å; L198-Q202 PolarHBondContact O-N 2.94Å; H199-Q202 PolarHBondContact O-N 2.63Å; Q202-G206 WeakPolarHBondContact O-CA 3.41Å; Q202-G206 PolarHBondContact O-N 3.05Å
203	E	92.6	Very high	95.2	Very high	126 Å²	126	54.2 Å²	54.2	59%	0.589	29%	0.288	S	S	*	.	H	α-helix	trans	-65.4	-39.4	175.5	-72.8	-64	106.4	0	0	111.8	H199 Y201	H199-E203 WeakPolarHBondContact CE1-CG 3.36Å; H199-E203 WeakPolarHBondContact O-CG 3.48Å; H199-E203 PolarHBondContact O-N 3.13Å; Y201-E203 PolarHBondContact O-N 3.49Å
204	S	93.8	Very high	95.2	Very high	86 Å²	86	52.8 Å²	52.8	60%	0.601	28%	0.281	S	S	*	.	H	α-helix	trans	-75.2	-31.6	-178.6	74.5	0	0	0	0	114	E200 Y201	E200-S204 WeakPolarHBondContact O-CB 3.24Å; E200-S204 PolarHBondContact O-N 2.72Å; E200-S204 PolarHBondContact O-OG 3.46Å; Y201-S204 PolarHBondContact O-N 2.97Å; Y201-S204 VanDerWaalsContact O-N 3.15Å; Y201-S204 PolarHBondContact O-OG 2.68Å
205	K	93.9	Very high	95.2	Very high	124 Å²	124	52.9 Å²	52.9	54%	0.539	28%	0.281	S	S	.	.	H	α-helix	trans	-104	-16.9	-174.3	-60.7	-55.7	-176.6	179.6	0	114.1	Y201 H207	Y201-K205 HydrophobicContact CD1-CB 4.47Å; Y201-K205 HydrophobicContact CD1-CG 4.19Å; Y201-K205 HydrophobicContact CD2-CG 4.17Å; Y201-K205 HydrophobicContact CE1-CB 4.1Å; Y201-K205 HydrophobicContact CE1-CG 3.83Å; Y201-K205 HydrophobicContact CE2-CG 3.82Å; Y201-K205 HydrophobicContact CG-CG 4.35Å; Y201-K205 WeakPolarHBondContact O-CB 3.33Å; Y201-K205 WeakPolarHBondContact O-CG 3.5Å; Y201-K205 PolarHBondContact O-N 2.73Å; K205-H207 PolarHBondContact O-CD2 2.68Å; K205-H207 PolarHBondContact O-N 3.49Å
206	G	92.1	Very high	95.3	Very high	68 Å²	68	52.9 Å²	52.9	70%	0.701	28%	0.281	S	S	*	.	S	Bend	trans	72.1	6.3	-174.5	0	0	0	0	0	114.2	Q202	Q202-G206 WeakPolarHBondContact O-CA 3.41Å; Q202-G206 PolarHBondContact O-N 3.05Å
207	H	91.5	Very high	95.4	Very high	115 Å²	115	52.8 Å²	52.8	53%	0.532	28%	0.28	S	S	.	.			trans	-147.5	158.2	174.7	71.8	86.4	0	0	0	110	K205	K205-H207 PolarHBondContact O-CD2 2.68Å; K205-H207 PolarHBondContact O-N 3.49Å
208	G	94.4	Very high	95.4	Very high	19 Å²	19	52 Å²	52	20%	0.196	28%	0.276	C	S	.	.	S	Bend	trans	125.6	176.6	-175.1	0	0	0	0	0	111.9	P169 K210	P169-G208 CarbonylContact O-C 3.36Å; G208-K210 PolarHBondContact O-N 3.49Å
209	Y	96.1	Very high	95.5	Very high	9 Å²	9	51.2 Å²	51.2	4%	0.035	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-60.4	125.1	-177.6	174.5	-107.5	0	0	0	111.1	F165 P167 P169 D171 V174 L198	F165-Y209 HydrophobicContact CE1-CE1 4.28Å; F165-Y209 HydrophobicContact CZ-CE1 4.11Å; P167-Y209 HydrophobicContact CB-CD1 4.09Å; P167-Y209 HydrophobicContact CB-CD2 3.5Å; P167-Y209 VanDerWaalsContact CB-CD2 3.5Å; P167-Y209 HydrophobicContact CB-CE1 4.12Å; P167-Y209 HydrophobicContact CB-CE2 3.54Å; P167-Y209 HydrophobicContact CB-CG 3.77Å; P167-Y209 HydrophobicContact CG-CD1 3.59Å; P167-Y209 HydrophobicContact CG-CD2 3.95Å; P167-Y209 HydrophobicContact CG-CE1 3.77Å; P167-Y209 HydrophobicContact CG-CE2 4.12Å; P167-Y209 HydrophobicContact CG-CG 3.66Å; P169-Y209 WeakPolarHBondContact O-CA 3.37Å; P169-Y209 PolarHBondContact O-N 3.08Å; D171-Y209 HydrophobicContact CB-CD2 4.23Å; D171-Y209 HydrophobicContact CB-CE2 4.25Å; V174-Y209 WeakPolarHBondContact CG2-OH 3.5Å; V174-Y209 PolarHBondContact N-OH 3.29Å; L198-Y209 HydrophobicContact CB-CD1 4.48Å; L198-Y209 HydrophobicContact CD1-CD1 3.93Å
210	K	94.2	Very high	95.6	Very high	132 Å²	132	49.8 Å²	49.8	57%	0.574	27%	0.268	S	S	*	.	P	Polyproline II helix	trans	-80.6	122.8	177.4	-172.9	173.1	-176.7	173.4	0	110	P173 G208 G212	P173-K210 WeakPolarHBondContact CB-O 3.37Å; G208-K210 PolarHBondContact O-N 3.49Å; K210-G212 PolarHBondContact O-N 2.82Å
211	M	92.8	Very high	95.7	Very high	4 Å²	4	51 Å²	51	2%	0.02	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-70.8	126.3	178.8	-176.2	-171.6	171.1	0	0	112.4	I195 H199 V214 K242 I243	I195-M211 HydrophobicContact CG2-CE 3.61Å; I195-M211 HydrophobicContact CG2-CG 3.62Å; I195-M211 HydrophobicContact CG2-SD 3.69Å; H199-M211 HydrophobicContact CB-CB 4.17Å; H199-M211 HydrophobicContact CB-SD 4.02Å; H199-M211 VanDerWaalsContact CD2-SD 3.59Å; M211-V214 HydrophobicContact CE-CG2 3.78Å; M211-K242 HydrophobicContact CE-CB 3.86Å; M211-K242 PolarHBondContact O-NZ 2.9Å; M211-K242 HydrophobicContact SD-CB 4.38Å; M211-I243 HydrophobicContact CE-CD1 4.1Å; M211-I243 HydrophobicContact CE-CG1 3.53Å
212	G	95.5	Very high	95.7	Very high	14 Å²	14	47.2 Å²	47.2	14%	0.144	26%	0.259	C	S	.	.			trans	-75.8	-132.7	165.1	0	0	0	0	0	112.8	V174 K210 K242	V174-G212 WeakPolarHBondContact O-CA 3.29Å; K210-G212 PolarHBondContact O-N 2.82Å; G212-K242 WeakPolarHBondContact O-CD 3.45Å; G212-K242 PolarHBondContact O-NZ 2.82Å
213	T	97.9	Very high	95.8	Very high	57 Å²	57	45.8 Å²	45.8	35%	0.35	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	146.5	175.7	57	0	0	0	0	110.8	K175 L176 K242	K175-T213 CarbonylContact C-O 3.55Å; K175-T213 WeakPolarHBondContact CA-O 3.37Å; L176-T213 PolarHBondContact N-O 2.74Å; T213-K242 CarbonylContact C-O 3.55Å; T213-K242 WeakPolarHBondContact CA-O 3.25Å
214	V	98.6	Very high	95.9	Very high	5 Å²	5	43.9 Å²	43.9	3%	0.03	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	124.5	179.7	-171	0	0	0	0	109.9	L176 L178 L192 I195 M211 K242 I243 T244	L176-V214 HydrophobicContact CB-CG1 4.26Å; L176-V214 HydrophobicContact CB-CG2 4.31Å; L176-V214 HydrophobicContact CD1-CG2 4.38Å; L176-V214 CarbonylContact O-C 3.55Å; L176-V214 WeakPolarHBondContact O-CA 3.35Å; L178-V214 HydrophobicContact CD1-CG1 3.75Å; L178-V214 HydrophobicContact CG-CG1 3.97Å; L192-V214 HydrophobicContact CD1-CB 4.33Å; L192-V214 HydrophobicContact CD1-CG1 3.69Å; I195-V214 HydrophobicContact CD1-CG2 3.81Å; I195-V214 HydrophobicContact CG2-CG2 3.97Å; M211-V214 HydrophobicContact CE-CG2 3.78Å; V214-K242 PolarHBondContact N-O 3.47Å; V214-I243 HydrophobicContact CB-CG1 4.5Å; V214-T244 PolarHBondContact O-N 2.86Å
215	K	98.8	Very high	96	Very high	25 Å²	25	41 Å²	41	11%	0.109	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	117.2	169.6	-178	65.8	174.4	-179.8	0	109.9	L176 V177 L178 Y217 T244	L176-K215 PolarHBondContact O-N 2.69Å; V177-K215 CarbonylContact C-O 3.44Å; V177-K215 WeakPolarHBondContact CA-O 3.39Å; V177-K215 HydrophobicContact CG2-CB 4.48Å; L178-K215 PolarHBondContact N-O 3.15Å; K215-Y217 HydrophobicContact CD-CE2 4.28Å; K215-Y217 HydrophobicContact CG-CD2 3.88Å; K215-Y217 HydrophobicContact CG-CE2 3.37Å; K215-T244 WeakPolarHBondContact CA-O 3.5Å; K215-T244 WeakPolarHBondContact CD-OG1 3.28Å; K215-T244 PolarHBondContact NZ-OG1 3.23Å
216	L	98.9	Very high	96.1	Very high	2 Å²	2	35.2 Å²	35.2	1%	0.01	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	126	169.6	177.3	62.1	0	0	0	110.2	L178 A180 I185 L192 I232 T244 C245 R246	L178-L216 HydrophobicContact CB-CD1 3.81Å; L178-L216 CarbonylContact O-C 3.57Å; L178-L216 WeakPolarHBondContact O-CA 3.34Å; A180-L216 HydrophobicContact CB-CD1 4.32Å; I185-L216 HydrophobicContact CD1-CD1 3.97Å; I185-L216 HydrophobicContact CD1-CD2 3.94Å; L192-L216 HydrophobicContact CD2-CD2 4.43Å; L216-I232 HydrophobicContact CD2-CD1 3.94Å; L216-I232 HydrophobicContact CD2-CG1 4.36Å; L216-I232 HydrophobicContact CD2-CG2 4.21Å; L216-T244 PolarHBondContact N-O 3.06Å; L216-C245 HydrophobicContact CB-CB 4.3Å; L216-C245 CarbonylContact O-C 3.58Å; L216-C245 VanDerWaalsContact O-CA 3.24Å; L216-C245 WeakPolarHBondContact O-CA 3.5Å; L216-R246 PolarHBondContact O-N 2.98Å
217	Y	98.9	Very high	96.4	Very high	1 Å²	1	32.1 Å²	32.1	0%	0.004	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	115.3	161.3	-69.8	-80.1	0	0	0	108.2	V177 L178 I179 A180 K215 R246 H248 D273 L274 K276 H277	V177-Y217 HydrophobicContact CG1-CD2 3.91Å; V177-Y217 HydrophobicContact CG1-CE2 4.1Å; L178-Y217 PolarHBondContact O-N 2.7Å; I179-Y217 CarbonylContact C-O 3.49Å; I179-Y217 WeakPolarHBondContact CA-O 3.4Å; A180-Y217 PolarHBondContact N-O 2.96Å; K215-Y217 HydrophobicContact CD-CE2 4.28Å; K215-Y217 HydrophobicContact CG-CD2 3.88Å; K215-Y217 HydrophobicContact CG-CE2 3.37Å; Y217-R246 WeakPolarHBondContact CA-O 3.06Å; Y217-R246 HydrophobicContact CD1-CB 3.77Å; Y217-R246 HydrophobicContact CE1-CB 3.85Å; Y217-R246 HydrophobicContact CE1-CG 4.14Å; Y217-H248 AromaticContact CD1-NE2 3.67Å; Y217-D273 HydrophobicContact CD1-CB 4.46Å; Y217-D273 HydrophobicContact CE1-CB 3.8Å; Y217-D273 PolarHBondContact OH-O 2.98Å; Y217-L274 HydrophobicContact CD2-CD2 3.84Å; Y217-L274 HydrophobicContact CE2-CD2 3.77Å; Y217-L274 HydrophobicContact CG-CD2 4.45Å; Y217-K276 WeakPolarHBondContact OH-CE 3.32Å; Y217-K276 PolarHBondContact OH-NZ 2.88Å; Y217-H277 AromaticContact CE2-CD2 3.88Å; Y217-H277 AromaticContact CE2-NE2 3.65Å; Y217-H277 AromaticContact CZ-NE2 3.71Å; Y217-H277 PolarHBondContact OH-NE2 3.11Å
218	Y	98.7	Very high	96.7	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	111.9	-177	179	-158.4	0	0	0	111.3	A180 G182 I185 E225 L226 L227 I232 R246 F247 H248	A180-Y218 HydrophobicContact CB-CD2 3.53Å; A180-Y218 HydrophobicContact CB-CE2 4.2Å; A180-Y218 HydrophobicContact CB-CG 4.12Å; G182-Y218 VanDerWaalsContact O-CE2 3.23Å; G182-Y218 WeakPolarHBondContact O-CE2 3.46Å; G182-Y218 PolarHBondContact O-OH 2.92Å; I185-Y218 HydrophobicContact CB-CD2 4.22Å; I185-Y218 HydrophobicContact CB-CE1 4.14Å; I185-Y218 HydrophobicContact CB-CE2 3.75Å; I185-Y218 HydrophobicContact CD1-CD1 4.09Å; I185-Y218 HydrophobicContact CD1-CD2 4.4Å; I185-Y218 HydrophobicContact CD1-CE1 4.39Å; I185-Y218 HydrophobicContact CD1-CG 4.11Å; I185-Y218 HydrophobicContact CG1-CD1 4.11Å; I185-Y218 HydrophobicContact CG1-CE1 3.9Å; I185-Y218 HydrophobicContact CG1-CE2 4.32Å; I185-Y218 HydrophobicContact CG1-CG 4.43Å; I185-Y218 HydrophobicContact CG2-CE1 4.35Å; I185-Y218 HydrophobicContact CG2-CE2 4.18Å; I185-Y218 WeakPolarHBondContact CG2-OH 3.48Å; Y218-E225 PolarHBondContact OH-O 3.12Å; Y218-L226 HydrophobicContact CD1-CD2 3.66Å; Y218-L226 HydrophobicContact CE1-CB 4.18Å; Y218-L226 HydrophobicContact CE1-CD2 3.69Å; Y218-L226 HydrophobicContact CG-CD2 4.08Å; Y218-L227 PolarHBondContact OH-N 3.26Å; Y218-L227 VanDerWaalsContact OH-N 3.14Å; Y218-I232 HydrophobicContact CD1-CD1 4.46Å; Y218-R246 PolarHBondContact N-O 2.79Å; Y218-F247 AromaticContact CD1-CD1 3.92Å; Y218-F247 HydrophobicContact CD1-CD1 3.92Å; Y218-F247 AromaticContact CD1-CE1 3.88Å; Y218-F247 HydrophobicContact CD1-CE1 3.88Å; Y218-F247 HydrophobicContact CG-CD1 4.35Å; Y218-F247 CarbonylContact O-C 3.55Å; Y218-F247 VanDerWaalsContact O-CA 3.31Å; Y218-F247 WeakPolarHBondContact O-CA 3.44Å; Y218-H248 PolarHBondContact O-N 2.99Å
219	S	98.4	Very high	96.7	Very high	17 Å²	17	28.5 Å²	28.5	12%	0.119	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	134.2	177.6	-168.1	0	0	0	0	112.9	A180 G181 G182 H248	A180-S219 PolarHBondContact O-N 3.31Å; G181-S219 WeakPolarHBondContact CA-O 3.11Å; G182-S219 PolarHBondContact N-O 2.68Å; S219-H248 CarbonylContact C-O 3.23Å; S219-H248 WeakPolarHBondContact CA-O 3.45Å; S219-H248 PolarHBondContact OG-O 3.42Å
220	A	97.4	Very high	96.7	Very high	8 Å²	8	36 Å²	36	7%	0.066	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	173.1	172.3	0	0	0	0	0	111.2	E225 L226 H248 V249 T250	A220-E225 HydrophobicContact CB-CB 4.11Å; A220-L226 HydrophobicContact CB-CD2 3.63Å; A220-L226 HydrophobicContact CB-CG 4.11Å; A220-H248 PolarHBondContact N-O 2.98Å; A220-V249 WeakPolarHBondContact O-CA 3.08Å; A220-T250 PolarHBondContact O-N 2.85Å; A220-T250 VanDerWaalsContact O-N 3.11Å; A220-T250 PolarHBondContact O-OG1 3.05Å
221	K	95.6	Very high	96.9	Very high	111 Å²	111	33.1 Å²	33.1	48%	0.483	17%	0.167	S	C	.	.	S	Bend	trans	-62.7	-48.6	175.7	-177.2	177.1	172.3	168.9	0	110.7	T250 Q251	K221-T250 PolarHBondContact O-N 3.48Å; K221-Q251 HydrophobicContact CG-CB 3.82Å; K221-Q251 HydrophobicContact CG-CG 4.28Å; K221-Q251 CarbonylContact O-C 3.55Å; K221-Q251 VanDerWaalsContact O-C 3.23Å; K221-Q251 WeakPolarHBondContact O-CA 3.45Å; K221-Q251 PolarHBondContact O-N 3.19Å
222	N	96.1	Very high	97.1	Very high	30 Å²	30	32.9 Å²	32.9	16%	0.16	17%	0.166	C	C	.	.	S	Bend	trans	-153.6	176.4	-177.5	58.1	43.4	0	0	0	109.2	N224 E225 Q252	N222-N224 PolarHBondContact O-N 3.22Å; N222-N224 WeakPolarHBondContact OD1-CB 3.13Å; N222-N224 PolarHBondContact OD1-N 2.9Å; N222-E225 PolarHBondContact O-N 3.28Å; N222-E225 VanDerWaalsContact O-N 3.14Å; N222-E225 PolarHBondContact OD1-N 3.05Å; N222-E225 VanDerWaalsContact OD1-N 3.13Å; N222-Q252 VanDerWaalsContact CA-OE1 3.29Å
223	T	95.9	Very high	97.2	Very high	8 Å²	8	32.7 Å²	32.7	5%	0.049	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-67.3	-18	-177.8	53.3	0	0	0	0	114.4	E225 L226 K229 V249 Q252 I256 I260 V264	T223-E225 VanDerWaalsContact C-N 3.35Å; T223-L226 HydrophobicContact CG2-CD1 4.27Å; T223-K229 PolarHBondContact O-NZ 3.45Å; T223-V249 HydrophobicContact CG2-CG1 3.99Å; T223-Q252 PolarHBondContact OG1-NE2 3.06Å; T223-Q252 PolarHBondContact OG1-OE1 3.48Å; T223-I256 HydrophobicContact CG2-CG1 4.04Å; T223-I256 HydrophobicContact CG2-CG2 4.18Å; T223-I260 HydrophobicContact CG2-CD1 3.62Å; T223-V264 HydrophobicContact CG2-CG2 4.44Å
224	N	94.3	Very high	97.2	Very high	86 Å²	86	31.7 Å²	31.7	46%	0.46	16%	0.163	S	C	.	.	G	3₁₀ helix	trans	-77.1	-23.9	174.9	-65.2	-14.7	0	0	0	112.4	S79 N222	S79-N224 WeakPolarHBondContact CB-O 3.47Å; N222-N224 PolarHBondContact O-N 3.22Å; N222-N224 WeakPolarHBondContact OD1-CB 3.13Å; N222-N224 PolarHBondContact OD1-N 2.9Å
225	E	95.4	Very high	97.2	Very high	27 Å²	27	32.4 Å²	32.4	13%	0.126	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-93.3	1.4	178.2	-69.9	-78	116	0	0	113.1	T81 K135 Y218 A220 N222 T223 L227	T81-E225 WeakPolarHBondContact CG2-OE1 3.11Å; T81-E225 VanDerWaalsContact OG1-CD 3.31Å; T81-E225 PolarHBondContact OG1-OE1 2.67Å; T81-E225 PolarHBondContact OG1-OE2 3.18Å; T81-E225 VanDerWaalsContact OG1-OE2 3.13Å; K135-E225 IonicContact NZ-OE2 2.76Å; K135-E225 PolarHBondContact NZ-OE2 2.96Å; Y218-E225 PolarHBondContact OH-O 3.12Å; A220-E225 HydrophobicContact CB-CB 4.11Å; N222-E225 PolarHBondContact O-N 3.28Å; N222-E225 VanDerWaalsContact O-N 3.14Å; N222-E225 PolarHBondContact OD1-N 3.05Å; N222-E225 VanDerWaalsContact OD1-N 3.13Å; T223-E225 VanDerWaalsContact C-N 3.35Å; E225-L227 PolarHBondContact O-N 3.14Å
226	L	96.9	Very high	97.1	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.01	17%	0.166	C	C	.	.			trans	-77.9	108.2	169.9	-68	173.5	0	0	0	109.4	Y218 A220 T223 K229 F247 V249	Y218-L226 HydrophobicContact CD1-CD2 3.66Å; Y218-L226 HydrophobicContact CE1-CB 4.18Å; Y218-L226 HydrophobicContact CE1-CD2 3.69Å; Y218-L226 HydrophobicContact CG-CD2 4.08Å; A220-L226 HydrophobicContact CB-CD2 3.63Å; A220-L226 HydrophobicContact CB-CG 4.11Å; T223-L226 HydrophobicContact CG2-CD1 4.27Å; L226-K229 HydrophobicContact CB-CD 3.74Å; L226-K229 HydrophobicContact CB-CG 3.67Å; L226-K229 HydrophobicContact CD1-CD 4.33Å; L226-K229 WeakPolarHBondContact O-CE 3.47Å; L226-K229 WeakPolarHBondContact O-CG 3.33Å; L226-F247 HydrophobicContact CD1-CB 3.87Å; L226-F247 HydrophobicContact CD1-CD1 3.93Å; L226-F247 HydrophobicContact CD1-CD2 4.38Å; L226-F247 HydrophobicContact CD1-CG 3.81Å; L226-F247 HydrophobicContact CD2-CB 4.28Å; L226-F247 HydrophobicContact CD2-CD1 3.73Å; L226-F247 HydrophobicContact CD2-CE1 4.48Å; L226-F247 HydrophobicContact CD2-CG 4.29Å; L226-F247 HydrophobicContact CG-CD1 4.39Å; L226-V249 HydrophobicContact CD1-CG1 4.37Å
227	L	97.9	Very high	97	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.01	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	155.7	176.6	-49.2	-179.4	0	0	0	111.5	E78 V82 V183 I185 Y218 E225 K229	E78-L227 HydrophobicContact CB-CD2 4.23Å; E78-L227 HydrophobicContact CG-CB 3.9Å; E78-L227 HydrophobicContact CG-CD2 3.76Å; E78-L227 HydrophobicContact CG-CG 4.3Å; V82-L227 HydrophobicContact CB-CD1 4.37Å; V82-L227 HydrophobicContact CB-CD2 3.84Å; V82-L227 HydrophobicContact CG1-CD1 3.89Å; V82-L227 HydrophobicContact CG1-CD2 4.12Å; V82-L227 HydrophobicContact CG2-CD1 4.14Å; V82-L227 HydrophobicContact CG2-CD2 3.86Å; V183-L227 HydrophobicContact CG1-CD1 4.21Å; I185-L227 HydrophobicContact CG2-CB 4.11Å; I185-L227 HydrophobicContact CG2-CD1 3.84Å; I185-L227 HydrophobicContact CG2-CG 4.3Å; Y218-L227 PolarHBondContact OH-N 3.26Å; Y218-L227 VanDerWaalsContact OH-N 3.14Å; E225-L227 PolarHBondContact O-N 3.14Å; L227-K229 PolarHBondContact O-N 3.09Å
228	F	97.9	Very high	96.9	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.4	18.7	171.9	-42.6	-59	0	0	0	115.6	E78 C118 A133 I185 F189 K230 N231 I232	E78-F228 VanDerWaalsContact CD-CD1 3.5Å; E78-F228 HydrophobicContact CG-CD1 4.17Å; E78-F228 HydrophobicContact CG-CE1 4.02Å; E78-F228 WeakPolarHBondContact OE1-CA 3.21Å; E78-F228 WeakPolarHBondContact OE1-CD1 3.18Å; E78-F228 PolarHBondContact OE1-N 2.74Å; C118-F228 HydrophobicContact CB-CE2 4.26Å; C118-F228 HydrophobicContact CB-CZ 3.83Å; A133-F228 HydrophobicContact CB-CE1 4.35Å; A133-F228 HydrophobicContact CB-CZ 3.64Å; I185-F228 HydrophobicContact CG1-CD2 4.12Å; I185-F228 HydrophobicContact CG2-CD2 4.2Å; I185-F228 HydrophobicContact CG2-CE2 4Å; F189-F228 HydrophobicContact CB-CD2 4.06Å; F189-F228 HydrophobicContact CB-CE2 4.25Å; F189-F228 HydrophobicContact CD1-CB 4.32Å; F189-F228 HydrophobicContact CD1-CD1 4.05Å; F189-F228 AromaticContact CD1-CD2 3.58Å; F189-F228 HydrophobicContact CD1-CD2 3.58Å; F189-F228 HydrophobicContact CD1-CE1 4.24Å; F189-F228 AromaticContact CD1-CE2 3.78Å; F189-F228 HydrophobicContact CD1-CE2 3.78Å; F189-F228 AromaticContact CD1-CG 3.71Å; F189-F228 HydrophobicContact CD1-CG 3.71Å; F189-F228 HydrophobicContact CD1-CZ 4.1Å; F189-F228 HydrophobicContact CD2-CB 4.2Å; F189-F228 HydrophobicContact CD2-CD2 4.3Å; F189-F228 HydrophobicContact CD2-CG 4.39Å; F189-F228 HydrophobicContact CE1-CB 4.09Å; F189-F228 AromaticContact CE1-CD1 3.79Å; F189-F228 HydrophobicContact CE1-CD1 3.79Å; F189-F228 HydrophobicContact CE1-CD2 4.09Å; F189-F228 HydrophobicContact CE1-CE1 4.2Å; F189-F228 HydrophobicContact CE1-CE2 4.48Å; F189-F228 AromaticContact CE1-CG 3.72Å; F189-F228 HydrophobicContact CE1-CG 3.72Å; F189-F228 HydrophobicContact CE2-CB 3.97Å; F189-F228 HydrophobicContact CE2-CG 4.4Å; F189-F228 HydrophobicContact CG-CB 4.39Å; F189-F228 AromaticContact CG-CD2 3.71Å; F189-F228 HydrophobicContact CG-CD2 3.71Å; F189-F228 HydrophobicContact CG-CE2 4.17Å; F189-F228 HydrophobicContact CG-CG 4.08Å; F189-F228 HydrophobicContact CZ-CB 3.92Å; F189-F228 HydrophobicContact CZ-CD1 4.37Å; F189-F228 HydrophobicContact CZ-CG 4.08Å; F228-K230 VanDerWaalsContact C-N 3.29Å; F228-K230 PolarHBondContact O-N 3.46Å; F228-K230 VanDerWaalsContact O-N 3.17Å; F228-N231 HydrophobicContact CB-CB 4.41Å; F228-N231 PolarHBondContact O-N 3.01Å; F228-I232 HydrophobicContact CB-CD1 4.2Å; F228-I232 HydrophobicContact CB-CG1 4.34Å; F228-I232 WeakPolarHBondContact O-CG1 3.36Å; F228-I232 PolarHBondContact O-N 3Å
229	K	95.5	Very high	96.8	Very high	59 Å²	59	41.6 Å²	41.6	26%	0.257	23%	0.225	S	C	.	.	H	α-helix	trans	-47	-50.4	-176.3	-76.1	175.2	-72.9	-168.8	0	112.9	T223 L226 L227 N231 I232 L233 I260	T223-K229 PolarHBondContact O-NZ 3.45Å; L226-K229 HydrophobicContact CB-CD 3.74Å; L226-K229 HydrophobicContact CB-CG 3.67Å; L226-K229 HydrophobicContact CD1-CD 4.33Å; L226-K229 WeakPolarHBondContact O-CE 3.47Å; L226-K229 WeakPolarHBondContact O-CG 3.33Å; L227-K229 PolarHBondContact O-N 3.09Å; K229-N231 PolarHBondContact O-N 3.38Å; K229-I232 PolarHBondContact O-N 3.42Å; K229-L233 WeakPolarHBondContact O-CB 3.2Å; K229-L233 WeakPolarHBondContact O-CG 3.5Å; K229-L233 PolarHBondContact O-N 2.88Å; K229-I260 HydrophobicContact CD-CD1 4.36Å
230	K	95.4	Very high	96.7	Very high	167 Å²	167	45.7 Å²	45.7	73%	0.726	25%	0.251	S	S	*	.	H	α-helix	trans	-63.2	-42.8	-178.3	-67.5	-174.8	178	-178.5	0	111.7	F228 G234	F228-K230 VanDerWaalsContact C-N 3.29Å; F228-K230 PolarHBondContact O-N 3.46Å; F228-K230 VanDerWaalsContact O-N 3.17Å; K230-G234 PolarHBondContact O-N 2.87Å
231	N	97.8	Very high	96.4	Very high	70 Å²	70	48.3 Å²	48.3	37%	0.374	28%	0.278	S	S	.	.	H	α-helix	trans	-65.3	-44.7	177.4	-61.4	86.4	0	0	0	111.5	F189 F228 K229 G234 L235	F189-N231 HydrophobicContact CE2-CB 3.85Å; F189-N231 HydrophobicContact CZ-CB 3.55Å; F228-N231 HydrophobicContact CB-CB 4.41Å; F228-N231 PolarHBondContact O-N 3.01Å; K229-N231 PolarHBondContact O-N 3.38Å; N231-G234 PolarHBondContact O-N 3.03Å; N231-L235 WeakPolarHBondContact O-CG 3.41Å; N231-L235 PolarHBondContact O-N 3.14Å
232	I	98.3	Very high	96.4	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-61.4	-46.3	178.5	-66.6	165.9	0	0	0	110.5	I185 F189 L192 L216 Y218 F228 K229 G234 L235 M236 C245 F247	I185-I232 HydrophobicContact CD1-CD1 4.49Å; F189-I232 HydrophobicContact CD2-CG1 4.2Å; F189-I232 HydrophobicContact CE2-CG1 4.17Å; L192-I232 HydrophobicContact CD2-CG1 4.5Å; L216-I232 HydrophobicContact CD2-CD1 3.94Å; L216-I232 HydrophobicContact CD2-CG1 4.36Å; L216-I232 HydrophobicContact CD2-CG2 4.21Å; Y218-I232 HydrophobicContact CD1-CD1 4.46Å; F228-I232 HydrophobicContact CB-CD1 4.2Å; F228-I232 HydrophobicContact CB-CG1 4.34Å; F228-I232 WeakPolarHBondContact O-CG1 3.36Å; F228-I232 PolarHBondContact O-N 3Å; K229-I232 PolarHBondContact O-N 3.42Å; I232-G234 VanDerWaalsContact C-N 3.33Å; I232-G234 PolarHBondContact O-N 2.84Å; I232-L235 PolarHBondContact O-N 3.31Å; I232-M236 HydrophobicContact CG2-SD 4.24Å; I232-M236 WeakPolarHBondContact O-CG 3.31Å; I232-M236 PolarHBondContact O-N 2.97Å; I232-C245 HydrophobicContact CG2-CB 3.78Å; I232-F247 HydrophobicContact CD1-CE1 4.23Å; I232-F247 HydrophobicContact CG2-CE1 4.49Å; I232-F247 HydrophobicContact CG2-CZ 4.05Å
233	L	97.1	Very high	96.5	Very high	9 Å²	9	45.2 Å²	45.2	5%	0.047	26%	0.264	C	S	.	.	H	α-helix	trans	-62.4	-40.7	174.9	-70	179.7	0	0	0	112	K229 L235 M236 N237 E259 I260 Y263	K229-L233 WeakPolarHBondContact O-CB 3.2Å; K229-L233 WeakPolarHBondContact O-CG 3.5Å; K229-L233 PolarHBondContact O-N 2.88Å; L233-L235 VanDerWaalsContact C-N 3.33Å; L233-L235 PolarHBondContact O-N 2.8Å; L233-M236 HydrophobicContact CD2-SD 4.23Å; L233-M236 PolarHBondContact O-N 3.47Å; L233-N237 VanDerWaalsContact O-CG 3.26Å; L233-N237 PolarHBondContact O-N 2.8Å; L233-N237 PolarHBondContact O-ND2 3.35Å; L233-E259 HydrophobicContact CD1-CG 4.02Å; L233-I260 HydrophobicContact CD1-CG2 3.95Å; L233-Y263 HydrophobicContact CD2-CD2 3.66Å; L233-Y263 HydrophobicContact CD2-CE2 3.67Å; L233-Y263 HydrophobicContact CD2-CG 4.41Å
234	G	97.9	Very high	96.6	Very high	37 Å²	37	47.1 Å²	47.1	38%	0.381	28%	0.275	S	S	.	.	H	α-helix	trans	-57.5	-44.8	174.5	0	0	0	0	0	112.4	K230 N231 I232 N237 A238	K230-G234 PolarHBondContact O-N 2.87Å; N231-G234 PolarHBondContact O-N 3.03Å; I232-G234 VanDerWaalsContact C-N 3.33Å; I232-G234 PolarHBondContact O-N 2.84Å; G234-N237 PolarHBondContact O-N 2.81Å; G234-A238 WeakPolarHBondContact O-CB 3.47Å; G234-A238 PolarHBondContact O-N 3.01Å
235	L	98	Very high	96.8	Very high	20 Å²	20	43.1 Å²	43.1	11%	0.105	25%	0.254	C	S	.	.	H	α-helix	trans	-65.7	-40.8	176.1	-69.2	170.3	0	0	0	112.2	F189 L192 L193 A196 N231 I232 L233 N237 A238 F239 I243	F189-L235 HydrophobicContact CE2-CD1 4.36Å; L192-L235 HydrophobicContact CD2-CD1 3.72Å; L192-L235 HydrophobicContact CG-CD1 3.85Å; L193-L235 HydrophobicContact CD2-CD1 4.02Å; A196-L235 HydrophobicContact CB-CD2 3.88Å; N231-L235 WeakPolarHBondContact O-CG 3.41Å; N231-L235 PolarHBondContact O-N 3.14Å; I232-L235 PolarHBondContact O-N 3.31Å; L233-L235 VanDerWaalsContact C-N 3.33Å; L233-L235 PolarHBondContact O-N 2.8Å; L235-N237 VanDerWaalsContact C-N 3.27Å; L235-N237 PolarHBondContact O-N 2.93Å; L235-A238 PolarHBondContact O-N 3.42Å; L235-F239 HydrophobicContact CD2-CD2 4.34Å; L235-F239 HydrophobicContact CD2-CE2 4.04Å; L235-F239 WeakPolarHBondContact O-CD2 3.35Å; L235-F239 PolarHBondContact O-N 3.15Å; L235-I243 HydrophobicContact CB-CD1 4.24Å; L235-I243 HydrophobicContact CB-CG2 4.45Å
236	M	97.6	Very high	97	Very high	21 Å²	21	46.1 Å²	46.1	10%	0.103	26%	0.264	C	S	.	.	H	α-helix	trans	-60.8	-38.6	175.2	-69.9	171.5	57.2	0	0	112.2	I232 L233 F239 I243 C245 Y263	I232-M236 HydrophobicContact CG2-SD 4.24Å; I232-M236 WeakPolarHBondContact O-CG 3.31Å; I232-M236 PolarHBondContact O-N 2.97Å; L233-M236 HydrophobicContact CD2-SD 4.23Å; L233-M236 PolarHBondContact O-N 3.47Å; M236-F239 CarbonylContact O-C 3.55Å; M236-I243 HydrophobicContact CG-CG2 4.26Å; M236-C245 HydrophobicContact CE-CB 4.36Å; M236-C245 HydrophobicContact CG-CB 4.43Å; M236-C245 HydrophobicContact SD-CB 3.36Å; M236-C245 WeakPolarHBondContact SD-CB 3.34Å; M236-Y263 HydrophobicContact CE-CD1 3.6Å; M236-Y263 HydrophobicContact CE-CE1 3.38Å; M236-Y263 HydrophobicContact CE-CG 4.33Å
237	N	96.8	Very high	97.1	Very high	115 Å²	115	46 Å²	46	62%	0.615	26%	0.264	S	S	*	.	H	α-helix	trans	-73.2	-36.9	178.1	-68.1	-19.8	0	0	0	112.4	L233 G234 L235	L233-N237 VanDerWaalsContact O-CG 3.26Å; L233-N237 PolarHBondContact O-N 2.8Å; L233-N237 PolarHBondContact O-ND2 3.35Å; G234-N237 PolarHBondContact O-N 2.81Å; L235-N237 VanDerWaalsContact C-N 3.27Å; L235-N237 PolarHBondContact O-N 2.93Å
238	A	96.9	Very high	97.1	Very high	65 Å²	65	45.9 Å²	45.9	54%	0.537	26%	0.263	S	S	.	.	H	α-helix	trans	-72.4	-29.6	178.1	0	0	0	0	0	112.8	G234 L235 P240	G234-A238 WeakPolarHBondContact O-CB 3.47Å; G234-A238 PolarHBondContact O-N 3.01Å; L235-A238 PolarHBondContact O-N 3.42Å; A238-P240 VanDerWaalsContact C-CD 3.43Å; A238-P240 WeakPolarHBondContact O-CD 3.46Å
239	F	96.3	Very high	97.1	Very high	20 Å²	20	46 Å²	46	9%	0.088	26%	0.264	C	S	.	.	S	Bend	trans	-126.1	61.5	-175.6	-58.4	-82.4	0	0	0	111.9	A196 H199 E200 L235 M236 G241 K242 I243	A196-F239 HydrophobicContact CB-CD2 4.49Å; A196-F239 HydrophobicContact CB-CE2 3.67Å; A196-F239 HydrophobicContact CB-CZ 3.85Å; H199-F239 HydrophobicContact CB-CE1 4.22Å; H199-F239 AromaticContact CG-CE1 3.87Å; H199-F239 AromaticContact ND1-CE1 3.87Å; E200-F239 HydrophobicContact CG-CZ 4.46Å; L235-F239 HydrophobicContact CD2-CD2 4.34Å; L235-F239 HydrophobicContact CD2-CE2 4.04Å; L235-F239 WeakPolarHBondContact O-CD2 3.35Å; L235-F239 PolarHBondContact O-N 3.15Å; M236-F239 CarbonylContact O-C 3.55Å; F239-G241 PolarHBondContact O-N 2.86Å; F239-K242 HydrophobicContact CB-CB 4.08Å; F239-K242 PolarHBondContact O-N 3.01Å; F239-I243 HydrophobicContact CB-CB 4.16Å; F239-I243 HydrophobicContact CB-CD1 3.98Å; F239-I243 HydrophobicContact CB-CG1 3.82Å; F239-I243 HydrophobicContact CD2-CD1 3.74Å; F239-I243 HydrophobicContact CG-CD1 4Å; F239-I243 HydrophobicContact CG-CG1 4.36Å; F239-I243 PolarHBondContact O-N 2.8Å
240	P	94.9	Very high	97.1	Very high	102 Å²	102	45.9 Å²	45.9	66%	0.662	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	131.4	-175	26.1	-34.5	0	0	0	111.4	A238 K242	A238-P240 VanDerWaalsContact C-CD 3.43Å; A238-P240 WeakPolarHBondContact O-CD 3.46Å; P240-K242 PolarHBondContact O-N 3.21Å; P240-K242 VanDerWaalsContact O-N 3.09Å
241	G	91.8	Very high	97.1	Very high	63 Å²	63	43.7 Å²	43.7	65%	0.649	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.9	-14.5	-177.3	0	0	0	0	0	115.1	F239	F239-G241 PolarHBondContact O-N 2.86Å
242	K	95.8	Very high	97	Very high	73 Å²	73	41.7 Å²	41.7	32%	0.317	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-41.7	177.3	-74.3	-75.9	-172.9	172.8	0	112.1	M211 G212 T213 V214 F239 P240	M211-K242 HydrophobicContact CE-CB 3.86Å; M211-K242 PolarHBondContact O-NZ 2.9Å; M211-K242 HydrophobicContact SD-CB 4.38Å; G212-K242 WeakPolarHBondContact O-CD 3.45Å; G212-K242 PolarHBondContact O-NZ 2.82Å; T213-K242 CarbonylContact C-O 3.55Å; T213-K242 WeakPolarHBondContact CA-O 3.25Å; V214-K242 PolarHBondContact N-O 3.47Å; F239-K242 HydrophobicContact CB-CB 4.08Å; F239-K242 PolarHBondContact O-N 3.01Å; P240-K242 PolarHBondContact O-N 3.21Å; P240-K242 VanDerWaalsContact O-N 3.09Å
243	I	98.4	Very high	96.7	Very high	3 Å²	3	47.4 Å²	47.4	2%	0.015	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	124.4	173.7	-59.2	-176.6	0	0	0	108.9	L192 M211 V214 L235 M236 F239	L192-I243 HydrophobicContact CD1-CD1 4.1Å; L192-I243 HydrophobicContact CD1-CG1 4.46Å; L192-I243 HydrophobicContact CD1-CG2 3.81Å; M211-I243 HydrophobicContact CE-CD1 4.1Å; M211-I243 HydrophobicContact CE-CG1 3.53Å; V214-I243 HydrophobicContact CB-CG1 4.5Å; L235-I243 HydrophobicContact CB-CD1 4.24Å; L235-I243 HydrophobicContact CB-CG2 4.45Å; M236-I243 HydrophobicContact CG-CG2 4.26Å; F239-I243 HydrophobicContact CB-CB 4.16Å; F239-I243 HydrophobicContact CB-CD1 3.98Å; F239-I243 HydrophobicContact CB-CG1 3.82Å; F239-I243 HydrophobicContact CD2-CD1 3.74Å; F239-I243 HydrophobicContact CG-CD1 4Å; F239-I243 HydrophobicContact CG-CG1 4.36Å; F239-I243 PolarHBondContact O-N 2.8Å
244	T	98.3	Very high	96.4	Very high	48 Å²	48	50 Å²	50	29%	0.294	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	148.6	173.7	66.4	0	0	0	0	111.2	V214 K215 L216	V214-T244 PolarHBondContact O-N 2.86Å; K215-T244 WeakPolarHBondContact CA-O 3.5Å; K215-T244 WeakPolarHBondContact CD-OG1 3.28Å; K215-T244 PolarHBondContact NZ-OG1 3.23Å; L216-T244 PolarHBondContact N-O 3.06Å
245	C	98.5	Very high	96.1	Very high	2 Å²	2	56.6 Å²	56.6	1%	0.014	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	150.1	177.6	-171.6	0	0	0	0	111.4	L216 I232 M236 F247	L216-C245 HydrophobicContact CB-CB 4.3Å; L216-C245 CarbonylContact O-C 3.58Å; L216-C245 VanDerWaalsContact O-CA 3.24Å; L216-C245 WeakPolarHBondContact O-CA 3.5Å; I232-C245 HydrophobicContact CG2-CB 3.78Å; M236-C245 HydrophobicContact CE-CB 4.36Å; M236-C245 HydrophobicContact CG-CB 4.43Å; M236-C245 HydrophobicContact SD-CB 3.36Å; M236-C245 WeakPolarHBondContact SD-CB 3.34Å; C245-F247 WeakPolarHBondContact SG-CE1 3.45Å
246	R	98.4	Very high	95.9	Very high	90 Å²	90	56.7 Å²	56.7	34%	0.34	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	126.8	159.8	-75.5	-72	174.3	-143.7	0.1	108.8	L216 Y217 Y218 P262 Y263	L216-R246 PolarHBondContact O-N 2.98Å; Y217-R246 WeakPolarHBondContact CA-O 3.06Å; Y217-R246 HydrophobicContact CD1-CB 3.77Å; Y217-R246 HydrophobicContact CE1-CB 3.85Å; Y217-R246 HydrophobicContact CE1-CG 4.14Å; Y218-R246 PolarHBondContact N-O 2.79Å; R246-P262 PolarHBondContact NH1-O 3.29Å; R246-Y263 VanDerWaalsContact NH1-CA 3.31Å
247	F	98.5	Very high	95.5	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	136	174.8	-59.2	-63.9	0	0	0	109.8	Y218 L226 I232 C245 Y263 V264 T265	Y218-F247 AromaticContact CD1-CD1 3.92Å; Y218-F247 HydrophobicContact CD1-CD1 3.92Å; Y218-F247 AromaticContact CD1-CE1 3.88Å; Y218-F247 HydrophobicContact CD1-CE1 3.88Å; Y218-F247 HydrophobicContact CG-CD1 4.35Å; Y218-F247 CarbonylContact O-C 3.55Å; Y218-F247 VanDerWaalsContact O-CA 3.31Å; Y218-F247 WeakPolarHBondContact O-CA 3.44Å; L226-F247 HydrophobicContact CD1-CB 3.87Å; L226-F247 HydrophobicContact CD1-CD1 3.93Å; L226-F247 HydrophobicContact CD1-CD2 4.38Å; L226-F247 HydrophobicContact CD1-CG 3.81Å; L226-F247 HydrophobicContact CD2-CB 4.28Å; L226-F247 HydrophobicContact CD2-CD1 3.73Å; L226-F247 HydrophobicContact CD2-CE1 4.48Å; L226-F247 HydrophobicContact CD2-CG 4.29Å; L226-F247 HydrophobicContact CG-CD1 4.39Å; I232-F247 HydrophobicContact CD1-CE1 4.23Å; I232-F247 HydrophobicContact CG2-CE1 4.49Å; I232-F247 HydrophobicContact CG2-CZ 4.05Å; C245-F247 WeakPolarHBondContact SG-CE1 3.45Å; F247-Y263 PolarHBondContact N-O 2.96Å; F247-V264 HydrophobicContact CB-CG2 3.96Å; F247-V264 HydrophobicContact CD2-CG2 4.22Å; F247-V264 CarbonylContact O-C 3.53Å; F247-V264 WeakPolarHBondContact O-CA 3.39Å; F247-T265 PolarHBondContact O-N 2.83Å
248	H	98.4	Very high	95.3	Very high	0 Å²	0	62 Å²	62	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	113.7	177.3	-76.3	-100.5	0	0	0	110.2	Y217 Y218 S219 A220 T265 G267 R268 I269 D273	Y217-H248 AromaticContact CD1-NE2 3.67Å; Y218-H248 PolarHBondContact O-N 2.99Å; S219-H248 CarbonylContact C-O 3.23Å; S219-H248 WeakPolarHBondContact CA-O 3.45Å; S219-H248 PolarHBondContact OG-O 3.42Å; A220-H248 PolarHBondContact N-O 2.98Å; H248-T265 VanDerWaalsContact CA-O 3.32Å; H248-T265 WeakPolarHBondContact CA-O 3.41Å; H248-G267 WeakPolarHBondContact CB-O 3.22Å; H248-R268 PolarHBondContact ND1-O 3.13Å; H248-I269 HydrophobicContact CB-CG1 4.07Å; H248-D273 IonicContact CE1-OD2 3.74Å; H248-D273 PolarHBondContact CE1-OD2 2.75Å; H248-D273 IonicContact NE2-OD2 2.86Å
249	V	97.9	Very high	95	Very high	2 Å²	2	64.6 Å²	64.6	1%	0.012	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	125	-179.5	-65.4	0	0	0	0	110.7	A220 T223 L226 Q252 V264 T265 E266 G267	A220-V249 WeakPolarHBondContact O-CA 3.08Å; T223-V249 HydrophobicContact CG2-CG1 3.99Å; L226-V249 HydrophobicContact CD1-CG1 4.37Å; V249-Q252 HydrophobicContact CB-CB 4.07Å; V249-Q252 HydrophobicContact CG2-CB 3.59Å; V249-Q252 HydrophobicContact CG2-CG 4.16Å; V249-V264 HydrophobicContact CG1-CG1 4.2Å; V249-V264 HydrophobicContact CG2-CG1 3.59Å; V249-T265 PolarHBondContact N-O 3.27Å; V249-E266 HydrophobicContact CG2-CG 3.99Å; V249-E266 WeakPolarHBondContact O-CA 3.43Å; V249-G267 PolarHBondContact O-N 3.07Å
250	T	96.8	Very high	94.8	Very high	57 Å²	57	64.1 Å²	64.1	35%	0.35	35%	0.354	S	S	.	.	S	Bend	trans	-97.6	-17.8	-169.3	52.8	0	0	0	0	114.3	A220 K221 R268	A220-T250 PolarHBondContact O-N 2.85Å; A220-T250 VanDerWaalsContact O-N 3.11Å; A220-T250 PolarHBondContact O-OG1 3.05Å; K221-T250 PolarHBondContact O-N 3.48Å; T250-R268 HydrophobicContact CG2-CG 4.02Å
251	Q	95.6	Very high	94.8	Very high	121 Å²	121	64.4 Å²	64.4	57%	0.565	35%	0.346	S	S	*	.	S	Bend	trans	-146.7	52.5	-178.6	-56.7	179.1	29	0	0	109.6	K221	K221-Q251 HydrophobicContact CG-CB 3.82Å; K221-Q251 HydrophobicContact CG-CG 4.28Å; K221-Q251 CarbonylContact O-C 3.55Å; K221-Q251 VanDerWaalsContact O-C 3.23Å; K221-Q251 WeakPolarHBondContact O-CA 3.45Å; K221-Q251 PolarHBondContact O-N 3.19Å
252	Q	95.6	Very high	95.1	Very high	27 Å²	27	65.3 Å²	65.3	13%	0.126	34%	0.34	C	S	.	.			trans	-79.3	123.4	175.9	-175.3	65.7	12.8	0	0	109.4	N222 T223 V249 S254 I256	N222-Q252 VanDerWaalsContact CA-OE1 3.29Å; T223-Q252 PolarHBondContact OG1-NE2 3.06Å; T223-Q252 PolarHBondContact OG1-OE1 3.48Å; V249-Q252 HydrophobicContact CB-CB 4.07Å; V249-Q252 HydrophobicContact CG2-CB 3.59Å; V249-Q252 HydrophobicContact CG2-CG 4.16Å; Q252-S254 PolarHBondContact NE2-O 3.42Å; Q252-S254 PolarHBondContact NE2-OG 3.35Å; Q252-S254 VanDerWaalsContact NE2-OG 3.14Å; Q252-I256 HydrophobicContact CG-CD1 4.17Å; Q252-I256 HydrophobicContact CG-CG1 3.89Å
253	S	91.5	Very high	95.1	Very high	121 Å²	121	65 Å²	65	85%	0.846	34%	0.338	S	S	*	.			trans	-119.6	-21.6	177.1	57	0	0	0	0	113.2
254	S	91.1	Very high	95.1	Very high	62 Å²	62	65.8 Å²	65.8	43%	0.434	34%	0.343	S	S	.	.	S	Bend	trans	-93.8	162.4	178.1	58.3	0	0	0	0	112	Q252 I256	Q252-S254 PolarHBondContact NE2-O 3.42Å; Q252-S254 PolarHBondContact NE2-OG 3.35Å; Q252-S254 VanDerWaalsContact NE2-OG 3.14Å; S254-I256 PolarHBondContact O-N 2.9Å
255	Q	91.6	Very high	95	Very high	176 Å²	176	66.1 Å²	66.1	82%	0.822	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-61.6	132.5	173.3	-170.6	173.7	18.9	0	0	110.7
256	I	92.5	Very high	94.9	Very high	23 Å²	23	72.5 Å²	72.5	12%	0.118	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-76.2	133	174.6	-61.8	166	0	0	0	108.7	T223 Q252 S254 K258 I260 Q261 V264	T223-I256 HydrophobicContact CG2-CG1 4.04Å; T223-I256 HydrophobicContact CG2-CG2 4.18Å; Q252-I256 HydrophobicContact CG-CD1 4.17Å; Q252-I256 HydrophobicContact CG-CG1 3.89Å; S254-I256 PolarHBondContact O-N 2.9Å; I256-K258 PolarHBondContact O-N 3.34Å; I256-I260 HydrophobicContact CG2-CD1 3.99Å; I256-I260 HydrophobicContact CG2-CG1 3.71Å; I256-Q261 HydrophobicContact CG2-CB 3.95Å; I256-Q261 HydrophobicContact CG2-CG 4.43Å; I256-V264 HydrophobicContact CD1-CB 4.24Å; I256-V264 HydrophobicContact CD1-CG1 3.66Å; I256-V264 HydrophobicContact CG2-CB 4.45Å; I256-V264 HydrophobicContact CG2-CG2 4.13Å
257	C	90.5	Very high	94.8	Very high	73 Å²	73	69.7 Å²	69.7	49%	0.493	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-59.6	136.1	175	178.1	0	0	0	0	111	E259 I260 Q261	C257-E259 PolarHBondContact O-N 3.41Å; C257-E259 VanDerWaalsContact O-N 3.09Å; C257-I260 HydrophobicContact CB-CG1 4.2Å; C257-I260 WeakPolarHBondContact O-CG1 3.23Å; C257-I260 PolarHBondContact O-N 2.92Å; C257-I260 VanDerWaalsContact O-N 3.07Å; C257-Q261 WeakPolarHBondContact O-CB 3.28Å; C257-Q261 PolarHBondContact O-N 3.35Å
258	K	92.1	Very high	94.8	Very high	173 Å²	173	79.6 Å²	79.6	75%	0.752	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-32.2	-178.4	-68.6	-175.4	178.1	-179.5	0	113.7	I256 P262	I256-K258 PolarHBondContact O-N 3.34Å; K258-P262 VanDerWaalsContact O-CD 3.29Å; K258-P262 WeakPolarHBondContact O-CD 3.19Å
259	E	90.5	Very high	94.7	Very high	121 Å²	121	80.5 Å²	80.5	57%	0.565	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-40.7	180	-173.1	-176.2	176.7	0	0	112.5	L233 C257	L233-E259 HydrophobicContact CD1-CG 4.02Å; C257-E259 PolarHBondContact O-N 3.41Å; C257-E259 VanDerWaalsContact O-N 3.09Å
260	I	93	Very high	94.7	Very high	10 Å²	10	82.5 Å²	82.5	5%	0.051	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-17.9	-178.6	59.9	167.4	0	0	0	112.9	T223 K229 L233 I256 C257 P262 Y263 V264	T223-I260 HydrophobicContact CG2-CD1 3.62Å; K229-I260 HydrophobicContact CD-CD1 4.36Å; L233-I260 HydrophobicContact CD1-CG2 3.95Å; I256-I260 HydrophobicContact CG2-CD1 3.99Å; I256-I260 HydrophobicContact CG2-CG1 3.71Å; C257-I260 HydrophobicContact CB-CG1 4.2Å; C257-I260 WeakPolarHBondContact O-CG1 3.23Å; C257-I260 PolarHBondContact O-N 2.92Å; C257-I260 VanDerWaalsContact O-N 3.07Å; I260-P262 VanDerWaalsContact C-N 3.32Å; I260-Y263 WeakPolarHBondContact O-CA 3.43Å; I260-Y263 WeakPolarHBondContact O-CB 3.42Å; I260-Y263 PolarHBondContact O-N 3.49Å; I260-V264 HydrophobicContact CB-CG2 4.31Å; I260-V264 HydrophobicContact CD1-CG2 4.2Å; I260-V264 HydrophobicContact CG1-CG2 4.27Å; I260-V264 WeakPolarHBondContact O-CG2 3.37Å; I260-V264 PolarHBondContact O-N 3.21Å
261	Q	94.9	Very high	94.7	Very high	107 Å²	107	84.2 Å²	84.2	50%	0.5	43%	0.434	S	S	.	.	G	3₁₀ helix	trans	-50.3	-42.9	-175.9	-173.2	179.6	9.2	0	0	113.7	I256 C257 Y263 V264	I256-Q261 HydrophobicContact CG2-CB 3.95Å; I256-Q261 HydrophobicContact CG2-CG 4.43Å; C257-Q261 WeakPolarHBondContact O-CB 3.28Å; C257-Q261 PolarHBondContact O-N 3.35Å; Q261-Y263 PolarHBondContact O-N 3.03Å; Q261-V264 PolarHBondContact O-N 2.96Å
262	P	96.3	Very high	94.7	Very high	82 Å²	82	85.1 Å²	85.1	53%	0.532	44%	0.438	S	S	.	.	G	3₁₀ helix	trans	-62.9	-16.4	177.3	-23	34.8	0	0	0	113.9	R246 K258 I260	R246-P262 PolarHBondContact NH1-O 3.29Å; K258-P262 VanDerWaalsContact O-CD 3.29Å; K258-P262 WeakPolarHBondContact O-CD 3.19Å; I260-P262 VanDerWaalsContact C-N 3.32Å
263	Y	96.7	Very high	94.8	Very high	66 Å²	66	84.9 Å²	84.9	26%	0.259	44%	0.438	S	S	.	.	G	3₁₀ helix	trans	-104.6	-7.1	-176	-52.8	-66.1	0	0	0	114.1	L233 M236 R246 F247 I260 Q261	L233-Y263 HydrophobicContact CD2-CD2 3.66Å; L233-Y263 HydrophobicContact CD2-CE2 3.67Å; L233-Y263 HydrophobicContact CD2-CG 4.41Å; M236-Y263 HydrophobicContact CE-CD1 3.6Å; M236-Y263 HydrophobicContact CE-CE1 3.38Å; M236-Y263 HydrophobicContact CE-CG 4.33Å; R246-Y263 VanDerWaalsContact NH1-CA 3.31Å; F247-Y263 PolarHBondContact N-O 2.96Å; I260-Y263 WeakPolarHBondContact O-CA 3.43Å; I260-Y263 WeakPolarHBondContact O-CB 3.42Å; I260-Y263 PolarHBondContact O-N 3.49Å; Q261-Y263 PolarHBondContact O-N 3.03Å
264	V	97.6	Very high	95.2	Very high	21 Å²	21	79.1 Å²	79.1	13%	0.127	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	132.8	-174.4	177.6	0	0	0	0	110.9	T223 F247 V249 I256 I260 Q261	T223-V264 HydrophobicContact CG2-CG2 4.44Å; F247-V264 HydrophobicContact CB-CG2 3.96Å; F247-V264 HydrophobicContact CD2-CG2 4.22Å; F247-V264 CarbonylContact O-C 3.53Å; F247-V264 WeakPolarHBondContact O-CA 3.39Å; V249-V264 HydrophobicContact CG1-CG1 4.2Å; V249-V264 HydrophobicContact CG2-CG1 3.59Å; I256-V264 HydrophobicContact CD1-CB 4.24Å; I256-V264 HydrophobicContact CD1-CG1 3.66Å; I256-V264 HydrophobicContact CG2-CB 4.45Å; I256-V264 HydrophobicContact CG2-CG2 4.13Å; I260-V264 HydrophobicContact CB-CG2 4.31Å; I260-V264 HydrophobicContact CD1-CG2 4.2Å; I260-V264 HydrophobicContact CG1-CG2 4.27Å; I260-V264 WeakPolarHBondContact O-CG2 3.37Å; I260-V264 PolarHBondContact O-N 3.21Å; Q261-V264 PolarHBondContact O-N 2.96Å
265	T	97.6	Very high	95.4	Very high	55 Å²	55	81 Å²	81	34%	0.337	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	135.8	167.2	-60.7	0	0	0	0	108.2	F247 H248 V249	F247-T265 PolarHBondContact O-N 2.83Å; H248-T265 VanDerWaalsContact CA-O 3.32Å; H248-T265 WeakPolarHBondContact CA-O 3.41Å; V249-T265 PolarHBondContact N-O 3.27Å
266	E	96.5	Very high	95.7	Very high	135 Å²	135	78.6 Å²	78.6	63%	0.631	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.3	136.7	170.9	-66.4	-171.6	-157.1	0	0	110.3	V249	V249-E266 HydrophobicContact CG2-CG 3.99Å; V249-E266 WeakPolarHBondContact O-CA 3.43Å
267	G	96.2	Very high	95.9	Very high	31 Å²	31	79.7 Å²	79.7	32%	0.32	39%	0.391	S	S	.	.	S	Bend	trans	108.1	-174.8	-177.7	0	0	0	0	0	113.7	H248 V249	H248-G267 WeakPolarHBondContact CB-O 3.22Å; V249-G267 PolarHBondContact O-N 3.07Å
268	R	97.1	Very high	96.3	Very high	209 Å²	209	79.2 Å²	79.2	79%	0.789	39%	0.385	S	S	*	.	S	Bend	trans	-81.1	160.4	177.2	-67.2	-173.6	174.3	105.2	-1.2	110.3	H248 T250 S270	H248-R268 PolarHBondContact ND1-O 3.13Å; T250-R268 HydrophobicContact CG2-CG 4.02Å; R268-S270 PolarHBondContact O-N 3.33Å
269	I	98.2	Very high	96.4	Very high	18 Å²	18	73.5 Å²	73.5	9%	0.092	37%	0.367	C	S	.	.			trans	-61.7	128.5	170.8	-60.1	164.6	0	0	0	108	I179 H248 D273 L274 M292 I296	I179-I269 HydrophobicContact CG2-CD1 3.64Å; H248-I269 HydrophobicContact CB-CG1 4.07Å; I269-D273 HydrophobicContact CG2-CB 4.03Å; I269-L274 HydrophobicContact CG2-CD1 4.2Å; I269-L274 HydrophobicContact CG2-CD2 3.74Å; I269-L274 HydrophobicContact CG2-CG 4.01Å; I269-M292 HydrophobicContact CD1-CE 4.45Å; I269-I296 HydrophobicContact CB-CD1 4.2Å; I269-I296 HydrophobicContact CG2-CD1 4.21Å
270	S	97	Very high	96.5	Very high	44 Å²	44	77.8 Å²	77.8	31%	0.308	38%	0.384	S	S	.	.			trans	-100	174.8	-173.2	75.9	0	0	0	0	112.9	R268 E272 D273	R268-S270 PolarHBondContact O-N 3.33Å; S270-E272 PolarHBondContact OG-N 3.02Å; S270-D273 PolarHBondContact N-OD2 3.09Å; S270-D273 WeakPolarHBondContact O-CB 3.31Å; S270-D273 PolarHBondContact O-N 3.29Å; S270-D273 PolarHBondContact OG-N 3.33Å; S270-D273 VanDerWaalsContact OG-N 3.16Å; S270-D273 PolarHBondContact OG-OD2 2.77Å
271	E	96.9	Very high	96.5	Very high	94 Å²	94	80.2 Å²	80.2	44%	0.439	40%	0.397	S	S	.	.	H	α-helix	trans	-65.9	-43	172.4	-169.1	169.1	121.9	0	0	111.9	D273 L274 E275 L299 I303	E271-D273 PolarHBondContact O-N 2.96Å; E271-L274 PolarHBondContact O-N 2.95Å; E271-E275 PolarHBondContact O-N 3.4Å; E271-L299 HydrophobicContact CB-CD1 4.24Å; E271-L299 HydrophobicContact CB-CD2 4.3Å; E271-L299 HydrophobicContact CB-CG 4.19Å; E271-L299 HydrophobicContact CG-CD2 4.03Å; E271-L299 HydrophobicContact CG-CG 4.25Å; E271-I303 HydrophobicContact CG-CG2 3.44Å; E271-I303 VanDerWaalsContact CG-CG2 3.44Å
272	E	96.5	Very high	96.7	Very high	140 Å²	140	75.2 Å²	75.2	65%	0.654	37%	0.373	S	S	*	.	H	α-helix	trans	-58.5	-30.9	175.2	-174.1	-176.5	179.7	0	0	112.7	S270 L274 K276	S270-E272 PolarHBondContact OG-N 3.02Å; E272-L274 VanDerWaalsContact C-N 3.28Å; E272-L274 PolarHBondContact O-N 2.94Å; E272-K276 PolarHBondContact O-NZ 3.19Å
273	D	97.5	Very high	96.8	Very high	22 Å²	22	72.8 Å²	72.8	12%	0.118	36%	0.356	C	S	.	.	H	α-helix	trans	-63.2	-38.1	172.8	-75.5	-47.4	0	0	0	112	Y217 H248 I269 S270 E271 K276 H277	Y217-D273 HydrophobicContact CD1-CB 4.46Å; Y217-D273 HydrophobicContact CE1-CB 3.8Å; Y217-D273 PolarHBondContact OH-O 2.98Å; H248-D273 IonicContact CE1-OD2 3.74Å; H248-D273 PolarHBondContact CE1-OD2 2.75Å; H248-D273 IonicContact NE2-OD2 2.86Å; I269-D273 HydrophobicContact CG2-CB 4.03Å; S270-D273 PolarHBondContact N-OD2 3.09Å; S270-D273 WeakPolarHBondContact O-CB 3.31Å; S270-D273 PolarHBondContact O-N 3.29Å; S270-D273 PolarHBondContact OG-N 3.33Å; S270-D273 VanDerWaalsContact OG-N 3.16Å; S270-D273 PolarHBondContact OG-OD2 2.77Å; E271-D273 PolarHBondContact O-N 2.96Å; D273-K276 WeakPolarHBondContact O-CE 3.46Å; D273-K276 PolarHBondContact O-NZ 2.82Å; D273-K276 IonicContact OD1-NZ 2.84Å; D273-H277 PolarHBondContact O-CD2 3.24Å; D273-H277 VanDerWaalsContact O-CD2 3.29Å; D273-H277 PolarHBondContact O-NE2 2.99Å
274	L	98.2	Very high	96.9	Very high	0 Å²	0	69.8 Å²	69.8	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-99	-36.6	-167.8	-54.5	-171	0	0	0	112.8	I179 Y217 I269 E271 E272 K276 H277 W284 I296 L299 L300 I303	I179-L274 HydrophobicContact CD1-CD1 4.01Å; I179-L274 HydrophobicContact CD1-CD2 4Å; Y217-L274 HydrophobicContact CD2-CD2 3.84Å; Y217-L274 HydrophobicContact CE2-CD2 3.77Å; Y217-L274 HydrophobicContact CG-CD2 4.45Å; I269-L274 HydrophobicContact CG2-CD1 4.2Å; I269-L274 HydrophobicContact CG2-CD2 3.74Å; I269-L274 HydrophobicContact CG2-CG 4.01Å; E271-L274 PolarHBondContact O-N 2.95Å; E272-L274 VanDerWaalsContact C-N 3.28Å; E272-L274 PolarHBondContact O-N 2.94Å; L274-K276 PolarHBondContact O-N 3.22Å; L274-K276 VanDerWaalsContact O-N 3.11Å; L274-H277 PolarHBondContact O-N 3.37Å; L274-W284 HydrophobicContact CB-CH2 4.11Å; L274-W284 HydrophobicContact CB-CZ3 4.08Å; L274-W284 HydrophobicContact CD2-CZ3 4.13Å; L274-W284 HydrophobicContact CG-CZ3 4.45Å; L274-W284 WeakPolarHBondContact O-CH2 3.34Å; L274-I296 HydrophobicContact CD1-CD1 4.18Å; L274-I296 HydrophobicContact CD1-CG2 4.24Å; L274-L299 HydrophobicContact CB-CD2 4.09Å; L274-L299 HydrophobicContact CD1-CD1 4.11Å; L274-L299 HydrophobicContact CD1-CD2 3.78Å; L274-L299 HydrophobicContact CG-CD2 4.36Å; L274-L300 HydrophobicContact CB-CD2 4.48Å; L274-L300 HydrophobicContact CD1-CD2 4.07Å; L274-I303 HydrophobicContact CB-CD1 4.02Å
275	E	97.3	Very high	96.9	Very high	101 Å²	101	69.3 Å²	69.3	47%	0.472	34%	0.34	S	S	.	.	H	α-helix	trans	-54.1	-36.7	-175.4	70.3	-178.8	173.9	0	0	113.5	E271 H277 V278	E271-E275 PolarHBondContact O-N 3.4Å; E275-H277 PolarHBondContact O-N 3.14Å; E275-H277 VanDerWaalsContact O-N 3.11Å; E275-V278 WeakPolarHBondContact O-CB 3.41Å; E275-V278 WeakPolarHBondContact O-CG2 3.38Å; E275-V278 PolarHBondContact O-N 2.86Å; E275-V278 VanDerWaalsContact O-N 3.13Å
276	K	96.8	Very high	97	Very high	126 Å²	126	66.7 Å²	66.7	55%	0.548	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-12.4	179.6	67.1	-174.3	170.5	-119.4	0	114.9	Y217 E272 D273 L274	Y217-K276 WeakPolarHBondContact OH-CE 3.32Å; Y217-K276 PolarHBondContact OH-NZ 2.88Å; E272-K276 PolarHBondContact O-NZ 3.19Å; D273-K276 WeakPolarHBondContact O-CE 3.46Å; D273-K276 PolarHBondContact O-NZ 2.82Å; D273-K276 IonicContact OD1-NZ 2.84Å; L274-K276 PolarHBondContact O-N 3.22Å; L274-K276 VanDerWaalsContact O-N 3.11Å
277	H	97.6	Very high	97.1	Very high	46 Å²	46	60.3 Å²	60.3	21%	0.213	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	-1.7	178.3	-57.4	-70.6	0	0	0	113.1	V177 Y217 D273 L274 E275 S279 T282 W284	V177-H277 HydrophobicContact CG2-CB 3.62Å; Y217-H277 AromaticContact CE2-CD2 3.88Å; Y217-H277 AromaticContact CE2-NE2 3.65Å; Y217-H277 AromaticContact CZ-NE2 3.71Å; Y217-H277 PolarHBondContact OH-NE2 3.11Å; D273-H277 PolarHBondContact O-CD2 3.24Å; D273-H277 VanDerWaalsContact O-CD2 3.29Å; D273-H277 PolarHBondContact O-NE2 2.99Å; L274-H277 PolarHBondContact O-N 3.37Å; E275-H277 PolarHBondContact O-N 3.14Å; E275-H277 VanDerWaalsContact O-N 3.11Å; H277-S279 PolarHBondContact O-N 2.76Å; H277-S279 VanDerWaalsContact O-N 3.11Å; H277-T282 WeakPolarHBondContact O-CB 3.34Å; H277-T282 PolarHBondContact O-OG1 2.99Å; H277-W284 HydrophobicContact CB-CH2 3.78Å; H277-W284 HydrophobicContact CB-CZ2 4.08Å
278	V	97	Very high	97.1	Very high	62 Å²	62	58.8 Å²	58.8	38%	0.376	28%	0.279	S	S	.	.			trans	-67	113	-179.3	179.4	0	0	0	0	109.6	E275 W284 I303 V305	E275-V278 WeakPolarHBondContact O-CB 3.41Å; E275-V278 WeakPolarHBondContact O-CG2 3.38Å; E275-V278 PolarHBondContact O-N 2.86Å; E275-V278 VanDerWaalsContact O-N 3.13Å; V278-W284 HydrophobicContact CG2-CZ2 4.32Å; V278-I303 HydrophobicContact CG2-CB 4.44Å; V278-I303 HydrophobicContact CG2-CD1 3.62Å; V278-I303 HydrophobicContact CG2-CG1 3.96Å; V278-V305 HydrophobicContact CG1-CG2 4.27Å; V278-V305 HydrophobicContact CG2-CG2 3.8Å
279	S	95.4	Very high	97	Very high	54 Å²	54	50.9 Å²	50.9	38%	0.378	25%	0.254	S	S	.	.			trans	-157.5	159.6	177.5	-177.1	0	0	0	0	109.6	H277 D281 T282	H277-S279 PolarHBondContact O-N 2.76Å; H277-S279 VanDerWaalsContact O-N 3.11Å; S279-D281 WeakPolarHBondContact CB-OD1 3.29Å; S279-D281 PolarHBondContact O-N 3.42Å; S279-D281 PolarHBondContact OG-OD1 3.47Å; S279-T282 PolarHBondContact O-N 2.87Å
280	K	91.6	Very high	96.9	Very high	211 Å²	211	51.6 Å²	51.6	92%	0.917	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-23.8	-179.8	-66.6	-175.6	178.6	-179.4	0	113.3
281	D	94.4	Very high	96.8	Very high	61 Å²	61	54 Å²	54	33%	0.326	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	7.8	-179.9	64.9	-29	0	0	0	113.3	V174 K175 S279	V174-D281 WeakPolarHBondContact CB-O 3.3Å; K175-D281 VanDerWaalsContact CE-OD2 3.31Å; K175-D281 WeakPolarHBondContact CE-OD2 3.37Å; K175-D281 PolarHBondContact N-O 3.21Å; K175-D281 VanDerWaalsContact NZ-CG 3.3Å; K175-D281 IonicContact NZ-OD1 3.12Å; K175-D281 PolarHBondContact NZ-OD1 3.09Å; K175-D281 IonicContact NZ-OD2 2.82Å; K175-D281 PolarHBondContact NZ-OD2 3.47Å; S279-D281 WeakPolarHBondContact CB-OD1 3.29Å; S279-D281 PolarHBondContact O-N 3.42Å; S279-D281 PolarHBondContact OG-OD1 3.47Å
282	T	98.3	Very high	96.7	Very high	1 Å²	1	51 Å²	51	1%	0.006	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	123.4	-179.8	-55.4	0	0	0	0	111.4	K175 V177 H277 S279 W284 C309	K175-T282 HydrophobicContact CB-CG2 4.39Å; K175-T282 CarbonylContact O-C 3.55Å; K175-T282 VanDerWaalsContact O-CA 3.29Å; K175-T282 WeakPolarHBondContact O-CA 3.49Å; V177-T282 HydrophobicContact CB-CG2 4.49Å; V177-T282 HydrophobicContact CG2-CG2 3.68Å; H277-T282 WeakPolarHBondContact O-CB 3.34Å; H277-T282 PolarHBondContact O-OG1 2.99Å; S279-T282 PolarHBondContact O-N 2.87Å; T282-W284 HydrophobicContact CG2-CD2 4.28Å; T282-W284 HydrophobicContact CG2-CZ2 3.94Å; T282-C309 WeakPolarHBondContact O-CB 3.48Å
283	L	98.5	Very high	96.7	Very high	32 Å²	32	44.5 Å²	44.5	17%	0.168	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	140.7	166.9	-47.8	179.4	0	0	0	110.3	F165 V174 K175 L176 V177 Y285 C309 F311	F165-L283 HydrophobicContact CE2-CD1 4.48Å; V174-L283 HydrophobicContact CB-CD1 4.38Å; V174-L283 HydrophobicContact CB-CG 4.33Å; V174-L283 HydrophobicContact CG1-CD1 4.34Å; V174-L283 HydrophobicContact CG1-CG 4.45Å; V174-L283 HydrophobicContact CG2-CD1 3.98Å; V174-L283 HydrophobicContact CG2-CG 4.34Å; K175-L283 PolarHBondContact O-N 3.27Å; L176-L283 WeakPolarHBondContact CA-O 3.41Å; L176-L283 HydrophobicContact CD2-CB 3.78Å; L176-L283 HydrophobicContact CD2-CD1 4.18Å; L176-L283 HydrophobicContact CD2-CG 4.32Å; V177-L283 PolarHBondContact N-O 3.43Å; L283-Y285 HydrophobicContact CB-CD2 4.42Å; L283-Y285 HydrophobicContact CB-CE2 4.01Å; L283-Y285 HydrophobicContact CD1-CE2 4.44Å; L283-C309 HydrophobicContact CD2-CB 4.17Å; L283-F311 HydrophobicContact CB-CE2 4.31Å; L283-F311 HydrophobicContact CD2-CE2 4.3Å
284	W	98.7	Very high	96.7	Very high	2 Å²	2	48.9 Å²	48.9	1%	0.008	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	119.7	-174.4	-58.2	80.1	0	0	0	109.3	V177 I179 L274 H277 V278 T282 L300 V305 C309 V310 F311	V177-W284 HydrophobicContact CB-CD2 4.04Å; V177-W284 HydrophobicContact CB-CE3 3.51Å; V177-W284 HydrophobicContact CB-CH2 4.4Å; V177-W284 HydrophobicContact CB-CZ3 3.73Å; V177-W284 HydrophobicContact CG1-CE3 3.58Å; V177-W284 HydrophobicContact CG1-CH2 4.38Å; V177-W284 HydrophobicContact CG1-CZ3 3.48Å; V177-W284 VanDerWaalsContact CG1-CZ3 3.48Å; V177-W284 HydrophobicContact CG2-CD2 4.41Å; V177-W284 HydrophobicContact CG2-CE3 4.08Å; V177-W284 HydrophobicContact CG2-CH2 4.1Å; V177-W284 HydrophobicContact CG2-CZ2 4.4Å; V177-W284 HydrophobicContact CG2-CZ3 3.93Å; V177-W284 WeakPolarHBondContact O-CA 3.21Å; I179-W284 HydrophobicContact CD1-CE3 4.01Å; I179-W284 HydrophobicContact CD1-CZ3 4.27Å; L274-W284 HydrophobicContact CB-CH2 4.11Å; L274-W284 HydrophobicContact CB-CZ3 4.08Å; L274-W284 HydrophobicContact CD2-CZ3 4.13Å; L274-W284 HydrophobicContact CG-CZ3 4.45Å; L274-W284 WeakPolarHBondContact O-CH2 3.34Å; H277-W284 HydrophobicContact CB-CH2 3.78Å; H277-W284 HydrophobicContact CB-CZ2 4.08Å; V278-W284 HydrophobicContact CG2-CZ2 4.32Å; T282-W284 HydrophobicContact CG2-CD2 4.28Å; T282-W284 HydrophobicContact CG2-CZ2 3.94Å; W284-L300 HydrophobicContact CB-CD1 4.25Å; W284-L300 HydrophobicContact CD2-CD1 4.22Å; W284-L300 HydrophobicContact CD2-CD2 3.78Å; W284-L300 HydrophobicContact CE3-CD1 4.11Å; W284-L300 HydrophobicContact CE3-CD2 3.45Å; W284-L300 VanDerWaalsContact CE3-CD2 3.45Å; W284-L300 HydrophobicContact CE3-CG 4.45Å; W284-L300 HydrophobicContact CG-CD1 4.29Å; W284-L300 HydrophobicContact CH2-CD2 3.74Å; W284-L300 HydrophobicContact CZ2-CD2 4.08Å; W284-L300 HydrophobicContact CZ3-CD2 3.42Å; W284-L300 VanDerWaalsContact CZ3-CD2 3.42Å; W284-V305 HydrophobicContact CG-CG1 4.34Å; W284-V305 HydrophobicContact CZ2-CG2 3.94Å; W284-C309 PolarHBondContact N-O 2.7Å; W284-V310 HydrophobicContact CB-CG1 4.44Å; W284-V310 HydrophobicContact CB-CG2 4.17Å; W284-V310 HydrophobicContact CG-CG2 4.37Å; W284-F311 PolarHBondContact O-N 3.32Å
285	Y	98.8	Very high	96.6	Very high	12 Å²	12	52.3 Å²	52.3	5%	0.047	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	116.3	178	-77.6	-100.1	0	0	0	109.3	F163 F164 F165 L176 V177 L178 I179 I191 L283 F311	F163-Y285 HydrophobicContact CD2-CD1 4.18Å; F163-Y285 HydrophobicContact CE1-CD1 4.3Å; F163-Y285 AromaticContact CE2-CD1 3.55Å; F163-Y285 HydrophobicContact CE2-CD1 3.55Å; F163-Y285 HydrophobicContact CE2-CE1 4.4Å; F163-Y285 HydrophobicContact CE2-CG 4.32Å; F163-Y285 AromaticContact CZ-CD1 3.64Å; F163-Y285 HydrophobicContact CZ-CD1 3.64Å; F163-Y285 HydrophobicContact CZ-CG 4.27Å; F164-Y285 VanDerWaalsContact O-CE1 3.31Å; F164-Y285 WeakPolarHBondContact O-CE1 3.18Å; F164-Y285 PolarHBondContact O-OH 3.07Å; F165-Y285 HydrophobicContact CB-CE1 4.45Å; F165-Y285 HydrophobicContact CD2-CE2 4.23Å; L176-Y285 HydrophobicContact CD2-CD2 4.29Å; L176-Y285 HydrophobicContact CD2-CE2 4.06Å; V177-Y285 PolarHBondContact O-N 3.45Å; L178-Y285 CarbonylContact C-O 3.49Å; L178-Y285 WeakPolarHBondContact CA-O 3.4Å; L178-Y285 HydrophobicContact CD2-CD2 4.34Å; L178-Y285 HydrophobicContact CD2-CG 4.32Å; I179-Y285 PolarHBondContact N-O 3.08Å; I191-Y285 HydrophobicContact CD1-CD1 3.86Å; I191-Y285 HydrophobicContact CD1-CE1 4.19Å; I191-Y285 HydrophobicContact CD1-CG 4.39Å; L283-Y285 HydrophobicContact CB-CD2 4.42Å; L283-Y285 HydrophobicContact CB-CE2 4.01Å; L283-Y285 HydrophobicContact CD1-CE2 4.44Å; Y285-F311 WeakPolarHBondContact CA-O 3.4Å; Y285-F311 HydrophobicContact CD1-CB 3.93Å; Y285-F311 HydrophobicContact CD1-CG 4.5Å; Y285-F311 HydrophobicContact CD2-CD2 4.27Å; Y285-F311 HydrophobicContact CE1-CB 3.95Å; Y285-F311 HydrophobicContact CE1-CD2 4.19Å; Y285-F311 HydrophobicContact CE1-CG 4.1Å; Y285-F311 AromaticContact CE2-CD2 3.85Å; Y285-F311 HydrophobicContact CE2-CD2 3.85Å; Y285-F311 HydrophobicContact CE2-CE2 4.37Å; Y285-F311 HydrophobicContact CG-CB 4.38Å; Y285-F311 AromaticContact CZ-CD2 3.81Å
286	I	98.7	Very high	96.6	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	122.8	-173.2	-46.6	165	0	0	0	109	I179 M292 I293 I296 L300 V310 F311 F312 E313	I179-I286 HydrophobicContact CB-CG1 4.31Å; I179-I286 HydrophobicContact CB-CG2 4.21Å; I179-I286 HydrophobicContact CD1-CG1 4.36Å; I179-I286 HydrophobicContact CG2-CG2 4.43Å; I179-I286 WeakPolarHBondContact O-CA 3.41Å; I286-M292 HydrophobicContact CG2-CE 4.5Å; I286-I293 HydrophobicContact CG2-CG1 3.89Å; I286-I296 HydrophobicContact CD1-CB 4.48Å; I286-I296 HydrophobicContact CD1-CG2 3.71Å; I286-I296 HydrophobicContact CG1-CG2 4.27Å; I286-I296 HydrophobicContact CG2-CG2 4.42Å; I286-L300 HydrophobicContact CD1-CD1 3.71Å; I286-V310 HydrophobicContact CD1-CG1 3.71Å; I286-F311 PolarHBondContact N-O 3.19Å; I286-F312 HydrophobicContact CB-CB 4.02Å; I286-F312 CarbonylContact O-C 3.5Å; I286-F312 WeakPolarHBondContact O-CA 3.39Å; I286-F312 WeakPolarHBondContact O-CB 3.34Å; I286-E313 PolarHBondContact O-N 2.83Å
287	C	98.4	Very high	96.6	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	127.3	172.6	-174.8	0	0	0	0	110.8	F163 I179 A180 G181 G184 P187 L188 E313	F163-C287 HydrophobicContact CE1-CB 4.22Å; F163-C287 HydrophobicContact CZ-CB 4.24Å; I179-C287 PolarHBondContact O-N 2.86Å; A180-C287 CarbonylContact C-O 3.48Å; A180-C287 WeakPolarHBondContact CA-O 3.41Å; G181-C287 PolarHBondContact N-O 3.26Å; G184-C287 WeakPolarHBondContact CA-O 3.41Å; G184-C287 WeakPolarHBondContact CA-SG 3.39Å; G184-C287 VanDerWaalsContact O-CB 3.28Å; G184-C287 WeakPolarHBondContact O-CB 3.38Å; P187-C287 HydrophobicContact CG-CB 3.88Å; P187-C287 VanDerWaalsContact CG-SG 3.6Å; L188-C287 HydrophobicContact CD1-CB 4.31Å; L188-C287 HydrophobicContact CG-CB 4.25Å; C287-E313 WeakPolarHBondContact CA-O 3.36Å; C287-E313 PolarHBondContact SG-O 3.42Å
288	G	97.1	Very high	96.6	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	177.5	-179	-167.2	0	0	0	0	0	113.3	I293 W315	G288-I293 WeakPolarHBondContact O-CD1 3.45Å; G288-W315 PolarHBondContact O-N 2.9Å
289	P	95	Very high	96.6	Very high	42 Å²	42	46.3 Å²	46.3	27%	0.273	25%	0.247	S	C	.	.			trans	-67.2	150.7	175.2	29.6	-34.4	0	0	0	109.9	P291 M292 I293 W315	P289-P291 VanDerWaalsContact C-CD 3.46Å; P289-M292 HydrophobicContact CG-CB 3.91Å; P289-M292 WeakPolarHBondContact O-CB 3.27Å; P289-M292 PolarHBondContact O-N 2.97Å; P289-I293 PolarHBondContact O-N 3.32Å; P289-W315 HydrophobicContact CB-CZ2 4.25Å; P289-W315 VanDerWaalsContact N-NE1 3.15Å
290	P	94.6	Very high	96.8	Very high	34 Å²	34	43.9 Å²	43.9	22%	0.221	23%	0.23	C	C	.	.	H	α-helix	trans	-51.2	-42.9	-174.6	-26.2	32.6	0	0	0	115.2	M292 I293 E294 K314 W316	P290-M292 VanDerWaalsContact C-N 3.28Å; P290-M292 PolarHBondContact O-N 2.93Å; P290-I293 PolarHBondContact O-N 3.21Å; P290-E294 WeakPolarHBondContact O-CG 3.46Å; P290-E294 PolarHBondContact O-N 3.29Å; P290-K314 HydrophobicContact CB-CD 4.34Å; P290-K314 HydrophobicContact CG-CD 4.41Å; P290-W316 HydrophobicContact CG-CE3 3.98Å; P290-W316 HydrophobicContact CG-CZ3 3.95Å
291	P	95.2	Very high	97	Very high	94 Å²	94	37 Å²	37	61%	0.61	21%	0.212	S	C	*	.	H	α-helix	trans	-61.9	-32.9	178.2	-24.6	35.5	0	0	0	113.9	P289 S295	P289-P291 VanDerWaalsContact C-CD 3.46Å; P291-S295 WeakPolarHBondContact O-CB 3.44Å; P291-S295 PolarHBondContact O-N 3.28Å; P291-S295 VanDerWaalsContact O-N 3.13Å
292	M	96	Very high	97.2	Very high	32 Å²	32	39.3 Å²	39.3	16%	0.158	22%	0.224	C	C	.	.	H	α-helix	trans	-70.2	-46.6	176.3	176.2	-174.2	153.8	0	0	110.5	I179 G181 I269 I286 P289 P290 E294 S295 I296	I179-M292 HydrophobicContact CB-CE 4.48Å; I179-M292 HydrophobicContact CG2-CE 3.43Å; I179-M292 VanDerWaalsContact CG2-CE 3.43Å; G181-M292 WeakPolarHBondContact CA-SD 3.48Å; I269-M292 HydrophobicContact CD1-CE 4.45Å; I286-M292 HydrophobicContact CG2-CE 4.5Å; P289-M292 HydrophobicContact CG-CB 3.91Å; P289-M292 WeakPolarHBondContact O-CB 3.27Å; P289-M292 PolarHBondContact O-N 2.97Å; P290-M292 VanDerWaalsContact C-N 3.28Å; P290-M292 PolarHBondContact O-N 2.93Å; M292-E294 VanDerWaalsContact C-N 3.31Å; M292-E294 PolarHBondContact O-N 3.29Å; M292-S295 PolarHBondContact O-N 3.08Å; M292-I296 HydrophobicContact CE-CG1 4.47Å; M292-I296 HydrophobicContact CG-CG1 4.19Å; M292-I296 WeakPolarHBondContact O-CB 3.4Å; M292-I296 VanDerWaalsContact O-CG1 3.31Å; M292-I296 WeakPolarHBondContact O-CG1 3.43Å; M292-I296 PolarHBondContact O-N 2.9Å
293	I	96.3	Very high	97.1	Very high	2 Å²	2	40.6 Å²	40.6	1%	0.01	23%	0.231	C	C	.	.	H	α-helix	trans	-61	-43.4	-179.7	-72.3	165.1	0	0	0	110.5	I286 G288 P289 P290 I296 S297 F312 E313 K314	I286-I293 HydrophobicContact CG2-CG1 3.89Å; G288-I293 WeakPolarHBondContact O-CD1 3.45Å; P289-I293 PolarHBondContact O-N 3.32Å; P290-I293 PolarHBondContact O-N 3.21Å; I293-I296 PolarHBondContact O-N 2.83Å; I293-S297 WeakPolarHBondContact O-CB 3.22Å; I293-S297 PolarHBondContact O-N 3.28Å; I293-S297 PolarHBondContact O-OG 2.77Å; I293-F312 HydrophobicContact CG2-CB 4.06Å; I293-F312 HydrophobicContact CG2-CD2 3.82Å; I293-F312 HydrophobicContact CG2-CE2 4.45Å; I293-F312 HydrophobicContact CG2-CG 3.9Å; I293-E313 WeakPolarHBondContact CD1-O 3.44Å; I293-K314 HydrophobicContact CD1-CB 4.07Å; I293-K314 HydrophobicContact CD1-CG 3.51Å
294	E	96.3	Very high	97	Very high	114 Å²	114	42 Å²	42	53%	0.533	25%	0.253	S	S	.	.	H	α-helix	trans	-61.9	-45.9	177.1	-72.5	165.3	-161.7	0	0	111.8	P290 M292 K298 K314	P290-E294 WeakPolarHBondContact O-CG 3.46Å; P290-E294 PolarHBondContact O-N 3.29Å; M292-E294 VanDerWaalsContact C-N 3.31Å; M292-E294 PolarHBondContact O-N 3.29Å; E294-K298 WeakPolarHBondContact O-CB 3.32Å; E294-K298 PolarHBondContact O-N 3.3Å; E294-K314 IonicContact OE1-NZ 3.06Å
295	S	96.9	Very high	97	Very high	73 Å²	73	42.8 Å²	42.8	51%	0.51	26%	0.258	S	S	.	.	H	α-helix	trans	-61.7	-47.5	177.2	-173.9	0	0	0	0	112.4	P291 M292 K298 L299	P291-S295 WeakPolarHBondContact O-CB 3.44Å; P291-S295 PolarHBondContact O-N 3.28Å; P291-S295 VanDerWaalsContact O-N 3.13Å; M292-S295 PolarHBondContact O-N 3.08Å; S295-K298 PolarHBondContact O-N 3.35Å; S295-L299 WeakPolarHBondContact O-CB 3.49Å; S295-L299 PolarHBondContact O-N 3.17Å
296	I	98	Very high	96.8	Very high	7 Å²	7	45.2 Å²	45.2	4%	0.036	28%	0.277	C	S	.	.	H	α-helix	trans	-69.5	-41.7	-178.1	-64.5	-67.4	0	0	0	110.5	I179 I269 L274 I286 M292 I293 K298 L299 L300	I179-I296 HydrophobicContact CD1-CG2 3.65Å; I179-I296 HydrophobicContact CG2-CD1 4.43Å; I179-I296 HydrophobicContact CG2-CG1 4.33Å; I179-I296 HydrophobicContact CG2-CG2 4.44Å; I269-I296 HydrophobicContact CB-CD1 4.2Å; I269-I296 HydrophobicContact CG2-CD1 4.21Å; L274-I296 HydrophobicContact CD1-CD1 4.18Å; L274-I296 HydrophobicContact CD1-CG2 4.24Å; I286-I296 HydrophobicContact CD1-CB 4.48Å; I286-I296 HydrophobicContact CD1-CG2 3.71Å; I286-I296 HydrophobicContact CG1-CG2 4.27Å; I286-I296 HydrophobicContact CG2-CG2 4.42Å; M292-I296 HydrophobicContact CE-CG1 4.47Å; M292-I296 HydrophobicContact CG-CG1 4.19Å; M292-I296 WeakPolarHBondContact O-CB 3.4Å; M292-I296 VanDerWaalsContact O-CG1 3.31Å; M292-I296 WeakPolarHBondContact O-CG1 3.43Å; M292-I296 PolarHBondContact O-N 2.9Å; I293-I296 PolarHBondContact O-N 2.83Å; I296-K298 VanDerWaalsContact C-N 3.29Å; I296-K298 PolarHBondContact O-N 2.86Å; I296-L299 WeakPolarHBondContact O-CB 3.45Å; I296-L299 PolarHBondContact O-N 3.16Å; I296-L300 HydrophobicContact CG2-CD1 4.03Å; I296-L300 HydrophobicContact CG2-CG 4.18Å; I296-L300 VanDerWaalsContact O-CG 3.32Å; I296-L300 WeakPolarHBondContact O-CG 3.26Å; I296-L300 PolarHBondContact O-N 2.78Å
297	S	96.9	Very high	96.7	Very high	35 Å²	35	53.2 Å²	53.2	25%	0.245	31%	0.307	C	S	.	.	H	α-helix	trans	-61.2	-40.3	177.8	-57.9	0	0	0	0	111.6	I293 A301	I293-S297 WeakPolarHBondContact O-CB 3.22Å; I293-S297 PolarHBondContact O-N 3.28Å; I293-S297 PolarHBondContact O-OG 2.77Å; S297-A301 WeakPolarHBondContact O-CB 3.34Å; S297-A301 PolarHBondContact O-N 3.49Å
298	K	97.1	Very high	96.5	Very high	148 Å²	148	58.4 Å²	58.4	64%	0.643	34%	0.335	S	S	*	.	H	α-helix	trans	-64.1	-44.3	174.8	-175.5	178.1	-179.9	-179.1	0	111.7	E294 S295 I296 A301 N302	E294-K298 WeakPolarHBondContact O-CB 3.32Å; E294-K298 PolarHBondContact O-N 3.3Å; S295-K298 PolarHBondContact O-N 3.35Å; I296-K298 VanDerWaalsContact C-N 3.29Å; I296-K298 PolarHBondContact O-N 2.86Å; K298-A301 PolarHBondContact O-N 3.3Å; K298-N302 PolarHBondContact O-N 3.44Å; K298-N302 PolarHBondContact O-OD1 2.72Å
299	L	97.5	Very high	96.5	Very high	19 Å²	19	59.8 Å²	59.8	10%	0.099	34%	0.344	C	S	.	.	H	α-helix	trans	-59.9	-49.7	176.8	-174.3	172.2	0	0	0	110.8	E271 L274 S295 I296 A301 N302 I303	E271-L299 HydrophobicContact CB-CD1 4.24Å; E271-L299 HydrophobicContact CB-CD2 4.3Å; E271-L299 HydrophobicContact CB-CG 4.19Å; E271-L299 HydrophobicContact CG-CD2 4.03Å; E271-L299 HydrophobicContact CG-CG 4.25Å; L274-L299 HydrophobicContact CB-CD2 4.09Å; L274-L299 HydrophobicContact CD1-CD1 4.11Å; L274-L299 HydrophobicContact CD1-CD2 3.78Å; L274-L299 HydrophobicContact CG-CD2 4.36Å; S295-L299 WeakPolarHBondContact O-CB 3.49Å; S295-L299 PolarHBondContact O-N 3.17Å; I296-L299 WeakPolarHBondContact O-CB 3.45Å; I296-L299 PolarHBondContact O-N 3.16Å; L299-A301 VanDerWaalsContact C-N 3.29Å; L299-A301 PolarHBondContact O-N 3.11Å; L299-N302 WeakPolarHBondContact O-CB 3.42Å; L299-N302 PolarHBondContact O-N 3.41Å; L299-I303 HydrophobicContact CD2-CD1 3.76Å; L299-I303 HydrophobicContact CD2-CG1 4.26Å; L299-I303 HydrophobicContact CD2-CG2 4.31Å; L299-I303 WeakPolarHBondContact O-CG1 3.39Å; L299-I303 PolarHBondContact O-N 3.13Å
300	L	98.1	Very high	96.6	Very high	2 Å²	2	59 Å²	59	1%	0.01	34%	0.338	C	S	.	.	H	α-helix	trans	-57.8	-41.6	178.3	-69.2	177.9	0	0	0	112.1	L274 W284 I286 I296 I303 G304 V305 V310	L274-L300 HydrophobicContact CB-CD2 4.48Å; L274-L300 HydrophobicContact CD1-CD2 4.07Å; W284-L300 HydrophobicContact CB-CD1 4.25Å; W284-L300 HydrophobicContact CD2-CD1 4.22Å; W284-L300 HydrophobicContact CD2-CD2 3.78Å; W284-L300 HydrophobicContact CE3-CD1 4.11Å; W284-L300 HydrophobicContact CE3-CD2 3.45Å; W284-L300 VanDerWaalsContact CE3-CD2 3.45Å; W284-L300 HydrophobicContact CE3-CG 4.45Å; W284-L300 HydrophobicContact CG-CD1 4.29Å; W284-L300 HydrophobicContact CH2-CD2 3.74Å; W284-L300 HydrophobicContact CZ2-CD2 4.08Å; W284-L300 HydrophobicContact CZ3-CD2 3.42Å; W284-L300 VanDerWaalsContact CZ3-CD2 3.42Å; I286-L300 HydrophobicContact CD1-CD1 3.71Å; I296-L300 HydrophobicContact CG2-CD1 4.03Å; I296-L300 HydrophobicContact CG2-CG 4.18Å; I296-L300 VanDerWaalsContact O-CG 3.32Å; I296-L300 WeakPolarHBondContact O-CG 3.26Å; I296-L300 PolarHBondContact O-N 2.78Å; L300-I303 HydrophobicContact CD2-CD1 4.18Å; L300-I303 WeakPolarHBondContact O-CG1 3.35Å; L300-I303 PolarHBondContact O-N 3.49Å; L300-G304 PolarHBondContact O-N 3.23Å; L300-V305 HydrophobicContact CB-CB 4.1Å; L300-V305 HydrophobicContact CB-CG2 4.39Å; L300-V305 HydrophobicContact CD2-CG2 4.11Å; L300-V305 WeakPolarHBondContact O-CB 3.42Å; L300-V305 PolarHBondContact O-N 3.06Å; L300-V310 HydrophobicContact CD1-CG1 4.02Å; L300-V310 HydrophobicContact CD1-CG2 4.05Å
301	A	97.2	Very high	96.7	Very high	66 Å²	66	61 Å²	61	55%	0.545	34%	0.344	S	S	.	.	H	α-helix	trans	-63.3	-41.1	175.1	0	0	0	0	0	112.2	S297 K298 L299 I303 G304	S297-A301 WeakPolarHBondContact O-CB 3.34Å; S297-A301 PolarHBondContact O-N 3.49Å; K298-A301 PolarHBondContact O-N 3.3Å; L299-A301 VanDerWaalsContact C-N 3.29Å; L299-A301 PolarHBondContact O-N 3.11Å; A301-I303 VanDerWaalsContact C-N 3.34Å; A301-I303 PolarHBondContact O-N 2.76Å; A301-G304 PolarHBondContact O-N 3.2Å
302	N	97.1	Very high	96.8	Very high	110 Å²	110	61.1 Å²	61.1	59%	0.588	34%	0.335	S	S	*	.	H	α-helix	trans	-64	-37.6	178.6	-69.1	-11.4	0	0	0	112.6	K298 L299 G304	K298-N302 PolarHBondContact O-N 3.44Å; K298-N302 PolarHBondContact O-OD1 2.72Å; L299-N302 WeakPolarHBondContact O-CB 3.42Å; L299-N302 PolarHBondContact O-N 3.41Å; N302-G304 PolarHBondContact O-N 3.12Å
303	I	97.3	Very high	96.6	Very high	29 Å²	29	60.9 Å²	60.9	15%	0.149	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	13.4	177.3	65.4	176.3	0	0	0	113.3	E271 L274 V278 L299 L300 A301 V305	E271-I303 HydrophobicContact CG-CG2 3.44Å; E271-I303 VanDerWaalsContact CG-CG2 3.44Å; L274-I303 HydrophobicContact CB-CD1 4.02Å; V278-I303 HydrophobicContact CG2-CB 4.44Å; V278-I303 HydrophobicContact CG2-CD1 3.62Å; V278-I303 HydrophobicContact CG2-CG1 3.96Å; L299-I303 HydrophobicContact CD2-CD1 3.76Å; L299-I303 HydrophobicContact CD2-CG1 4.26Å; L299-I303 HydrophobicContact CD2-CG2 4.31Å; L299-I303 WeakPolarHBondContact O-CG1 3.39Å; L299-I303 PolarHBondContact O-N 3.13Å; L300-I303 HydrophobicContact CD2-CD1 4.18Å; L300-I303 WeakPolarHBondContact O-CG1 3.35Å; L300-I303 PolarHBondContact O-N 3.49Å; A301-I303 VanDerWaalsContact C-N 3.34Å; A301-I303 PolarHBondContact O-N 2.76Å; I303-V305 HydrophobicContact CD1-CG2 4.4Å; I303-V305 HydrophobicContact CG1-CG2 4.14Å
304	G	96.4	Very high	96.3	Very high	61 Å²	61	63.6 Å²	63.6	63%	0.629	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.8	18.3	169.9	0	0	0	0	0	115.9	L300 A301 N302 S306	L300-G304 PolarHBondContact O-N 3.23Å; A301-G304 PolarHBondContact O-N 3.2Å; N302-G304 PolarHBondContact O-N 3.12Å; G304-S306 PolarHBondContact O-N 3.13Å
305	V	97.6	Very high	95.4	Very high	18 Å²	18	61.9 Å²	61.9	11%	0.109	33%	0.334	C	S	.	.			trans	-73	126.2	174.3	176.4	0	0	0	0	109.9	V278 W284 L300 I303 V310	V278-V305 HydrophobicContact CG1-CG2 4.27Å; V278-V305 HydrophobicContact CG2-CG2 3.8Å; W284-V305 HydrophobicContact CG-CG1 4.34Å; W284-V305 HydrophobicContact CZ2-CG2 3.94Å; L300-V305 HydrophobicContact CB-CB 4.1Å; L300-V305 HydrophobicContact CB-CG2 4.39Å; L300-V305 HydrophobicContact CD2-CG2 4.11Å; L300-V305 WeakPolarHBondContact O-CB 3.42Å; L300-V305 PolarHBondContact O-N 3.06Å; I303-V305 HydrophobicContact CD1-CG2 4.4Å; I303-V305 HydrophobicContact CG1-CG2 4.14Å; V305-V310 HydrophobicContact CG1-CG2 3.55Å
306	S	96	Very high	93.9	Very high	63 Å²	63	66.5 Å²	66.5	44%	0.441	34%	0.34	S	S	.	.			trans	-64	136.9	174.3	-177	0	0	0	0	111	G304 D308 C309	G304-S306 PolarHBondContact O-N 3.13Å; S306-D308 PolarHBondContact O-N 3.14Å; S306-D308 PolarHBondContact OG-N 2.78Å; S306-C309 PolarHBondContact O-N 2.76Å; S306-C309 VanDerWaalsContact O-N 3.13Å
307	R	94.9	Very high	93.7	Very high	168 Å²	168	69.5 Å²	69.5	63%	0.634	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-57.9	-31	177.5	-173.4	179	178.1	-169.3	-2.4	112.6	C309 V310	R307-C309 PolarHBondContact O-N 3.38Å; R307-V310 PolarHBondContact O-N 3.31Å
308	D	95.3	Very high	93.5	Very high	110 Å²	110	71.3 Å²	71.3	59%	0.588	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-66.9	-17.2	-178	-59.2	-31	0	0	0	113.2	S306	S306-D308 PolarHBondContact O-N 3.14Å; S306-D308 PolarHBondContact OG-N 2.78Å
309	C	96.1	Very high	93.3	Very high	29 Å²	29	67.1 Å²	67.1	20%	0.196	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-99.8	3.7	176.1	-58.8	0	0	0	0	112.8	T282 L283 W284 S306 R307	T282-C309 WeakPolarHBondContact O-CB 3.48Å; L283-C309 HydrophobicContact CD2-CB 4.17Å; W284-C309 PolarHBondContact N-O 2.7Å; S306-C309 PolarHBondContact O-N 2.76Å; S306-C309 VanDerWaalsContact O-N 3.13Å; R307-C309 PolarHBondContact O-N 3.38Å
310	V	97.6	Very high	93.1	Very high	24 Å²	24	69.9 Å²	69.9	15%	0.145	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	112.7	-176.6	-174.9	0	0	0	0	110.5	W284 I286 L300 V305 R307	W284-V310 HydrophobicContact CB-CG1 4.44Å; W284-V310 HydrophobicContact CB-CG2 4.17Å; W284-V310 HydrophobicContact CG-CG2 4.37Å; I286-V310 HydrophobicContact CD1-CG1 3.71Å; L300-V310 HydrophobicContact CD1-CG1 4.02Å; L300-V310 HydrophobicContact CD1-CG2 4.05Å; V305-V310 HydrophobicContact CG1-CG2 3.55Å; R307-V310 PolarHBondContact O-N 3.31Å
311	F	98	Very high	92.8	Very high	78 Å²	78	74.1 Å²	74.1	34%	0.342	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	136.3	176.7	-52.4	-86	0	0	0	108.6	F163 L283 W284 Y285 I286	F163-F311 HydrophobicContact CD2-CB 4.18Å; F163-F311 HydrophobicContact CE2-CB 4.02Å; L283-F311 HydrophobicContact CB-CE2 4.31Å; L283-F311 HydrophobicContact CD2-CE2 4.3Å; W284-F311 PolarHBondContact O-N 3.32Å; Y285-F311 WeakPolarHBondContact CA-O 3.4Å; Y285-F311 HydrophobicContact CD1-CB 3.93Å; Y285-F311 HydrophobicContact CD1-CG 4.5Å; Y285-F311 HydrophobicContact CD2-CD2 4.27Å; Y285-F311 HydrophobicContact CE1-CB 3.95Å; Y285-F311 HydrophobicContact CE1-CD2 4.19Å; Y285-F311 HydrophobicContact CE1-CG 4.1Å; Y285-F311 AromaticContact CE2-CD2 3.85Å; Y285-F311 HydrophobicContact CE2-CD2 3.85Å; Y285-F311 HydrophobicContact CE2-CE2 4.37Å; Y285-F311 HydrophobicContact CG-CB 4.38Å; Y285-F311 AromaticContact CZ-CD2 3.81Å; I286-F311 PolarHBondContact N-O 3.19Å
312	F	96.1	Very high	92.5	Very high	96 Å²	96	74.7 Å²	74.7	42%	0.421	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	149.8	175.8	64	-96.3	0	0	0	113.2	I286 I293	I286-F312 HydrophobicContact CB-CB 4.02Å; I286-F312 CarbonylContact O-C 3.5Å; I286-F312 WeakPolarHBondContact O-CA 3.39Å; I286-F312 WeakPolarHBondContact O-CB 3.34Å; I293-F312 HydrophobicContact CG2-CB 4.06Å; I293-F312 HydrophobicContact CG2-CD2 3.82Å; I293-F312 HydrophobicContact CG2-CE2 4.45Å; I293-F312 HydrophobicContact CG2-CG 3.9Å
313	E	92.9	Very high	92.2	Very high	27 Å²	27	72.1 Å²	72.1	13%	0.126	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	127.2	170.4	-178.3	168.9	87.1	0	0	109.6	W101 S116 F163 I286 C287 I293	W101-E313 VanDerWaalsContact CD1-OE2 3.29Å; S116-E313 PolarHBondContact OG-OE1 3.36Å; F163-E313 HydrophobicContact CB-CB 3.95Å; F163-E313 HydrophobicContact CD1-CB 3.98Å; F163-E313 HydrophobicContact CD2-CB 3.99Å; F163-E313 HydrophobicContact CE1-CB 4.45Å; F163-E313 HydrophobicContact CE2-CB 4.46Å; F163-E313 HydrophobicContact CG-CB 3.7Å; I286-E313 PolarHBondContact O-N 2.83Å; C287-E313 WeakPolarHBondContact CA-O 3.36Å; C287-E313 PolarHBondContact SG-O 3.42Å; I293-E313 WeakPolarHBondContact CD1-O 3.44Å
314	K	88.9	Confident	91.8	Very high	58 Å²	58	75.5 Å²	75.5	25%	0.252	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	133.3	176.4	-68.5	175.9	178.8	-166.5	0	109.1	P290 I293 E294 W316	P290-K314 HydrophobicContact CB-CD 4.34Å; P290-K314 HydrophobicContact CG-CD 4.41Å; I293-K314 HydrophobicContact CD1-CB 4.07Å; I293-K314 HydrophobicContact CD1-CG 3.51Å; E294-K314 IonicContact OE1-NZ 3.06Å; K314-W316 HydrophobicContact CB-CD2 4.19Å; K314-W316 HydrophobicContact CB-CE3 4.26Å; K314-W316 HydrophobicContact CB-CH2 3.52Å; K314-W316 HydrophobicContact CB-CZ2 3.37Å; K314-W316 HydrophobicContact CB-CZ3 3.95Å; K314-W316 HydrophobicContact CD-CH2 3.31Å; K314-W316 HydrophobicContact CD-CZ2 4Å; K314-W316 HydrophobicContact CD-CZ3 3.77Å; K314-W316 HydrophobicContact CG-CH2 4.02Å; K314-W316 HydrophobicContact CG-CZ2 4.26Å; K314-W316 HydrophobicContact CG-CZ3 4.46Å; K314-W316 PolarHBondContact O-NE1 3.49Å
315	W	77.5	Confident	91.4	Very high	78 Å²	78	76.7 Å²	76.7	30%	0.295	35%	0.35	S	S	.	.			trans	-102	150.7	165.3	74.4	-95.3	0	0	0	110.5	G181 V183 G288 P289	G181-W315 PolarHBondContact O-NE1 2.93Å; V183-W315 HydrophobicContact CG2-CD2 3.63Å; V183-W315 HydrophobicContact CG2-CE3 3.72Å; V183-W315 HydrophobicContact CG2-CG 4.15Å; V183-W315 HydrophobicContact CG2-CH2 4.14Å; V183-W315 HydrophobicContact CG2-CZ2 4.04Å; V183-W315 HydrophobicContact CG2-CZ3 3.97Å; G288-W315 PolarHBondContact O-N 2.9Å; P289-W315 HydrophobicContact CB-CZ2 4.25Å; P289-W315 VanDerWaalsContact N-NE1 3.15Å
316	W	65.9	Low	90.8	Very high	171 Å²	171	82 Å²	82	65%	0.648	37%	0.372	S	S	*	.			trans	-136.3	0	-162.7	-34.6	92.7	0	0	0	113.3	R57 P290 K314	R57-W316 VanDerWaalsContact CD-NE1 3.31Å; R57-W316 HydrophobicContact CG-CZ2 4.4Å; R57-W316 VanDerWaalsContact NH1-CD1 3.3Å; P290-W316 HydrophobicContact CG-CE3 3.98Å; P290-W316 HydrophobicContact CG-CZ3 3.95Å; K314-W316 HydrophobicContact CB-CD2 4.19Å; K314-W316 HydrophobicContact CB-CE3 4.26Å; K314-W316 HydrophobicContact CB-CH2 3.52Å; K314-W316 HydrophobicContact CB-CZ2 3.37Å; K314-W316 HydrophobicContact CB-CZ3 3.95Å; K314-W316 HydrophobicContact CD-CH2 3.31Å; K314-W316 HydrophobicContact CD-CZ2 4Å; K314-W316 HydrophobicContact CD-CZ3 3.77Å; K314-W316 HydrophobicContact CG-CH2 4.02Å; K314-W316 HydrophobicContact CG-CZ2 4.26Å; K314-W316 HydrophobicContact CG-CZ3 4.46Å; K314-W316 PolarHBondContact O-NE1 3.49Å

Retrieved 316 of 316 residues in 2159.9 ms (Link to these results)

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