A0A087X5P0_POEFO Loading...

Ribose-5-phosphate isomerase

AlphaFold DB , UniProt , Accession A0A087X5P0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 280 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	40.7	Very low	35	Very low	241 Å²	241	190.3 Å²	190.3	100%	1.187	88%	0.878	S	S	*	*				0	119.9	0	-77.1	167	77.7	0	0	107.6
2	T	33.1	Very low	35	Very low	142 Å²	142	186.6 Å²	186.6	87%	0.871	87%	0.868	S	S	*	*	P	Polyproline II helix	trans	-87.4	129.7	-151.9	-0.3	0	0	0	0	112.1
3	L	33.3	Very low	35.2	Very low	177 Å²	177	183.5 Å²	183.5	93%	0.927	87%	0.87	S	S	*	*	P	Polyproline II helix	trans	-68.4	123.6	166.3	-111.5	77.4	0	0	0	109.4
4	Q	40.1	Very low	35.1	Very low	178 Å²	178	177.7 Å²	177.7	83%	0.832	87%	0.869	S	S	*	*	P	Polyproline II helix	trans	-100.7	121.7	168.7	-86.9	-176.1	-27.3	0	0	111.2
5	R	34.3	Very low	35.1	Very low	233 Å²	233	172.3 Å²	172.3	88%	0.879	86%	0.864	S	S	*	*	P	Polyproline II helix	trans	-97.6	122.4	179.8	-162.2	179.9	-170.7	-173.8	2.6	107
6	W	33.2	Very low	34.9	Very low	229 Å²	229	168.3 Å²	168.3	87%	0.867	87%	0.866	S	S	*	*	P	Polyproline II helix	trans	-89.5	116.9	172.5	-79.1	85.1	0	0	0	110
7	V	33.1	Very low	34.8	Very low	109 Å²	109	164.1 Å²	164.1	66%	0.661	86%	0.862	S	S	*	*			trans	-105	130.7	168.7	171.2	0	0	0	0	106.6
8	F	33.9	Very low	34.7	Very low	199 Å²	199	160.9 Å²	160.9	87%	0.873	86%	0.856	S	S	*	*			trans	-128.2	117.9	161.8	-132.7	-92.6	0	0	0	109.1
9	L	33.6	Very low	34.6	Very low	155 Å²	155	158.4 Å²	158.4	81%	0.812	85%	0.853	S	S	*	*			trans	-99.1	141.9	-178.5	-161.8	77.6	0	0	0	109.7
10	R	36.4	Very low	34.6	Very low	214 Å²	214	156.1 Å²	156.1	81%	0.808	85%	0.849	S	S	*	*			trans	-53	154	175.3	-68.7	172.5	168	-163.7	-4.4	114.3
11	K	33.3	Very low	35.2	Very low	216 Å²	216	154.1 Å²	154.1	94%	0.939	84%	0.844	S	S	*	*			trans	-133.1	127	140.5	-84.9	-172.2	176.4	-179.4	0	110.9
12	L	34.6	Very low	35.7	Very low	146 Å²	146	147.2 Å²	147.2	76%	0.764	82%	0.817	S	S	*	*			trans	-93.3	149.2	167.6	-83.9	149	0	0	0	108.7
13	T	38.3	Very low	35.6	Very low	146 Å²	146	150 Å²	150	90%	0.896	82%	0.818	S	S	*	*			trans	-148.9	125.1	148	41.7	0	0	0	0	110.2
14	A	34	Very low	35.6	Very low	103 Å²	103	146.8 Å²	146.8	85%	0.851	81%	0.81	S	S	*	*			trans	-81	177.5	161.7	0	0	0	0	0	109.1
15	A	34.2	Very low	35.5	Very low	96 Å²	96	146.3 Å²	146.3	79%	0.793	81%	0.813	S	S	*	*			cis	-168	165.2	13.7	0	0	0	0	0	107.8
16	A	32.8	Very low	35.9	Very low	109 Å²	109	141 Å²	141	90%	0.901	81%	0.808	S	S	*	*				163.9	148.6	127.2	0	0	0	0	0	112.9
17	A	32.4	Very low	36.1	Very low	97 Å²	97	135.6 Å²	135.6	80%	0.802	81%	0.805	S	S	*	*			trans	-107.4	164.3	-166.4	0	0	0	0	0	113.6
18	S	32.7	Very low	36.4	Very low	107 Å²	107	135.9 Å²	135.9	75%	0.748	81%	0.812	S	S	*	*			trans	173.2	116.7	137.2	57.9	0	0	0	0	112.7
19	S	33.1	Very low	36.8	Very low	113 Å²	113	135.3 Å²	135.3	79%	0.79	82%	0.817	S	S	*	*				85.7	112.6	112.3	69.3	0	0	0	0	119.6
20	S	35.3	Very low	36.8	Very low	112 Å²	112	132.4 Å²	132.4	78%	0.783	81%	0.81	S	S	*	*			trans	-73.4	177.1	157.5	45.6	0	0	0	0	112.3
21	P	46.7	Very low	36.8	Very low	115 Å²	115	128.3 Å²	128.3	75%	0.747	81%	0.813	S	S	*	*			cis	-153.3	-145.6	33.3	41.2	-14.6	0	0	0	115.1
22	P	51.8	Low	36.8	Very low	96 Å²	96	122.9 Å²	122.9	62%	0.623	80%	0.801	S	S	*	*				-127.9	-173.6	-51.5	23.8	0.1	0	0	0	115.5
23	F	30.7	Very low	36.8	Very low	199 Å²	199	121.7 Å²	121.7	87%	0.873	80%	0.8	S	S	*	*			trans	82.5	139.8	163.4	-71.2	-86.6	0	0	0	117.5
24	S	34	Very low	36.6	Very low	110 Å²	110	123.3 Å²	123.3	77%	0.769	80%	0.797	S	S	*	*			cis	-161	158.3	17.6	38.5	0	0	0	0	111.4
25	L	37.3	Very low	37.1	Very low	169 Å²	169	124.8 Å²	124.8	89%	0.885	80%	0.795	S	S	*	*			trans	-80.5	156.5	170	-83.4	151.8	0	0	0	111.6
26	P	43.1	Very low	37.6	Very low	121 Å²	121	126.6 Å²	126.6	79%	0.786	79%	0.791	S	S	*	*				-134.1	147.4	121.1	32.7	-19.1	0	0	0	114.4
27	S	37.5	Very low	38	Very low	115 Å²	115	124.7 Å²	124.7	80%	0.804	78%	0.781	S	S	*	*			trans	-66	132.9	168.2	47.8	0	0	0	0	112.8
28	S	38.2	Very low	38.5	Very low	116 Å²	116	129.2 Å²	129.2	81%	0.811	78%	0.783	S	S	*	*			trans	-154.9	123.9	140.6	57.5	0	0	0	0	110.2	S30	S28-S30 PolarHBondContact O-N 2.76Å
29	L	42.2	Very low	39.4	Very low	186 Å²	186	127 Å²	127	97%	0.974	77%	0.768	S	S	*	*			trans	-67.5	116.3	169.2	-78.5	138.3	0	0	0	108
30	S	35	Very low	40.6	Very low	95 Å²	95	130.4 Å²	130.4	66%	0.664	77%	0.771	S	S	*	*			trans	-117.7	112	159.1	-173	0	0	0	0	107.9	S28 C32	S28-S30 PolarHBondContact O-N 2.76Å; S30-C32 PolarHBondContact O-N 2.87Å
31	C	35.5	Very low	42.1	Very low	128 Å²	128	128.3 Å²	128.3	87%	0.865	76%	0.756	S	S	*	*			trans	-65.5	86.8	168.1	-175.9	0	0	0	0	107.9	T33	C31-T33 PolarHBondContact O-N 3.03Å
32	C	33.4	Very low	43.4	Very low	101 Å²	101	124.7 Å²	124.7	68%	0.682	74%	0.736	S	S	*	*			trans	-85.2	106.7	163.3	-74.4	0	0	0	0	107.3	S30 H34	S30-C32 PolarHBondContact O-N 2.87Å; C32-H34 PolarHBondContact O-N 2.75Å; C32-H34 VanDerWaalsContact O-N 3.09Å
33	T	35.2	Very low	44.2	Very low	121 Å²	121	122.6 Å²	122.6	74%	0.742	73%	0.727	S	S	*	*			trans	-38.7	114.4	161.4	28.9	0	0	0	0	109.7	C31 V35	C31-T33 PolarHBondContact O-N 3.03Å; T33-V35 VanDerWaalsContact C-N 3.27Å; T33-V35 PolarHBondContact O-N 3.22Å
34	H	34.1	Very low	46.2	Very low	181 Å²	181	115.5 Å²	115.5	84%	0.838	71%	0.705	S	S	*	*			trans	-57.7	96.8	164.3	-93.5	-66.4	0	0	0	107.5	C32 L36	C32-H34 PolarHBondContact O-N 2.75Å; C32-H34 VanDerWaalsContact O-N 3.09Å; H34-L36 VanDerWaalsContact C-N 3.26Å; H34-L36 PolarHBondContact O-N 3.42Å
35	V	43.7	Very low	48.7	Very low	133 Å²	133	115.9 Å²	115.9	81%	0.806	70%	0.699	S	S	*	*			trans	-62.4	103.1	154.4	-178.3	0	0	0	0	104	T33 G37	T33-V35 VanDerWaalsContact C-N 3.27Å; T33-V35 PolarHBondContact O-N 3.22Å; V35-G37 PolarHBondContact O-N 2.97Å
36	L	44.6	Very low	51.2	Low	135 Å²	135	111.6 Å²	111.6	71%	0.707	68%	0.675	S	S	*	*			trans	-48.7	114.8	175.6	-73.2	161.5	0	0	0	107.4	H34 F38	H34-L36 VanDerWaalsContact C-N 3.26Å; H34-L36 PolarHBondContact O-N 3.42Å; L36-F38 PolarHBondContact O-N 3.38Å
37	G	42.3	Very low	53.6	Low	68 Å²	68	105.9 Å²	105.9	70%	0.701	64%	0.638	S	S	*	*			trans	-60.7	96.1	164.6	0	0	0	0	0	107.1	V35 S39	V35-G37 PolarHBondContact O-N 2.97Å; G37-S39 PolarHBondContact O-N 3.32Å
38	F	42.9	Very low	56.3	Low	192 Å²	192	103.6 Å²	103.6	84%	0.842	62%	0.615	S	S	*	*			trans	-61.2	93.5	160.2	-95.5	-90.4	0	0	0	105.7	L36	L36-F38 PolarHBondContact O-N 3.38Å
39	S	51.5	Low	59.1	Low	61 Å²	61	102.4 Å²	102.4	43%	0.427	60%	0.597	S	S	.	*			trans	-77.2	145.5	-158.6	56.9	0	0	0	0	110.1	G37 S41 A42	G37-S39 PolarHBondContact O-N 3.32Å; S39-S41 PolarHBondContact O-N 2.88Å; S39-S41 PolarHBondContact OG-OG 2.96Å; S39-A42 PolarHBondContact O-N 3.23Å
40	Q	57	Low	61.8	Low	184 Å²	184	93.7 Å²	93.7	86%	0.86	55%	0.551	S	S	*	*	H	α-helix	trans	-44	-23.1	175.3	-147.4	165.7	30.7	0	0	114.4	A44	Q40-A44 WeakPolarHBondContact O-CB 3.28Å; Q40-A44 PolarHBondContact O-N 3.15Å
41	S	67.9	Low	64.8	Low	68 Å²	68	90 Å²	90	48%	0.476	52%	0.523	S	S	.	.	H	α-helix	trans	-68.4	-35.1	174.2	62.1	0	0	0	0	114.9	S39 N45	S39-S41 PolarHBondContact O-N 2.88Å; S39-S41 PolarHBondContact OG-OG 2.96Å; S41-N45 VanDerWaalsContact O-CG 3.26Å; S41-N45 PolarHBondContact O-N 3.37Å
42	A	72.9	Confident	67.8	Low	39 Å²	39	87 Å²	87	32%	0.322	50%	0.495	S	S	.	.	H	α-helix	trans	-69.7	-45.1	179.6	0	0	0	0	0	110.7	S39 A44 N45 M46	S39-A42 PolarHBondContact O-N 3.23Å; A42-A44 VanDerWaalsContact C-N 3.35Å; A42-A44 PolarHBondContact O-N 2.92Å; A42-N45 PolarHBondContact O-N 3.3Å; A42-M46 WeakPolarHBondContact O-CG 3.11Å; A42-M46 PolarHBondContact O-N 2.84Å
43	A	69.2	Low	70.9	Confident	52 Å²	52	84.6 Å²	84.6	43%	0.43	48%	0.476	S	S	.	.	H	α-helix	trans	-62.7	-39.3	175.4	0	0	0	0	0	112.8	M46 A47	A43-M46 HydrophobicContact CB-CE 4.28Å; A43-M46 PolarHBondContact O-N 2.89Å; A43-A47 PolarHBondContact O-N 3.27Å; A43-A47 VanDerWaalsContact O-N 3.14Å
44	A	73.4	Confident	73.9	Confident	51 Å²	51	78.9 Å²	78.9	42%	0.421	44%	0.44	S	S	.	.	H	α-helix	trans	-62.3	-44	173.7	0	0	0	0	0	111.9	Q40 A42 A47 E48	Q40-A44 WeakPolarHBondContact O-CB 3.28Å; Q40-A44 PolarHBondContact O-N 3.15Å; A42-A44 VanDerWaalsContact C-N 3.35Å; A42-A44 PolarHBondContact O-N 2.92Å; A44-A47 PolarHBondContact O-N 3.47Å; A44-E48 WeakPolarHBondContact O-CG 3.46Å; A44-E48 PolarHBondContact O-N 3.5Å; A44-E48 VanDerWaalsContact O-N 3.13Å
45	N	85.1	Confident	77	Confident	117 Å²	117	70.2 Å²	70.2	63%	0.626	40%	0.4	S	S	*	.	H	α-helix	trans	-64.3	-40.3	177.7	-73.8	-10	0	0	0	112.6	S41 A42 A47 E48 E49	S41-N45 VanDerWaalsContact O-CG 3.26Å; S41-N45 PolarHBondContact O-N 3.37Å; A42-N45 PolarHBondContact O-N 3.3Å; N45-A47 PolarHBondContact O-N 2.95Å; N45-E48 PolarHBondContact O-N 3.49Å; N45-E49 PolarHBondContact O-N 3.08Å
46	M	91.2	Very high	79.6	Confident	79 Å²	79	66.5 Å²	66.5	39%	0.389	37%	0.372	S	S	.	.	H	α-helix	trans	-62.7	-42.7	177.4	-69.8	-175.7	-63.2	0	0	111.9	A42 A43 E48 E49 A50 E268	A42-M46 WeakPolarHBondContact O-CG 3.11Å; A42-M46 PolarHBondContact O-N 2.84Å; A43-M46 HydrophobicContact CB-CE 4.28Å; A43-M46 PolarHBondContact O-N 2.89Å; M46-E48 PolarHBondContact O-N 3.48Å; M46-E49 PolarHBondContact O-N 2.89Å; M46-A50 WeakPolarHBondContact O-CB 3.44Å; M46-A50 PolarHBondContact O-N 3.3Å; M46-E268 HydrophobicContact SD-CG 4.27Å
47	A	92.1	Very high	82.2	Confident	2 Å²	2	61.4 Å²	61.4	2%	0.017	35%	0.348	C	S	.	.	H	α-helix	trans	-64.6	-38.9	177	0	0	0	0	0	112.8	A43 A44 N45 K51	A43-A47 PolarHBondContact O-N 3.27Å; A43-A47 VanDerWaalsContact O-N 3.14Å; A44-A47 PolarHBondContact O-N 3.47Å; N45-A47 PolarHBondContact O-N 2.95Å; A47-K51 VanDerWaalsContact O-CG 3.3Å; A47-K51 WeakPolarHBondContact O-CG 3.4Å; A47-K51 PolarHBondContact O-N 3.4Å
48	E	95.4	Very high	84.9	Confident	66 Å²	66	58.1 Å²	58.1	31%	0.308	31%	0.314	S	S	.	.	H	α-helix	trans	-68.4	-40.5	177.1	-69.3	-53.6	127.4	0	0	112.4	A44 N45 M46 K51 K52 Y79	A44-E48 WeakPolarHBondContact O-CG 3.46Å; A44-E48 PolarHBondContact O-N 3.5Å; A44-E48 VanDerWaalsContact O-N 3.13Å; N45-E48 PolarHBondContact O-N 3.49Å; M46-E48 PolarHBondContact O-N 3.48Å; E48-K51 WeakPolarHBondContact O-CB 3.37Å; E48-K51 PolarHBondContact O-N 2.86Å; E48-K51 IonicContact OE1-NZ 2.85Å; E48-K51 PolarHBondContact OE1-NZ 3.4Å; E48-K51 IonicContact OE2-NZ 3.54Å; E48-K52 PolarHBondContact O-N 2.91Å; E48-Y79 WeakPolarHBondContact OE2-CE2 3.33Å; E48-Y79 PolarHBondContact OE2-OH 2.87Å
49	E	96.8	Very high	87.5	Confident	92 Å²	92	49.1 Å²	49.1	43%	0.43	28%	0.275	S	S	.	.	H	α-helix	trans	-65.5	-41.4	174.9	-168.5	59.5	-148.6	0	0	111.4	N45 M46 K51 K52 L53	N45-E49 PolarHBondContact O-N 3.08Å; M46-E49 PolarHBondContact O-N 2.89Å; E49-K51 PolarHBondContact O-N 3.09Å; E49-K52 WeakPolarHBondContact O-CB 3.5Å; E49-K52 PolarHBondContact O-N 2.83Å; E49-K52 VanDerWaalsContact O-N 3.17Å; E49-L53 HydrophobicContact CG-CD1 4.16Å; E49-L53 HydrophobicContact CG-CG 4.44Å; E49-L53 WeakPolarHBondContact O-CG 3.39Å; E49-L53 PolarHBondContact O-N 2.94Å
50	A	97.9	Very high	89.8	Confident	3 Å²	3	49.1 Å²	49.1	3%	0.025	27%	0.27	C	S	.	.	H	α-helix	trans	-57.2	-46.8	173.7	0	0	0	0	0	112	M46 K52 L53 A54 D166 Y167 G266	M46-A50 WeakPolarHBondContact O-CB 3.44Å; M46-A50 PolarHBondContact O-N 3.3Å; A50-K52 VanDerWaalsContact C-N 3.31Å; A50-K52 PolarHBondContact O-N 2.78Å; A50-L53 PolarHBondContact O-N 3.11Å; A50-A54 WeakPolarHBondContact O-CB 3.44Å; A50-A54 PolarHBondContact O-N 3.12Å; A50-D166 HydrophobicContact CB-CB 3.98Å; A50-Y167 HydrophobicContact CB-CD1 4.39Å; A50-G266 WeakPolarHBondContact CB-O 3.37Å; A50-G266 WeakPolarHBondContact O-CA 3.01Å
51	K	98.3	Very high	91.7	Very high	16 Å²	16	45.3 Å²	45.3	7%	0.07	26%	0.256	C	S	.	.	H	α-helix	trans	-56.7	-45.7	175.1	-75.2	176.5	-172.4	172.2	0	111.9	A47 E48 E49 A54 A55 S75 T76 Y79 D166	A47-K51 VanDerWaalsContact O-CG 3.3Å; A47-K51 WeakPolarHBondContact O-CG 3.4Å; A47-K51 PolarHBondContact O-N 3.4Å; E48-K51 WeakPolarHBondContact O-CB 3.37Å; E48-K51 PolarHBondContact O-N 2.86Å; E48-K51 IonicContact OE1-NZ 2.85Å; E48-K51 PolarHBondContact OE1-NZ 3.4Å; E48-K51 IonicContact OE2-NZ 3.54Å; E49-K51 PolarHBondContact O-N 3.09Å; K51-A54 PolarHBondContact O-N 2.84Å; K51-A55 VanDerWaalsContact O-CB 3.27Å; K51-A55 WeakPolarHBondContact O-CB 3.48Å; K51-A55 PolarHBondContact O-N 3.26Å; K51-S75 PolarHBondContact NZ-OG 3.28Å; K51-T76 HydrophobicContact CB-CG2 3.88Å; K51-T76 HydrophobicContact CG-CG2 4.03Å; K51-T76 WeakPolarHBondContact CG-OG1 3.35Å; K51-Y79 HydrophobicContact CB-CD2 3.82Å; K51-Y79 HydrophobicContact CB-CE2 3.76Å; K51-Y79 HydrophobicContact CD-CE2 4.27Å; K51-D166 HydrophobicContact CG-CB 4.06Å
52	K	98.5	Very high	93.2	Very high	65 Å²	65	42.8 Å²	42.8	28%	0.283	24%	0.237	S	C	.	.	H	α-helix	trans	-61.9	-48.5	179.4	-175.8	-176.5	174.7	-170	0	111.8	E48 E49 A50 A54 A55 Y56 Y79	E48-K52 PolarHBondContact O-N 2.91Å; E49-K52 WeakPolarHBondContact O-CB 3.5Å; E49-K52 PolarHBondContact O-N 2.83Å; E49-K52 VanDerWaalsContact O-N 3.17Å; A50-K52 VanDerWaalsContact C-N 3.31Å; A50-K52 PolarHBondContact O-N 2.78Å; K52-A54 PolarHBondContact O-N 2.8Å; K52-A55 PolarHBondContact O-N 2.68Å; K52-Y56 HydrophobicContact CD-CE1 4.41Å; K52-Y56 HydrophobicContact CG-CD1 3.81Å; K52-Y56 HydrophobicContact CG-CE1 3.58Å; K52-Y56 HydrophobicContact CG-CG 4.49Å; K52-Y56 WeakPolarHBondContact O-CB 3.43Å; K52-Y56 WeakPolarHBondContact O-CD1 3.27Å; K52-Y56 PolarHBondContact O-N 2.84Å; K52-Y79 HydrophobicContact CB-CD1 3.82Å; K52-Y79 HydrophobicContact CB-CD2 4.31Å; K52-Y79 HydrophobicContact CB-CE1 4.19Å; K52-Y79 HydrophobicContact CB-CG 3.88Å; K52-Y79 HydrophobicContact CD-CD1 4.35Å; K52-Y79 HydrophobicContact CG-CD1 3.87Å; K52-Y79 HydrophobicContact CG-CE1 4.48Å; K52-Y79 HydrophobicContact CG-CG 4.2Å
53	L	98.5	Very high	94.4	Very high	52 Å²	52	41.1 Å²	41.1	27%	0.272	22%	0.223	S	C	.	.	H	α-helix	trans	-60.9	-43.6	179.4	-69.3	169.2	0	0	0	112.1	E49 A50 S57 G270 V272	E49-L53 HydrophobicContact CG-CD1 4.16Å; E49-L53 HydrophobicContact CG-CG 4.44Å; E49-L53 WeakPolarHBondContact O-CG 3.39Å; E49-L53 PolarHBondContact O-N 2.94Å; A50-L53 PolarHBondContact O-N 3.11Å; L53-S57 VanDerWaalsContact O-CB 3.28Å; L53-S57 WeakPolarHBondContact O-CB 3.08Å; L53-S57 PolarHBondContact O-N 3.26Å; L53-G270 WeakPolarHBondContact CD1-O 3.5Å; L53-V272 HydrophobicContact CB-CG2 3.83Å
54	A	98.8	Very high	95.8	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-60.6	-48.8	175.3	0	0	0	0	0	111.8	A50 K51 K52 S57 A58 A165	A50-A54 WeakPolarHBondContact O-CB 3.44Å; A50-A54 PolarHBondContact O-N 3.12Å; K51-A54 PolarHBondContact O-N 2.84Å; K52-A54 PolarHBondContact O-N 2.8Å; A54-S57 PolarHBondContact O-N 3.43Å; A54-A58 WeakPolarHBondContact O-CB 3.43Å; A54-A58 PolarHBondContact O-N 3.13Å; A54-A165 VanDerWaalsContact CB-O 3.31Å; A54-A165 WeakPolarHBondContact CB-O 3.41Å
55	A	98.8	Very high	97	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-61.7	-46.3	-179.6	0	0	0	0	0	112	K51 K52 A58 V59 A80 I164	K51-A55 VanDerWaalsContact O-CB 3.27Å; K51-A55 WeakPolarHBondContact O-CB 3.48Å; K51-A55 PolarHBondContact O-N 3.26Å; K52-A55 PolarHBondContact O-N 2.68Å; A55-A58 PolarHBondContact O-N 3.39Å; A55-V59 WeakPolarHBondContact O-CG2 3.17Å; A55-V59 PolarHBondContact O-N 3.37Å; A55-A80 HydrophobicContact CB-CB 4.06Å; A55-I164 HydrophobicContact CB-CD1 3.86Å
56	Y	98.8	Very high	97.6	Very high	55 Å²	55	45.9 Å²	45.9	22%	0.216	23%	0.23	C	C	.	.	H	α-helix	trans	-63.2	-48.5	-180	-83.3	43.6	0	0	0	110.6	K52 A58 V59 D60 Y79 R83	K52-Y56 HydrophobicContact CD-CE1 4.41Å; K52-Y56 HydrophobicContact CG-CD1 3.81Å; K52-Y56 HydrophobicContact CG-CE1 3.58Å; K52-Y56 HydrophobicContact CG-CG 4.49Å; K52-Y56 WeakPolarHBondContact O-CB 3.43Å; K52-Y56 WeakPolarHBondContact O-CD1 3.27Å; K52-Y56 PolarHBondContact O-N 2.84Å; Y56-A58 VanDerWaalsContact C-N 3.32Å; Y56-A58 PolarHBondContact O-N 3.23Å; Y56-V59 PolarHBondContact O-N 2.72Å; Y56-D60 WeakPolarHBondContact O-CB 3.25Å; Y56-D60 PolarHBondContact O-N 3.4Å; Y56-Y79 WeakPolarHBondContact CE1-O 3.38Å; Y56-R83 HydrophobicContact CD1-CB 3.74Å; Y56-R83 HydrophobicContact CD1-CG 4.2Å; Y56-R83 HydrophobicContact CD2-CB 4.42Å; Y56-R83 HydrophobicContact CD2-CG 4.16Å; Y56-R83 HydrophobicContact CE1-CB 3.82Å; Y56-R83 HydrophobicContact CE2-CB 4.47Å; Y56-R83 HydrophobicContact CG-CB 4.06Å; Y56-R83 HydrophobicContact CG-CG 3.99Å
57	S	98.8	Very high	98	Very high	27 Å²	27	43.4 Å²	43.4	19%	0.189	22%	0.217	C	C	.	.	H	α-helix	trans	-59.8	-41.4	177.4	-175.1	0	0	0	0	112.1	L53 A54 N61	L53-S57 VanDerWaalsContact O-CB 3.28Å; L53-S57 WeakPolarHBondContact O-CB 3.08Å; L53-S57 PolarHBondContact O-N 3.26Å; A54-S57 PolarHBondContact O-N 3.43Å; S57-N61 WeakPolarHBondContact O-CB 3.41Å; S57-N61 PolarHBondContact O-N 2.87Å; S57-N61 VanDerWaalsContact O-N 3.12Å; S57-N61 PolarHBondContact O-ND2 2.8Å; S57-N61 PolarHBondContact OG-ND2 2.77Å
58	A	98.8	Very high	98.3	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-65.1	-45.7	177.5	0	0	0	0	0	112.6	A54 A55 Y56 N62 V162 I164 Y264	A54-A58 WeakPolarHBondContact O-CB 3.43Å; A54-A58 PolarHBondContact O-N 3.13Å; A55-A58 PolarHBondContact O-N 3.39Å; Y56-A58 VanDerWaalsContact C-N 3.32Å; Y56-A58 PolarHBondContact O-N 3.23Å; A58-N62 WeakPolarHBondContact O-CB 3.36Å; A58-N62 PolarHBondContact O-N 2.78Å; A58-N62 VanDerWaalsContact O-N 3.11Å; A58-N62 PolarHBondContact O-ND2 2.97Å; A58-V162 HydrophobicContact CB-CG1 3.98Å; A58-I164 HydrophobicContact CB-CG2 3.26Å; A58-Y264 HydrophobicContact CB-CD1 4.3Å; A58-Y264 HydrophobicContact CB-CD2 3.75Å; A58-Y264 HydrophobicContact CB-CE2 4.14Å; A58-Y264 HydrophobicContact CB-CG 3.87Å
59	V	98.8	Very high	98.4	Very high	2 Å²	2	41.1 Å²	41.1	1%	0.012	21%	0.207	C	C	.	.	H	α-helix	trans	-63.9	-45.7	178.4	171.4	0	0	0	0	111	A55 Y56 N61 V63 A80 R83 L84 R87 I128	A55-V59 WeakPolarHBondContact O-CG2 3.17Å; A55-V59 PolarHBondContact O-N 3.37Å; Y56-V59 PolarHBondContact O-N 2.72Å; V59-N61 VanDerWaalsContact C-N 3.31Å; V59-N61 PolarHBondContact O-N 3.26Å; V59-V63 HydrophobicContact CG1-CB 4.48Å; V59-V63 HydrophobicContact CG1-CG2 4.28Å; V59-V63 WeakPolarHBondContact O-CB 3.3Å; V59-V63 PolarHBondContact O-N 2.85Å; V59-V63 VanDerWaalsContact O-N 3.09Å; V59-A80 HydrophobicContact CG2-CB 3.95Å; V59-R83 HydrophobicContact CB-CB 4.32Å; V59-R83 HydrophobicContact CB-CG 3.95Å; V59-R83 HydrophobicContact CG1-CB 4.27Å; V59-R83 HydrophobicContact CG1-CG 3.81Å; V59-R83 HydrophobicContact CG2-CB 4.45Å; V59-L84 HydrophobicContact CG1-CB 4.33Å; V59-L84 HydrophobicContact CG1-CD1 4.45Å; V59-R87 PolarHBondContact O-NH1 3.37Å; V59-I128 HydrophobicContact CG2-CD1 3.75Å
60	D	98.6	Very high	98.5	Very high	61 Å²	61	36.8 Å²	36.8	33%	0.326	19%	0.187	S	C	.	.	H	α-helix	trans	-62	-38.9	-178.4	-71	-3.9	0	0	0	112.1	Y56 R83 R87	Y56-D60 WeakPolarHBondContact O-CB 3.25Å; Y56-D60 PolarHBondContact O-N 3.4Å; D60-R83 VanDerWaalsContact CG-NH2 3.34Å; D60-R83 IonicContact OD1-CZ 3.66Å; D60-R83 IonicContact OD1-NE 3.54Å; D60-R83 PolarHBondContact OD1-NE 2.76Å; D60-R83 IonicContact OD1-NH2 2.68Å; D60-R83 PolarHBondContact OD1-NH2 2.74Å; D60-R83 VanDerWaalsContact OD1-NH2 3.12Å; D60-R83 IonicContact OD2-CZ 3.69Å; D60-R83 IonicContact OD2-NE 3.77Å; D60-R83 PolarHBondContact OD2-NE 2.82Å; D60-R83 IonicContact OD2-NH2 3.51Å; D60-R83 PolarHBondContact OD2-NH2 2.8Å; D60-R87 WeakPolarHBondContact OD1-CD 3.43Å
61	N	98.4	Very high	98.6	Very high	104 Å²	104	37 Å²	37	56%	0.556	19%	0.188	S	C	*	.	H	α-helix	trans	-90.5	-16.4	-173.8	-71.2	-62.7	0	0	0	114.9	S57 V59	S57-N61 WeakPolarHBondContact O-CB 3.41Å; S57-N61 PolarHBondContact O-N 2.87Å; S57-N61 VanDerWaalsContact O-N 3.12Å; S57-N61 PolarHBondContact O-ND2 2.8Å; S57-N61 PolarHBondContact OG-ND2 2.77Å; V59-N61 VanDerWaalsContact C-N 3.31Å; V59-N61 PolarHBondContact O-N 3.26Å
62	N	98.3	Very high	98.6	Very high	16 Å²	16	36.3 Å²	36.3	9%	0.086	19%	0.185	C	C	.	.	H	α-helix	trans	-125	-14.9	-171.5	-55.3	-84.9	0	0	0	114.3	A58 V126 V162 R262 Y264	A58-N62 WeakPolarHBondContact O-CB 3.36Å; A58-N62 PolarHBondContact O-N 2.78Å; A58-N62 VanDerWaalsContact O-N 3.11Å; A58-N62 PolarHBondContact O-ND2 2.97Å; N62-V126 HydrophobicContact CB-CG2 4.36Å; N62-V162 HydrophobicContact CB-CG2 4.07Å; N62-R262 PolarHBondContact OD1-NH1 3.16Å; N62-Y264 WeakPolarHBondContact ND2-CE2 3.06Å; N62-Y264 PolarHBondContact ND2-OH 3.42Å
63	V	98.2	Very high	98.6	Very high	4 Å²	4	33.7 Å²	33.7	2%	0.024	18%	0.175	C	C	.	.			trans	-97.9	128.7	176.9	-177.8	0	0	0	0	111.1	V59 V69 L84 R87 I95 V126 I128	V59-V63 HydrophobicContact CG1-CB 4.48Å; V59-V63 HydrophobicContact CG1-CG2 4.28Å; V59-V63 WeakPolarHBondContact O-CB 3.3Å; V59-V63 PolarHBondContact O-N 2.85Å; V59-V63 VanDerWaalsContact O-N 3.09Å; V63-V69 HydrophobicContact CG1-CG2 4.11Å; V63-V69 HydrophobicContact CG2-CG2 4.45Å; V63-L84 HydrophobicContact CG1-CD1 3.82Å; V63-R87 PolarHBondContact O-NH1 2.93Å; V63-R87 PolarHBondContact O-NH2 2.77Å; V63-I95 HydrophobicContact CG1-CD1 3.8Å; V63-I95 HydrophobicContact CG1-CG1 4.45Å; V63-V126 HydrophobicContact CG2-CG1 4.25Å; V63-I128 HydrophobicContact CG2-CD1 3.79Å
64	Q	98.2	Very high	98.5	Very high	135 Å²	135	32.5 Å²	32.5	63%	0.631	18%	0.175	S	C	*	.			trans	-123.5	160.6	179.5	-59.5	-177.9	-18.6	0	0	110.9	Q67 I95	Q64-Q67 HydrophobicContact CB-CG 4.26Å; Q64-Q67 WeakPolarHBondContact O-CB 3.33Å; Q64-Q67 WeakPolarHBondContact O-CG 3.41Å; Q64-Q67 PolarHBondContact O-OE1 2.9Å; Q64-I95 WeakPolarHBondContact O-CD1 3.28Å
65	N	98.3	Very high	98.3	Very high	78 Å²	78	35.4 Å²	35.4	42%	0.417	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	148.2	176.8	-167.4	24.5	0	0	0	111.9	Q67 L93 N94	N65-Q67 VanDerWaalsContact C-N 3.33Å; N65-L93 HydrophobicContact CB-CD2 3.86Å; N65-L93 WeakPolarHBondContact OD1-CA 3.47Å; N65-N94 PolarHBondContact OD1-N 3.31Å
66	N	98.4	Very high	98.3	Very high	107 Å²	107	36.1 Å²	36.1	57%	0.572	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.9	31.6	-179.7	-54.6	-53.3	0	0	0	114.6	N94	N66-N94 WeakPolarHBondContact CA-O 3.42Å; N66-N94 PolarHBondContact N-O 3.35Å; N66-N94 WeakPolarHBondContact OD1-CB 3.4Å; N66-N94 PolarHBondContact OD1-ND2 2.84Å
67	Q	98.5	Very high	98.2	Very high	26 Å²	26	33.6 Å²	33.6	12%	0.121	19%	0.19	C	C	.	.			trans	-101.4	150.3	175.9	-75	-173	-30.6	0	0	113.1	Q64 N65 V69 I95 V96 D125	Q64-Q67 HydrophobicContact CB-CG 4.26Å; Q64-Q67 WeakPolarHBondContact O-CB 3.33Å; Q64-Q67 WeakPolarHBondContact O-CG 3.41Å; Q64-Q67 PolarHBondContact O-OE1 2.9Å; N65-Q67 VanDerWaalsContact C-N 3.33Å; Q67-V69 HydrophobicContact CB-CG2 4.31Å; Q67-I95 HydrophobicContact CB-CD1 4.15Å; Q67-I95 WeakPolarHBondContact O-CA 3.29Å; Q67-V96 PolarHBondContact O-N 2.87Å; Q67-V96 VanDerWaalsContact O-N 3.15Å; Q67-D125 VanDerWaalsContact CA-OD2 3.28Å; Q67-D125 WeakPolarHBondContact CA-OD2 3.33Å; Q67-D125 HydrophobicContact CB-CB 3.95Å; Q67-D125 HydrophobicContact CG-CB 3.72Å
68	V	98.8	Very high	98.2	Very high	18 Å²	18	34.4 Å²	34.4	11%	0.109	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	120.8	162	-171.7	0	0	0	0	108.7	V96 V98 H121 L124 D125 V126	V68-V96 CarbonylContact C-O 3.57Å; V68-V96 WeakPolarHBondContact CA-O 3.5Å; V68-V96 HydrophobicContact CG1-CB 4.48Å; V68-V96 HydrophobicContact CG2-CB 4.49Å; V68-V98 HydrophobicContact CG1-CG2 3.81Å; V68-H121 HydrophobicContact CG1-CB 3.84Å; V68-H121 HydrophobicContact CG2-CB 4.36Å; V68-L124 HydrophobicContact CG1-CB 4.49Å; V68-L124 HydrophobicContact CG1-CD2 4.32Å; V68-L124 HydrophobicContact CG1-CG 3.91Å; V68-D125 PolarHBondContact N-OD2 2.85Å; V68-D125 PolarHBondContact O-N 2.83Å; V68-V126 PolarHBondContact O-N 2.82Å
69	V	98.9	Very high	98.2	Very high	3 Å²	3	36.6 Å²	36.6	2%	0.018	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	121.3	-172.5	-179.3	0	0	0	0	110.9	V63 Q67 V71 L84 I95 V96 C97 V98 V126	V63-V69 HydrophobicContact CG1-CG2 4.11Å; V63-V69 HydrophobicContact CG2-CG2 4.45Å; Q67-V69 HydrophobicContact CB-CG2 4.31Å; V69-V71 HydrophobicContact CG1-CG2 4.4Å; V69-L84 HydrophobicContact CG1-CD2 4.47Å; V69-I95 HydrophobicContact CB-CG2 4.11Å; V69-I95 HydrophobicContact CG2-CG2 3.58Å; V69-V96 PolarHBondContact N-O 3.09Å; V69-C97 CarbonylContact O-C 3.57Å; V69-C97 VanDerWaalsContact O-CA 3.31Å; V69-C97 WeakPolarHBondContact O-CA 3.31Å; V69-V98 PolarHBondContact O-N 3.43Å; V69-V126 CarbonylContact C-O 3.54Å; V69-V126 VanDerWaalsContact CA-O 3.26Å; V69-V126 WeakPolarHBondContact CA-O 3.48Å; V69-V126 HydrophobicContact CB-CG1 4.43Å; V69-V126 HydrophobicContact CG1-CG1 4.26Å; V69-V126 HydrophobicContact CG2-CG1 3.85Å
70	G	98.9	Very high	98.2	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	121.7	167.7	0	0	0	0	0	109.9	V98 L124 V126 A127 I128	G70-V98 CarbonylContact C-O 3.47Å; G70-V98 WeakPolarHBondContact CA-O 3.24Å; G70-L124 VanDerWaalsContact CA-CD2 3.45Å; G70-L124 VanDerWaalsContact N-CD2 3.35Å; G70-V126 PolarHBondContact N-O 3.49Å; G70-A127 WeakPolarHBondContact O-CA 3.35Å; G70-I128 PolarHBondContact O-N 3.01Å
71	V	98.9	Very high	98.2	Very high	8 Å²	8	34 Å²	34	5%	0.048	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	114.6	-178.1	-178.7	0	0	0	0	109.5	V69 I77 V81 C97 V98 T100 A104 I108	V69-V71 HydrophobicContact CG1-CG2 4.4Å; V71-I77 HydrophobicContact CG1-CG2 3.89Å; V71-V81 HydrophobicContact CG1-CG2 3.59Å; V71-C97 HydrophobicContact CG2-CB 3.81Å; V71-V98 PolarHBondContact N-O 3.44Å; V71-T100 VanDerWaalsContact O-CG2 3.26Å; V71-T100 WeakPolarHBondContact O-CG2 3.4Å; V71-T100 PolarHBondContact O-N 3.37Å; V71-T100 PolarHBondContact O-OG1 3.29Å; V71-A104 HydrophobicContact CG1-CB 4.36Å; V71-I108 HydrophobicContact CB-CD1 3.96Å; V71-I108 HydrophobicContact CB-CG1 4.31Å; V71-I108 HydrophobicContact CG1-CD1 4.34Å; V71-I108 HydrophobicContact CG1-CG1 4.24Å; V71-I108 HydrophobicContact CG2-CD1 3.96Å; V71-I108 HydrophobicContact CG2-CG1 4.12Å
72	G	98.6	Very high	98.2	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.01	18%	0.176	C	C	.	.			trans	-62	-169.1	179.1	0	0	0	0	0	116.3	I77 T100 A104 I128 D129	G72-I77 WeakPolarHBondContact O-CG2 3.25Å; G72-T100 VanDerWaalsContact CA-OG1 3.28Å; G72-T100 WeakPolarHBondContact CA-OG1 3.25Å; G72-A104 WeakPolarHBondContact O-CB 3.47Å; G72-I128 WeakPolarHBondContact CA-O 3.3Å; G72-I128 PolarHBondContact N-O 2.6Å; G72-D129 WeakPolarHBondContact CA-OD1 3.46Å
73	S	97.7	Very high	98.3	Very high	10 Å²	10	32.8 Å²	32.8	7%	0.07	18%	0.18	C	C	.	.			trans	-128.9	162.6	179.7	-63.7	0	0	0	0	112.5	I77 T100 S101 D129	S73-I77 WeakPolarHBondContact O-CG1 3.45Å; S73-T100 PolarHBondContact N-OG1 3.05Å; S73-T100 PolarHBondContact OG-OG1 3.49Å; S73-S101 WeakPolarHBondContact OG-CB 3.48Å; S73-S101 PolarHBondContact OG-OG 2.75Å; S73-D129 PolarHBondContact N-OD1 2.84Å
74	G	96.4	Very high	98.3	Very high	27 Å²	27	32.9 Å²	32.9	28%	0.278	18%	0.18	S	C	.	.	S	Bend	trans	96.2	177.3	176.7	0	0	0	0	0	114.9	T76 I77	G74-T76 PolarHBondContact O-N 3.24Å; G74-I77 PolarHBondContact O-N 2.82Å
75	S	96.3	Very high	98.3	Very high	61 Å²	61	27.3 Å²	27.3	43%	0.427	16%	0.157	S	C	.	.	H	α-helix	trans	-64.2	-33.4	-168.6	61	0	0	0	0	114.7	K51 I77	K51-S75 PolarHBondContact NZ-OG 3.28Å; S75-I77 VanDerWaalsContact C-N 3.29Å; S75-I77 PolarHBondContact O-N 2.92Å
76	T	97.1	Very high	98.3	Very high	15 Å²	15	25.9 Å²	25.9	9%	0.092	15%	0.148	C	C	.	.	H	α-helix	trans	-70.8	-28.7	-180	-48.6	0	0	0	0	111.7	K51 G74 V78 Y79 I164	K51-T76 HydrophobicContact CB-CG2 3.88Å; K51-T76 HydrophobicContact CG-CG2 4.03Å; K51-T76 WeakPolarHBondContact CG-OG1 3.35Å; G74-T76 PolarHBondContact O-N 3.24Å; T76-V78 VanDerWaalsContact C-N 3.27Å; T76-V78 PolarHBondContact O-N 3.38Å; T76-Y79 PolarHBondContact O-N 2.98Å; T76-I164 HydrophobicContact CG2-CB 4.18Å; T76-I164 HydrophobicContact CG2-CD1 3.76Å; T76-I164 HydrophobicContact CG2-CG1 3.79Å
77	I	98.3	Very high	98.3	Very high	2 Å²	2	21.8 Å²	21.8	1%	0.01	13%	0.125	C	C	.	.	H	α-helix	trans	-70.8	-24.7	-177.5	-67.8	-70.8	0	0	0	112.8	V71 G72 S73 G74 S75 Y79 A80 V81 I128 D129 I164	V71-I77 HydrophobicContact CG1-CG2 3.89Å; G72-I77 WeakPolarHBondContact O-CG2 3.25Å; S73-I77 WeakPolarHBondContact O-CG1 3.45Å; G74-I77 PolarHBondContact O-N 2.82Å; S75-I77 VanDerWaalsContact C-N 3.29Å; S75-I77 PolarHBondContact O-N 2.92Å; I77-Y79 PolarHBondContact O-N 3.3Å; I77-A80 HydrophobicContact CD1-CB 4.45Å; I77-A80 WeakPolarHBondContact O-CB 3.3Å; I77-A80 PolarHBondContact O-N 3.38Å; I77-V81 HydrophobicContact CG2-CG2 3.98Å; I77-V81 WeakPolarHBondContact O-CG2 3.45Å; I77-V81 PolarHBondContact O-N 2.82Å; I77-I128 HydrophobicContact CD1-CG2 4.2Å; I77-I128 WeakPolarHBondContact CD1-O 3.49Å; I77-D129 VanDerWaalsContact CD1-CA 3.49Å; I77-I164 HydrophobicContact CD1-CD1 3.57Å; I77-I164 HydrophobicContact CD1-CG1 4.05Å; I77-I164 HydrophobicContact CG1-CD1 4.41Å
78	V	98.3	Very high	98.3	Very high	44 Å²	44	22.4 Å²	22.4	27%	0.267	13%	0.13	S	C	.	.	H	α-helix	trans	-50.5	-49.8	172.8	-179.8	0	0	0	0	110.1	T76 A80 V81 D82 L107	T76-V78 VanDerWaalsContact C-N 3.27Å; T76-V78 PolarHBondContact O-N 3.38Å; V78-A80 VanDerWaalsContact C-N 3.34Å; V78-A80 PolarHBondContact O-N 2.84Å; V78-V81 PolarHBondContact O-N 2.91Å; V78-D82 PolarHBondContact O-N 3.26Å; V78-L107 HydrophobicContact CG1-CD2 4.47Å; V78-L107 HydrophobicContact CG2-CD1 4.03Å; V78-L107 HydrophobicContact CG2-CD2 4.18Å
79	Y	98.7	Very high	98.3	Very high	47 Å²	47	29.5 Å²	29.5	18%	0.184	16%	0.155	C	C	.	.	H	α-helix	trans	-67.3	-30.3	179.3	-55.5	-66.1	0	0	0	114	E48 K51 K52 Y56 T76 I77 R83	E48-Y79 WeakPolarHBondContact OE2-CE2 3.33Å; E48-Y79 PolarHBondContact OE2-OH 2.87Å; K51-Y79 HydrophobicContact CB-CD2 3.82Å; K51-Y79 HydrophobicContact CB-CE2 3.76Å; K51-Y79 HydrophobicContact CD-CE2 4.27Å; K52-Y79 HydrophobicContact CB-CD1 3.82Å; K52-Y79 HydrophobicContact CB-CD2 4.31Å; K52-Y79 HydrophobicContact CB-CE1 4.19Å; K52-Y79 HydrophobicContact CB-CG 3.88Å; K52-Y79 HydrophobicContact CD-CD1 4.35Å; K52-Y79 HydrophobicContact CG-CD1 3.87Å; K52-Y79 HydrophobicContact CG-CE1 4.48Å; K52-Y79 HydrophobicContact CG-CG 4.2Å; Y56-Y79 WeakPolarHBondContact CE1-O 3.38Å; T76-Y79 PolarHBondContact O-N 2.98Å; I77-Y79 PolarHBondContact O-N 3.3Å; Y79-R83 WeakPolarHBondContact O-CB 3.26Å; Y79-R83 PolarHBondContact O-N 2.96Å
80	A	98.8	Very high	98.3	Very high	6 Å²	6	34.6 Å²	34.6	5%	0.05	18%	0.178	C	C	.	.	H	α-helix	trans	-70.1	-41.5	176.4	0	0	0	0	0	110.8	A55 V59 I77 V78 R83 L84 I128 I164	A55-A80 HydrophobicContact CB-CB 4.06Å; V59-A80 HydrophobicContact CG2-CB 3.95Å; I77-A80 HydrophobicContact CD1-CB 4.45Å; I77-A80 WeakPolarHBondContact O-CB 3.3Å; I77-A80 PolarHBondContact O-N 3.38Å; V78-A80 VanDerWaalsContact C-N 3.34Å; V78-A80 PolarHBondContact O-N 2.84Å; A80-R83 PolarHBondContact O-N 2.85Å; A80-L84 VanDerWaalsContact O-CB 3.3Å; A80-L84 WeakPolarHBondContact O-CB 3.36Å; A80-L84 PolarHBondContact O-N 2.95Å; A80-I128 HydrophobicContact CB-CG2 4.26Å; A80-I164 HydrophobicContact CB-CD1 3.76Å
81	V	98.7	Very high	98.2	Very high	3 Å²	3	39.1 Å²	39.1	2%	0.018	20%	0.199	C	C	.	.	H	α-helix	trans	-66	-43.1	175.3	176.9	0	0	0	0	110.7	V71 I77 V78 R83 L84 A85 L107 H111 L113	V71-V81 HydrophobicContact CG1-CG2 3.59Å; I77-V81 HydrophobicContact CG2-CG2 3.98Å; I77-V81 WeakPolarHBondContact O-CG2 3.45Å; I77-V81 PolarHBondContact O-N 2.82Å; V78-V81 PolarHBondContact O-N 2.91Å; V81-R83 VanDerWaalsContact C-N 3.33Å; V81-R83 PolarHBondContact O-N 3.3Å; V81-L84 PolarHBondContact O-N 2.99Å; V81-A85 WeakPolarHBondContact O-CB 3.44Å; V81-A85 PolarHBondContact O-N 3.33Å; V81-L107 HydrophobicContact CG1-CB 4.3Å; V81-L107 HydrophobicContact CG2-CB 4.31Å; V81-H111 HydrophobicContact CG1-CB 4.03Å; V81-H111 WeakPolarHBondContact CG1-ND1 3.48Å; V81-L113 HydrophobicContact CG1-CD1 3.86Å
82	D	98.6	Very high	98.2	Very high	48 Å²	48	46.2 Å²	46.2	26%	0.257	23%	0.23	S	C	.	.	H	α-helix	trans	-54.9	-49.8	175	-66.7	-8.4	0	0	0	110.7	V78 A85 E86 H111	V78-D82 PolarHBondContact O-N 3.26Å; D82-A85 PolarHBondContact O-N 2.72Å; D82-E86 PolarHBondContact O-N 3.38Å; D82-H111 IonicContact OD1-CD2 3.09Å; D82-H111 IonicContact OD1-CE1 2.71Å; D82-H111 PolarHBondContact OD1-CE1 2.99Å; D82-H111 VanDerWaalsContact OD1-CE1 3.24Å; D82-H111 IonicContact OD1-NE2 2.72Å; D82-H111 PolarHBondContact OD1-NE2 2.91Å
83	R	98.8	Very high	98.2	Very high	45 Å²	45	47 Å²	47	17%	0.17	23%	0.233	C	C	.	.	H	α-helix	trans	-65.4	-42.5	179.1	-175.6	56.6	169.6	173.5	0.5	112.3	Y56 V59 D60 Y79 A80 V81 A85 E86 R87	Y56-R83 HydrophobicContact CD1-CB 3.74Å; Y56-R83 HydrophobicContact CD1-CG 4.2Å; Y56-R83 HydrophobicContact CD2-CB 4.42Å; Y56-R83 HydrophobicContact CD2-CG 4.16Å; Y56-R83 HydrophobicContact CE1-CB 3.82Å; Y56-R83 HydrophobicContact CE2-CB 4.47Å; Y56-R83 HydrophobicContact CG-CB 4.06Å; Y56-R83 HydrophobicContact CG-CG 3.99Å; V59-R83 HydrophobicContact CB-CB 4.32Å; V59-R83 HydrophobicContact CB-CG 3.95Å; V59-R83 HydrophobicContact CG1-CB 4.27Å; V59-R83 HydrophobicContact CG1-CG 3.81Å; V59-R83 HydrophobicContact CG2-CB 4.45Å; D60-R83 VanDerWaalsContact CG-NH2 3.34Å; D60-R83 IonicContact OD1-CZ 3.66Å; D60-R83 IonicContact OD1-NE 3.54Å; D60-R83 PolarHBondContact OD1-NE 2.76Å; D60-R83 IonicContact OD1-NH2 2.68Å; D60-R83 PolarHBondContact OD1-NH2 2.74Å; D60-R83 VanDerWaalsContact OD1-NH2 3.12Å; D60-R83 IonicContact OD2-CZ 3.69Å; D60-R83 IonicContact OD2-NE 3.77Å; D60-R83 PolarHBondContact OD2-NE 2.82Å; D60-R83 IonicContact OD2-NH2 3.51Å; D60-R83 PolarHBondContact OD2-NH2 2.8Å; Y79-R83 WeakPolarHBondContact O-CB 3.26Å; Y79-R83 PolarHBondContact O-N 2.96Å; A80-R83 PolarHBondContact O-N 2.85Å; V81-R83 VanDerWaalsContact C-N 3.33Å; V81-R83 PolarHBondContact O-N 3.3Å; R83-A85 VanDerWaalsContact C-N 3.33Å; R83-A85 PolarHBondContact O-N 3.01Å; R83-E86 IonicContact CZ-OE2 2.83Å; R83-E86 IonicContact NH1-OE1 3.84Å; R83-E86 PolarHBondContact NH1-OE1 3.12Å; R83-E86 IonicContact NH1-OE2 3.36Å; R83-E86 PolarHBondContact NH1-OE2 3.43Å; R83-E86 WeakPolarHBondContact O-CB 3.37Å; R83-E86 PolarHBondContact O-N 3.34Å; R83-R87 WeakPolarHBondContact O-CG 3.42Å; R83-R87 PolarHBondContact O-N 2.94Å
84	L	98.8	Very high	98.2	Very high	6 Å²	6	51.3 Å²	51.3	3%	0.031	26%	0.256	C	S	.	.	H	α-helix	trans	-60.6	-44.6	178.3	-178.4	59.8	0	0	0	111.2	V59 V63 V69 A80 V81 R87 V88 I95 L113	V59-L84 HydrophobicContact CG1-CB 4.33Å; V59-L84 HydrophobicContact CG1-CD1 4.45Å; V63-L84 HydrophobicContact CG1-CD1 3.82Å; V69-L84 HydrophobicContact CG1-CD2 4.47Å; A80-L84 VanDerWaalsContact O-CB 3.3Å; A80-L84 WeakPolarHBondContact O-CB 3.36Å; A80-L84 PolarHBondContact O-N 2.95Å; V81-L84 PolarHBondContact O-N 2.99Å; L84-R87 PolarHBondContact O-N 3.44Å; L84-V88 HydrophobicContact CD1-CG2 4.49Å; L84-V88 WeakPolarHBondContact O-CG2 3.37Å; L84-V88 PolarHBondContact O-N 2.88Å; L84-I95 HydrophobicContact CD1-CG1 4.34Å; L84-I95 HydrophobicContact CD1-CG2 4.38Å; L84-I95 HydrophobicContact CD2-CG2 4.37Å; L84-L113 HydrophobicContact CB-CD1 4.47Å; L84-L113 HydrophobicContact CD2-CD1 4.01Å; L84-L113 HydrophobicContact CG-CD1 4.19Å; L84-L113 HydrophobicContact CG-CD2 4.32Å
85	A	98.7	Very high	98.3	Very high	18 Å²	18	50.4 Å²	50.4	15%	0.149	24%	0.244	C	C	.	.	H	α-helix	trans	-63.7	-40.2	176.4	0	0	0	0	0	112.3	V81 D82 R83 R89 H111 L113	V81-A85 WeakPolarHBondContact O-CB 3.44Å; V81-A85 PolarHBondContact O-N 3.33Å; D82-A85 PolarHBondContact O-N 2.72Å; R83-A85 VanDerWaalsContact C-N 3.33Å; R83-A85 PolarHBondContact O-N 3.01Å; A85-R89 WeakPolarHBondContact O-CB 3.21Å; A85-R89 PolarHBondContact O-N 2.96Å; A85-R89 VanDerWaalsContact O-N 3.09Å; A85-H111 HydrophobicContact CB-CB 3.84Å; A85-L113 HydrophobicContact CB-CD1 4.4Å; A85-L113 HydrophobicContact CB-CD2 4.29Å; A85-L113 HydrophobicContact CB-CG 4.29Å
86	E	98.7	Very high	98.4	Very high	48 Å²	48	49 Å²	49	22%	0.224	23%	0.233	C	C	.	.	H	α-helix	trans	-57	-51	173	-173.4	-173.3	-179	0	0	111.3	D82 R83 R89 Q90	D82-E86 PolarHBondContact O-N 3.38Å; R83-E86 IonicContact CZ-OE2 2.83Å; R83-E86 IonicContact NH1-OE1 3.84Å; R83-E86 PolarHBondContact NH1-OE1 3.12Å; R83-E86 IonicContact NH1-OE2 3.36Å; R83-E86 PolarHBondContact NH1-OE2 3.43Å; R83-E86 WeakPolarHBondContact O-CB 3.37Å; R83-E86 PolarHBondContact O-N 3.34Å; E86-R89 PolarHBondContact O-N 2.86Å; E86-Q90 HydrophobicContact CG-CG 4.4Å; E86-Q90 VanDerWaalsContact CG-NE2 3.26Å; E86-Q90 WeakPolarHBondContact O-CB 3.42Å; E86-Q90 WeakPolarHBondContact O-CG 3.43Å; E86-Q90 PolarHBondContact O-N 3.3Å; E86-Q90 PolarHBondContact OE1-NE2 2.92Å
87	R	98.6	Very high	98.5	Very high	22 Å²	22	48.2 Å²	48.2	8%	0.083	23%	0.229	C	C	.	.	H	α-helix	trans	-63.9	-44.8	179.9	-68.8	-171.5	67.2	-156	-8.9	112.5	V59 D60 V63 R83 L84 R89 Q90 E91 L93	V59-R87 PolarHBondContact O-NH1 3.37Å; D60-R87 WeakPolarHBondContact OD1-CD 3.43Å; V63-R87 PolarHBondContact O-NH1 2.93Å; V63-R87 PolarHBondContact O-NH2 2.77Å; R83-R87 WeakPolarHBondContact O-CG 3.42Å; R83-R87 PolarHBondContact O-N 2.94Å; L84-R87 PolarHBondContact O-N 3.44Å; R87-R89 VanDerWaalsContact C-N 3.26Å; R87-R89 PolarHBondContact O-N 3.43Å; R87-Q90 PolarHBondContact O-N 2.91Å; R87-E91 WeakPolarHBondContact CG-OE1 3.36Å; R87-E91 IonicContact CZ-OE1 3.56Å; R87-E91 IonicContact CZ-OE2 2.7Å; R87-E91 IonicContact NE-OE1 3.4Å; R87-E91 PolarHBondContact NE-OE1 3.46Å; R87-E91 IonicContact NE-OE2 3.62Å; R87-E91 PolarHBondContact NE-OE2 3.32Å; R87-E91 IonicContact NH2-OE1 2.84Å; R87-E91 IonicContact NH2-OE2 2.85Å; R87-E91 PolarHBondContact NH2-OE2 3.11Å; R87-E91 WeakPolarHBondContact O-CA 3.38Å; R87-E91 VanDerWaalsContact O-CB 3.3Å; R87-E91 WeakPolarHBondContact O-CB 3.34Å; R87-E91 PolarHBondContact O-N 2.83Å; R87-L93 HydrophobicContact CB-CD1 3.87Å
88	V	98.4	Very high	98.5	Very high	38 Å²	38	48.3 Å²	48.3	23%	0.23	23%	0.229	C	C	.	.	H	α-helix	trans	-54.9	-44.1	175	165.7	0	0	0	0	111	L84 K92 L93 I95 L113	L84-V88 HydrophobicContact CD1-CG2 4.49Å; L84-V88 WeakPolarHBondContact O-CG2 3.37Å; L84-V88 PolarHBondContact O-N 2.88Å; V88-K92 WeakPolarHBondContact O-CA 3.4Å; V88-K92 PolarHBondContact O-N 3.36Å; V88-K92 VanDerWaalsContact O-N 3.08Å; V88-L93 HydrophobicContact CG2-CB 4.1Å; V88-L93 PolarHBondContact O-N 3.33Å; V88-I95 HydrophobicContact CG2-CB 4.24Å; V88-I95 HydrophobicContact CG2-CG1 4.01Å; V88-L113 HydrophobicContact CB-CD2 4.18Å; V88-L113 HydrophobicContact CG1-CD2 4.42Å; V88-L113 HydrophobicContact CG2-CD2 3.8Å
89	R	98.3	Very high	98.5	Very high	167 Å²	167	47.4 Å²	47.4	63%	0.63	22%	0.224	S	C	*	.	H	α-helix	trans	-69.7	-44.3	-179.8	180	-178.9	57.6	-179.5	-5.1	113	A85 E86 R87 K92	A85-R89 WeakPolarHBondContact O-CB 3.21Å; A85-R89 PolarHBondContact O-N 2.96Å; A85-R89 VanDerWaalsContact O-N 3.09Å; E86-R89 PolarHBondContact O-N 2.86Å; R87-R89 VanDerWaalsContact C-N 3.26Å; R87-R89 PolarHBondContact O-N 3.43Å; R89-K92 PolarHBondContact O-NZ 3.32Å
90	Q	98.3	Very high	98.5	Very high	110 Å²	110	45.3 Å²	45.3	51%	0.514	22%	0.216	S	C	.	.	H	α-helix	trans	-79.2	-49.1	-174.1	-71.6	174.3	-0.3	0	0	112.2	E86 R87	E86-Q90 HydrophobicContact CG-CG 4.4Å; E86-Q90 VanDerWaalsContact CG-NE2 3.26Å; E86-Q90 WeakPolarHBondContact O-CB 3.42Å; E86-Q90 WeakPolarHBondContact O-CG 3.43Å; E86-Q90 PolarHBondContact O-N 3.3Å; E86-Q90 PolarHBondContact OE1-NE2 2.92Å; R87-Q90 PolarHBondContact O-N 2.91Å
91	E	98.1	Very high	98.5	Very high	95 Å²	95	45.2 Å²	45.2	44%	0.444	22%	0.215	S	C	.	.	H	α-helix	trans	-91.3	-7.4	-175	-59.6	169.4	-141.8	0	0	112.9	R87 L93	R87-E91 WeakPolarHBondContact CG-OE1 3.36Å; R87-E91 IonicContact CZ-OE1 3.56Å; R87-E91 IonicContact CZ-OE2 2.7Å; R87-E91 IonicContact NE-OE1 3.4Å; R87-E91 PolarHBondContact NE-OE1 3.46Å; R87-E91 IonicContact NE-OE2 3.62Å; R87-E91 PolarHBondContact NE-OE2 3.32Å; R87-E91 IonicContact NH2-OE1 2.84Å; R87-E91 IonicContact NH2-OE2 2.85Å; R87-E91 PolarHBondContact NH2-OE2 3.11Å; R87-E91 WeakPolarHBondContact O-CA 3.38Å; R87-E91 VanDerWaalsContact O-CB 3.3Å; R87-E91 WeakPolarHBondContact O-CB 3.34Å; R87-E91 PolarHBondContact O-N 2.83Å; E91-L93 VanDerWaalsContact C-N 3.32Å; E91-L93 HydrophobicContact CB-CD2 3.87Å; E91-L93 HydrophobicContact CB-CG 3.93Å; E91-L93 PolarHBondContact O-N 3.07Å
92	K	97.8	Very high	98.5	Very high	157 Å²	157	51 Å²	51	68%	0.683	24%	0.241	S	C	*	.			trans	60.1	39.2	-175.4	-51.7	-56	-177.3	-161.4	0	113	V88 R89	V88-K92 WeakPolarHBondContact O-CA 3.4Å; V88-K92 PolarHBondContact O-N 3.36Å; V88-K92 VanDerWaalsContact O-N 3.08Å; R89-K92 PolarHBondContact O-NZ 3.32Å
93	L	98.2	Very high	98.5	Very high	17 Å²	17	52.8 Å²	52.8	9%	0.089	25%	0.247	C	C	.	.			trans	-65.7	135	175.6	-51.7	-179.1	0	0	0	110.8	N65 R87 V88 E91 I95	N65-L93 HydrophobicContact CB-CD2 3.86Å; N65-L93 WeakPolarHBondContact OD1-CA 3.47Å; R87-L93 HydrophobicContact CB-CD1 3.87Å; V88-L93 HydrophobicContact CG2-CB 4.1Å; V88-L93 PolarHBondContact O-N 3.33Å; E91-L93 VanDerWaalsContact C-N 3.32Å; E91-L93 HydrophobicContact CB-CD2 3.87Å; E91-L93 HydrophobicContact CB-CG 3.93Å; E91-L93 PolarHBondContact O-N 3.07Å; L93-I95 HydrophobicContact CB-CD1 4.3Å; L93-I95 HydrophobicContact CB-CG1 3.8Å
94	N	98	Very high	98.5	Very high	101 Å²	101	50.7 Å²	50.7	54%	0.54	24%	0.239	S	C	.	.			trans	-92.3	97.2	168.3	179.2	38.2	0	0	0	108.3	N65 N66	N65-N94 PolarHBondContact OD1-N 3.31Å; N66-N94 WeakPolarHBondContact CA-O 3.42Å; N66-N94 PolarHBondContact N-O 3.35Å; N66-N94 WeakPolarHBondContact OD1-CB 3.4Å; N66-N94 PolarHBondContact OD1-ND2 2.84Å
95	I	98.4	Very high	98.5	Very high	8 Å²	8	54.9 Å²	54.9	4%	0.041	26%	0.255	C	S	.	.			trans	-123.1	139.7	-177.2	-58.3	-64.6	0	0	0	109.3	V63 Q64 Q67 V69 L84 V88 L93 A114	V63-I95 HydrophobicContact CG1-CD1 3.8Å; V63-I95 HydrophobicContact CG1-CG1 4.45Å; Q64-I95 WeakPolarHBondContact O-CD1 3.28Å; Q67-I95 HydrophobicContact CB-CD1 4.15Å; Q67-I95 WeakPolarHBondContact O-CA 3.29Å; V69-I95 HydrophobicContact CB-CG2 4.11Å; V69-I95 HydrophobicContact CG2-CG2 3.58Å; L84-I95 HydrophobicContact CD1-CG1 4.34Å; L84-I95 HydrophobicContact CD1-CG2 4.38Å; L84-I95 HydrophobicContact CD2-CG2 4.37Å; V88-I95 HydrophobicContact CG2-CB 4.24Å; V88-I95 HydrophobicContact CG2-CG1 4.01Å; L93-I95 HydrophobicContact CB-CD1 4.3Å; L93-I95 HydrophobicContact CB-CG1 3.8Å; I95-A114 WeakPolarHBondContact O-CB 3.18Å
96	V	98.6	Very high	98.5	Very high	31 Å²	31	56.7 Å²	56.7	19%	0.188	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	132.1	169.4	179.8	0	0	0	0	109.1	Q67 V68 V69	Q67-V96 PolarHBondContact O-N 2.87Å; Q67-V96 VanDerWaalsContact O-N 3.15Å; V68-V96 CarbonylContact C-O 3.57Å; V68-V96 WeakPolarHBondContact CA-O 3.5Å; V68-V96 HydrophobicContact CG1-CB 4.48Å; V68-V96 HydrophobicContact CG2-CB 4.49Å; V69-V96 PolarHBondContact N-O 3.09Å
97	C	98.9	Very high	98.4	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	132.2	-177.2	-61.7	0	0	0	0	111.4	V69 V71 I108 A114 S116	V69-C97 CarbonylContact O-C 3.57Å; V69-C97 VanDerWaalsContact O-CA 3.31Å; V69-C97 WeakPolarHBondContact O-CA 3.31Å; V71-C97 HydrophobicContact CG2-CB 3.81Å; C97-I108 HydrophobicContact CB-CD1 3.6Å; C97-I108 HydrophobicContact CB-CG1 3.84Å; C97-I108 HydrophobicContact CB-CG2 3.82Å; C97-A114 WeakPolarHBondContact CB-O 3.3Å; C97-A114 PolarHBondContact N-O 2.82Å; C97-S116 PolarHBondContact O-N 3.01Å
98	V	98.9	Very high	98.4	Very high	3 Å²	3	54.2 Å²	54.2	2%	0.018	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	117.6	175	-176.1	0	0	0	0	109	V68 V69 G70 V71 L118 L124 I154	V68-V98 HydrophobicContact CG1-CG2 3.81Å; V69-V98 PolarHBondContact O-N 3.43Å; G70-V98 CarbonylContact C-O 3.47Å; G70-V98 WeakPolarHBondContact CA-O 3.24Å; V71-V98 PolarHBondContact N-O 3.44Å; V98-L118 HydrophobicContact CG1-CG 4.36Å; V98-L124 HydrophobicContact CB-CD2 3.87Å; V98-L124 HydrophobicContact CG2-CD2 4.08Å; V98-I154 HydrophobicContact CB-CD1 4.28Å; V98-I154 HydrophobicContact CG1-CD1 3.4Å; V98-I154 VanDerWaalsContact CG1-CD1 3.4Å
99	P	98.8	Very high	98.5	Very high	26 Å²	26	55.9 Å²	55.9	17%	0.169	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	152.6	-172	31.9	-35.1	0	0	0	113.4	A104 R105 I108 L115 S116	P99-A104 HydrophobicContact CB-CB 3.78Å; P99-R105 HydrophobicContact CB-CB 3.9Å; P99-R105 HydrophobicContact CG-CB 3.94Å; P99-R105 HydrophobicContact CG-CG 4.28Å; P99-I108 HydrophobicContact CB-CD1 3.91Å; P99-I108 HydrophobicContact CG-CD1 4.49Å; P99-L115 HydrophobicContact CG-CD1 3.96Å; P99-S116 WeakPolarHBondContact CD-O 3.32Å
100	T	98.7	Very high	98.5	Very high	3 Å²	3	54.5 Å²	54.5	2%	0.018	26%	0.258	C	S	.	.	S	Bend	trans	-99.9	3.2	172.1	71.2	0	0	0	0	114.4	V71 G72 S73 Q150 I154	V71-T100 VanDerWaalsContact O-CG2 3.26Å; V71-T100 WeakPolarHBondContact O-CG2 3.4Å; V71-T100 PolarHBondContact O-N 3.37Å; V71-T100 PolarHBondContact O-OG1 3.29Å; G72-T100 VanDerWaalsContact CA-OG1 3.28Å; G72-T100 WeakPolarHBondContact CA-OG1 3.25Å; S73-T100 PolarHBondContact N-OG1 3.05Å; S73-T100 PolarHBondContact OG-OG1 3.49Å; T100-Q150 WeakPolarHBondContact O-CB 3.4Å; T100-Q150 PolarHBondContact O-OE1 3.19Å; T100-I154 HydrophobicContact CG2-CB 3.65Å; T100-I154 HydrophobicContact CG2-CG1 3.75Å; T100-I154 HydrophobicContact CG2-CG2 3.8Å
101	S	98.5	Very high	98.5	Very high	4 Å²	4	52.5 Å²	52.5	3%	0.028	25%	0.249	C	C	.	.	S	Bend	trans	-166.6	174.1	175.9	67.8	0	0	0	0	111.8	S73 Q103 A104 R105 C147	S73-S101 WeakPolarHBondContact OG-CB 3.48Å; S73-S101 PolarHBondContact OG-OG 2.75Å; S101-Q103 VanDerWaalsContact C-N 3.3Å; S101-Q103 PolarHBondContact O-N 2.59Å; S101-Q103 PolarHBondContact OG-N 2.71Å; S101-A104 PolarHBondContact O-N 2.71Å; S101-A104 PolarHBondContact OG-N 2.85Å; S101-A104 VanDerWaalsContact OG-N 3.08Å; S101-R105 WeakPolarHBondContact O-CB 3.35Å; S101-R105 PolarHBondContact O-N 2.9Å; S101-C147 WeakPolarHBondContact CB-SG 3.22Å
102	F	98.1	Very high	98.5	Very high	125 Å²	125	51.3 Å²	51.3	55%	0.548	26%	0.262	S	S	.	.	H	α-helix	trans	-60.9	-36.8	167.8	-169.8	-98.2	0	0	0	113.1	R105 Q106 D221	F102-R105 WeakPolarHBondContact O-CB 3.39Å; F102-R105 PolarHBondContact O-N 3.43Å; F102-Q106 HydrophobicContact CD1-CG 4Å; F102-Q106 HydrophobicContact CE1-CG 3.63Å; F102-Q106 HydrophobicContact CZ-CG 4.03Å; F102-Q106 WeakPolarHBondContact O-CG 3.31Å; F102-Q106 PolarHBondContact O-N 3.41Å; F102-D221 PolarHBondContact N-OD2 3.05Å; F102-D221 VanDerWaalsContact N-OD2 3.16Å
103	Q	98.4	Very high	98.5	Very high	85 Å²	85	44.4 Å²	44.4	40%	0.397	23%	0.232	S	C	.	.	H	α-helix	trans	-60.9	-50.4	177.1	-175.7	-161	17.3	0	0	110.7	S101 R105 Q106 L107	S101-Q103 VanDerWaalsContact C-N 3.3Å; S101-Q103 PolarHBondContact O-N 2.59Å; S101-Q103 PolarHBondContact OG-N 2.71Å; Q103-R105 VanDerWaalsContact C-N 3.29Å; Q103-R105 PolarHBondContact O-N 3.46Å; Q103-Q106 PolarHBondContact O-N 2.86Å; Q103-Q106 VanDerWaalsContact O-N 3.17Å; Q103-L107 HydrophobicContact CG-CD1 4.27Å; Q103-L107 WeakPolarHBondContact O-CG 3.21Å; Q103-L107 PolarHBondContact O-N 3.46Å
104	A	98.6	Very high	98.5	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-57.9	-44.7	178.6	0	0	0	0	0	111.1	V71 G72 P99 S101 Q106 L107 I108	V71-A104 HydrophobicContact CG1-CB 4.36Å; G72-A104 WeakPolarHBondContact O-CB 3.47Å; P99-A104 HydrophobicContact CB-CB 3.78Å; S101-A104 PolarHBondContact O-N 2.71Å; S101-A104 PolarHBondContact OG-N 2.85Å; S101-A104 VanDerWaalsContact OG-N 3.08Å; A104-Q106 VanDerWaalsContact C-N 3.33Å; A104-Q106 PolarHBondContact O-N 3.03Å; A104-L107 PolarHBondContact O-N 3.29Å; A104-I108 VanDerWaalsContact O-CG1 3.31Å; A104-I108 WeakPolarHBondContact O-CG1 3.44Å; A104-I108 PolarHBondContact O-N 2.97Å
105	R	98.8	Very high	98.6	Very high	94 Å²	94	44 Å²	44	36%	0.355	24%	0.238	S	C	.	.	H	α-helix	trans	-57	-44.8	176.5	-172.4	-170.7	173.6	-69.5	-6.7	112	P99 S101 F102 Q103 L109 L115	P99-R105 HydrophobicContact CB-CB 3.9Å; P99-R105 HydrophobicContact CG-CB 3.94Å; P99-R105 HydrophobicContact CG-CG 4.28Å; S101-R105 WeakPolarHBondContact O-CB 3.35Å; S101-R105 PolarHBondContact O-N 2.9Å; F102-R105 WeakPolarHBondContact O-CB 3.39Å; F102-R105 PolarHBondContact O-N 3.43Å; Q103-R105 VanDerWaalsContact C-N 3.29Å; Q103-R105 PolarHBondContact O-N 3.46Å; R105-L109 WeakPolarHBondContact O-CG 3.26Å; R105-L109 PolarHBondContact O-N 3.25Å; R105-L115 HydrophobicContact CG-CD1 4.09Å; R105-L115 HydrophobicContact CG-CD2 3.83Å
106	Q	98.6	Very high	98.6	Very high	57 Å²	57	44.2 Å²	44.2	27%	0.266	24%	0.239	S	C	.	.	H	α-helix	trans	-67.1	-41.6	178.5	-67.4	-57.6	-33.3	0	0	111.8	F102 Q103 A104 I108 L109 Q110	F102-Q106 HydrophobicContact CD1-CG 4Å; F102-Q106 HydrophobicContact CE1-CG 3.63Å; F102-Q106 HydrophobicContact CZ-CG 4.03Å; F102-Q106 WeakPolarHBondContact O-CG 3.31Å; F102-Q106 PolarHBondContact O-N 3.41Å; Q103-Q106 PolarHBondContact O-N 2.86Å; Q103-Q106 VanDerWaalsContact O-N 3.17Å; A104-Q106 VanDerWaalsContact C-N 3.33Å; A104-Q106 PolarHBondContact O-N 3.03Å; Q106-I108 PolarHBondContact O-N 3.07Å; Q106-L109 PolarHBondContact O-N 2.86Å; Q106-Q110 WeakPolarHBondContact O-CB 3.08Å; Q106-Q110 WeakPolarHBondContact O-CG 3.43Å; Q106-Q110 PolarHBondContact O-N 2.95Å
107	L	98.4	Very high	98.6	Very high	17 Å²	17	44.9 Å²	44.9	9%	0.089	24%	0.242	C	C	.	.	H	α-helix	trans	-58.9	-45.3	176.8	-73.5	169.2	0	0	0	111.9	V78 V81 Q103 A104 L109 Q110 H111	V78-L107 HydrophobicContact CG1-CD2 4.47Å; V78-L107 HydrophobicContact CG2-CD1 4.03Å; V78-L107 HydrophobicContact CG2-CD2 4.18Å; V81-L107 HydrophobicContact CG1-CB 4.3Å; V81-L107 HydrophobicContact CG2-CB 4.31Å; Q103-L107 HydrophobicContact CG-CD1 4.27Å; Q103-L107 WeakPolarHBondContact O-CG 3.21Å; Q103-L107 PolarHBondContact O-N 3.46Å; A104-L107 PolarHBondContact O-N 3.29Å; L107-L109 PolarHBondContact O-N 3.27Å; L107-Q110 PolarHBondContact O-N 2.9Å; L107-H111 PolarHBondContact O-N 3.44Å; L107-H111 PolarHBondContact O-ND1 3.39Å
108	I	98.8	Very high	98.5	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-56.6	-50.9	176.2	-67.8	162.9	0	0	0	110.6	V71 C97 P99 A104 Q106 H111 G112 L113 L115	V71-I108 HydrophobicContact CB-CD1 3.96Å; V71-I108 HydrophobicContact CB-CG1 4.31Å; V71-I108 HydrophobicContact CG1-CD1 4.34Å; V71-I108 HydrophobicContact CG1-CG1 4.24Å; V71-I108 HydrophobicContact CG2-CD1 3.96Å; V71-I108 HydrophobicContact CG2-CG1 4.12Å; C97-I108 HydrophobicContact CB-CD1 3.6Å; C97-I108 HydrophobicContact CB-CG1 3.84Å; C97-I108 HydrophobicContact CB-CG2 3.82Å; P99-I108 HydrophobicContact CB-CD1 3.91Å; P99-I108 HydrophobicContact CG-CD1 4.49Å; A104-I108 VanDerWaalsContact O-CG1 3.31Å; A104-I108 WeakPolarHBondContact O-CG1 3.44Å; A104-I108 PolarHBondContact O-N 2.97Å; Q106-I108 PolarHBondContact O-N 3.07Å; I108-H111 PolarHBondContact O-N 3.02Å; I108-G112 PolarHBondContact O-N 3.03Å; I108-L113 HydrophobicContact CG2-CB 3.78Å; I108-L113 PolarHBondContact O-N 2.96Å; I108-L113 VanDerWaalsContact O-N 3.11Å; I108-L115 HydrophobicContact CB-CD1 4.36Å; I108-L115 HydrophobicContact CD1-CD1 3.84Å; I108-L115 HydrophobicContact CG2-CB 4.03Å; I108-L115 HydrophobicContact CG2-CD1 3.96Å
109	L	98.6	Very high	98.5	Very high	73 Å²	73	55.9 Å²	55.9	38%	0.382	30%	0.295	S	S	.	.	H	α-helix	trans	-65.5	-42.4	-177.3	-70.8	176.9	0	0	0	112.7	R105 Q106 L107 H111 G112 L115	R105-L109 WeakPolarHBondContact O-CG 3.26Å; R105-L109 PolarHBondContact O-N 3.25Å; Q106-L109 PolarHBondContact O-N 2.86Å; L107-L109 PolarHBondContact O-N 3.27Å; L109-H111 PolarHBondContact O-N 3.04Å; L109-G112 PolarHBondContact O-N 3.45Å; L109-L115 HydrophobicContact CD1-CD2 4.27Å; L109-L115 HydrophobicContact CD2-CB 4.12Å; L109-L115 HydrophobicContact CD2-CD2 3.88Å; L109-L115 HydrophobicContact CG-CD2 4.1Å
110	Q	98.4	Very high	98.5	Very high	139 Å²	139	62.8 Å²	62.8	65%	0.65	32%	0.317	S	S	*	.	H	α-helix	trans	-62.3	-29.6	179.4	-74	171.2	-3.8	0	0	112.3	Q106 L107	Q106-Q110 WeakPolarHBondContact O-CB 3.08Å; Q106-Q110 WeakPolarHBondContact O-CG 3.43Å; Q106-Q110 PolarHBondContact O-N 2.95Å; L107-Q110 PolarHBondContact O-N 2.9Å
111	H	98.6	Very high	98.5	Very high	68 Å²	68	65.3 Å²	65.3	32%	0.315	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	1.4	176.9	-73.4	88.8	0	0	0	114.3	V81 D82 A85 L107 I108 L109 L113	V81-H111 HydrophobicContact CG1-CB 4.03Å; V81-H111 WeakPolarHBondContact CG1-ND1 3.48Å; D82-H111 IonicContact OD1-CD2 3.09Å; D82-H111 IonicContact OD1-CE1 2.71Å; D82-H111 PolarHBondContact OD1-CE1 2.99Å; D82-H111 VanDerWaalsContact OD1-CE1 3.24Å; D82-H111 IonicContact OD1-NE2 2.72Å; D82-H111 PolarHBondContact OD1-NE2 2.91Å; A85-H111 HydrophobicContact CB-CB 3.84Å; L107-H111 PolarHBondContact O-N 3.44Å; L107-H111 PolarHBondContact O-ND1 3.39Å; I108-H111 PolarHBondContact O-N 3.02Å; L109-H111 PolarHBondContact O-N 3.04Å; H111-L113 HydrophobicContact CB-CD1 4.32Å; H111-L113 HydrophobicContact CB-CG 4.25Å; H111-L113 PolarHBondContact O-N 2.8Å
112	G	98.3	Very high	98.4	Very high	70 Å²	70	68.9 Å²	68.9	72%	0.722	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.1	23.3	-179.4	0	0	0	0	0	114	I108 L109	I108-G112 PolarHBondContact O-N 3.03Å; L109-G112 PolarHBondContact O-N 3.45Å
113	L	98.6	Very high	98.5	Very high	11 Å²	11	69.7 Å²	69.7	6%	0.058	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-79.7	149	175.2	-69.3	172.1	0	0	0	110.6	V81 L84 A85 V88 I108 H111 L115	V81-L113 HydrophobicContact CG1-CD1 3.86Å; L84-L113 HydrophobicContact CB-CD1 4.47Å; L84-L113 HydrophobicContact CD2-CD1 4.01Å; L84-L113 HydrophobicContact CG-CD1 4.19Å; L84-L113 HydrophobicContact CG-CD2 4.32Å; A85-L113 HydrophobicContact CB-CD1 4.4Å; A85-L113 HydrophobicContact CB-CD2 4.29Å; A85-L113 HydrophobicContact CB-CG 4.29Å; V88-L113 HydrophobicContact CB-CD2 4.18Å; V88-L113 HydrophobicContact CG1-CD2 4.42Å; V88-L113 HydrophobicContact CG2-CD2 3.8Å; I108-L113 HydrophobicContact CG2-CB 3.78Å; I108-L113 PolarHBondContact O-N 2.96Å; I108-L113 VanDerWaalsContact O-N 3.11Å; H111-L113 HydrophobicContact CB-CD1 4.32Å; H111-L113 HydrophobicContact CB-CG 4.25Å; H111-L113 PolarHBondContact O-N 2.8Å; L113-L115 PolarHBondContact O-N 3.47Å
114	A	98.6	Very high	98.5	Very high	54 Å²	54	65.6 Å²	65.6	45%	0.446	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	119.4	178.7	0	0	0	0	0	110.5	I95 C97	I95-A114 WeakPolarHBondContact O-CB 3.18Å; C97-A114 WeakPolarHBondContact CB-O 3.3Å; C97-A114 PolarHBondContact N-O 2.82Å
115	L	98.8	Very high	98.5	Very high	57 Å²	57	67.4 Å²	67.4	30%	0.298	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	139.3	-179.7	-179.6	69.6	0	0	0	111.2	P99 R105 I108 L109 L113	P99-L115 HydrophobicContact CG-CD1 3.96Å; R105-L115 HydrophobicContact CG-CD1 4.09Å; R105-L115 HydrophobicContact CG-CD2 3.83Å; I108-L115 HydrophobicContact CB-CD1 4.36Å; I108-L115 HydrophobicContact CD1-CD1 3.84Å; I108-L115 HydrophobicContact CG2-CB 4.03Å; I108-L115 HydrophobicContact CG2-CD1 3.96Å; L109-L115 HydrophobicContact CD1-CD2 4.27Å; L109-L115 HydrophobicContact CD2-CB 4.12Å; L109-L115 HydrophobicContact CD2-CD2 3.88Å; L109-L115 HydrophobicContact CG-CD2 4.1Å; L113-L115 PolarHBondContact O-N 3.47Å
116	S	98.5	Very high	98.5	Very high	11 Å²	11	63 Å²	63	8%	0.077	33%	0.332	C	S	.	.			trans	-145.3	-167.5	170	-153.9	0	0	0	0	112.1	C97 P99 H121	C97-S116 PolarHBondContact O-N 3.01Å; P99-S116 WeakPolarHBondContact CD-O 3.32Å; S116-H121 WeakPolarHBondContact CB-ND1 3.47Å; S116-H121 PolarHBondContact OG-CE1 3.17Å; S116-H121 VanDerWaalsContact OG-CE1 3.23Å; S116-H121 PolarHBondContact OG-ND1 3.24Å
117	D	98.6	Very high	98.5	Very high	46 Å²	46	60.5 Å²	60.5	25%	0.246	32%	0.32	C	S	.	.			trans	-144.1	171.5	-176.8	51.3	47.7	0	0	0	110.7	E119 R120 H121	D117-E119 VanDerWaalsContact C-N 3.26Å; D117-E119 PolarHBondContact O-N 3.27Å; D117-E119 PolarHBondContact OD1-N 2.98Å; D117-R120 PolarHBondContact O-N 3.06Å; D117-R120 WeakPolarHBondContact OD1-CG 3.37Å; D117-R120 PolarHBondContact OD1-N 3.19Å; D117-R120 IonicContact OD1-NH1 3.24Å; D117-R120 IonicContact OD2-CZ 3.44Å; D117-R120 IonicContact OD2-NH1 2.91Å; D117-R120 PolarHBondContact OD2-NH1 2.86Å; D117-H121 PolarHBondContact O-N 2.87Å
118	L	98.1	Very high	98.5	Very high	49 Å²	49	60 Å²	60	26%	0.257	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-19.5	177.6	-75.3	177.8	0	0	0	113.9	V98 R120 H121 P122 L124 I153 I154 N157	V98-L118 HydrophobicContact CG1-CG 4.36Å; L118-R120 VanDerWaalsContact C-N 3.31Å; L118-H121 WeakPolarHBondContact CD2-O 3.07Å; L118-H121 CarbonylContact O-C 3.59Å; L118-P122 VanDerWaalsContact O-CA 3.29Å; L118-P122 WeakPolarHBondContact O-CA 3.34Å; L118-L124 HydrophobicContact CD2-CD1 3.41Å; L118-L124 VanDerWaalsContact CD2-CD1 3.41Å; L118-I153 HydrophobicContact CD1-CG2 3.4Å; L118-I153 VanDerWaalsContact CD1-CG2 3.4Å; L118-I154 HydrophobicContact CD1-CD1 3.77Å; L118-I154 HydrophobicContact CD2-CD1 3.89Å; L118-I154 HydrophobicContact CG-CD1 3.73Å; L118-N157 HydrophobicContact CD2-CB 4.31Å
119	E	98	Very high	98.5	Very high	185 Å²	185	60.2 Å²	60.2	86%	0.864	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-36.3	175.5	-65.7	179.4	-123.6	0	0	110.8	D117	D117-E119 VanDerWaalsContact C-N 3.26Å; D117-E119 PolarHBondContact O-N 3.27Å; D117-E119 PolarHBondContact OD1-N 2.98Å
120	R	98.4	Very high	98.5	Very high	171 Å²	171	57.2 Å²	57.2	65%	0.645	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-33.7	175.5	-63.9	-175.2	-169.9	97.6	10.2	113.3	D117 L118	D117-R120 PolarHBondContact O-N 3.06Å; D117-R120 WeakPolarHBondContact OD1-CG 3.37Å; D117-R120 PolarHBondContact OD1-N 3.19Å; D117-R120 IonicContact OD1-NH1 3.24Å; D117-R120 IonicContact OD2-CZ 3.44Å; D117-R120 IonicContact OD2-NH1 2.91Å; D117-R120 PolarHBondContact OD2-NH1 2.86Å; L118-R120 VanDerWaalsContact C-N 3.31Å
121	H	98.4	Very high	98.5	Very high	55 Å²	55	51.2 Å²	51.2	26%	0.255	28%	0.28	S	S	.	.			trans	-130.9	80.3	-178	-58.4	93.4	0	0	0	110.5	V68 S116 D117 L118 E123	V68-H121 HydrophobicContact CG1-CB 3.84Å; V68-H121 HydrophobicContact CG2-CB 4.36Å; S116-H121 WeakPolarHBondContact CB-ND1 3.47Å; S116-H121 PolarHBondContact OG-CE1 3.17Å; S116-H121 VanDerWaalsContact OG-CE1 3.23Å; S116-H121 PolarHBondContact OG-ND1 3.24Å; D117-H121 PolarHBondContact O-N 2.87Å; L118-H121 WeakPolarHBondContact CD2-O 3.07Å; L118-H121 CarbonylContact O-C 3.59Å; H121-E123 PolarHBondContact O-N 3.37Å
122	P	98	Very high	98.5	Very high	79 Å²	79	49.3 Å²	49.3	51%	0.513	27%	0.272	S	S	.	.	S	Bend	trans	-69.9	-19.5	-176.2	27.8	-35.7	0	0	0	113.5	L118 N157	L118-P122 VanDerWaalsContact O-CA 3.29Å; L118-P122 WeakPolarHBondContact O-CA 3.34Å; P122-N157 WeakPolarHBondContact O-CB 3.39Å
123	E	98.3	Very high	98.5	Very high	142 Å²	142	46 Å²	46	66%	0.664	24%	0.237	S	C	*	.	S	Bend	trans	-122.1	132.2	176.2	-64.9	-179.7	-171.3	0	0	109.8	H121	H121-E123 PolarHBondContact O-N 3.37Å
124	L	98.7	Very high	98.5	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.235	C	C	.	.	B	Isolated β-bridge	trans	-113.1	151.6	-178.3	-65.6	80.2	0	0	0	110.4	V68 G70 V98 L118 I154 N157 S158 K159	V68-L124 HydrophobicContact CG1-CB 4.49Å; V68-L124 HydrophobicContact CG1-CD2 4.32Å; V68-L124 HydrophobicContact CG1-CG 3.91Å; G70-L124 VanDerWaalsContact CA-CD2 3.45Å; G70-L124 VanDerWaalsContact N-CD2 3.35Å; V98-L124 HydrophobicContact CB-CD2 3.87Å; V98-L124 HydrophobicContact CG2-CD2 4.08Å; L118-L124 HydrophobicContact CD2-CD1 3.41Å; L118-L124 VanDerWaalsContact CD2-CD1 3.41Å; L124-I154 HydrophobicContact CD2-CG2 4.03Å; L124-N157 HydrophobicContact CD1-CB 4.25Å; L124-N157 PolarHBondContact N-O 2.85Å; L124-S158 CarbonylContact O-C 3.57Å; L124-S158 WeakPolarHBondContact O-CA 3.43Å; L124-K159 WeakPolarHBondContact O-CG 3.28Å; L124-K159 PolarHBondContact O-N 2.91Å
125	D	98.8	Very high	98.4	Very high	38 Å²	38	43 Å²	43	20%	0.203	21%	0.214	C	C	.	.	S	Bend	trans	-82	-39.7	179.6	-60.6	-65.7	0	0	0	111.8	Q67 V68 K159 C160	Q67-D125 VanDerWaalsContact CA-OD2 3.28Å; Q67-D125 WeakPolarHBondContact CA-OD2 3.33Å; Q67-D125 HydrophobicContact CB-CB 3.95Å; Q67-D125 HydrophobicContact CG-CB 3.72Å; V68-D125 PolarHBondContact N-OD2 2.85Å; V68-D125 PolarHBondContact O-N 2.83Å; D125-K159 IonicContact OD1-NZ 2.76Å; D125-K159 PolarHBondContact OD1-NZ 3.24Å; D125-C160 PolarHBondContact O-N 2.84Å
126	V	98.8	Very high	98.3	Very high	2 Å²	2	42.7 Å²	42.7	1%	0.012	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	139.3	179.1	59.8	0	0	0	0	110.6	N62 V63 V68 V69 G70 I128 C160 V162	N62-V126 HydrophobicContact CB-CG2 4.36Å; V63-V126 HydrophobicContact CG2-CG1 4.25Å; V68-V126 PolarHBondContact O-N 2.82Å; V69-V126 CarbonylContact C-O 3.54Å; V69-V126 VanDerWaalsContact CA-O 3.26Å; V69-V126 WeakPolarHBondContact CA-O 3.48Å; V69-V126 HydrophobicContact CB-CG1 4.43Å; V69-V126 HydrophobicContact CG1-CG1 4.26Å; V69-V126 HydrophobicContact CG2-CG1 3.85Å; G70-V126 PolarHBondContact N-O 3.49Å; V126-I128 HydrophobicContact CG2-CG1 4.25Å; V126-C160 CarbonylContact C-O 3.6Å; V126-C160 VanDerWaalsContact CA-O 3.27Å; V126-C160 WeakPolarHBondContact CA-O 3.45Å; V126-V162 HydrophobicContact CG2-CG2 4.05Å
127	A	98.9	Very high	98.1	Very high	3 Å²	3	48.1 Å²	48.1	3%	0.025	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	136.2	163.2	0	0	0	0	0	109.9	G70 I154 S158 C160 F161 V162	G70-A127 WeakPolarHBondContact O-CA 3.35Å; A127-I154 HydrophobicContact CB-CG2 4.15Å; A127-S158 VanDerWaalsContact CB-OG 3.25Å; A127-S158 WeakPolarHBondContact CB-OG 3.15Å; A127-C160 PolarHBondContact N-O 2.85Å; A127-F161 HydrophobicContact CB-CD2 3.94Å; A127-V162 PolarHBondContact O-N 3.29Å
128	I	98.9	Very high	98.1	Very high	8 Å²	8	46.1 Å²	46.1	4%	0.041	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	122	171.9	-59.6	178.7	0	0	0	107.8	V59 V63 G70 G72 I77 A80 V126 V162 I164	V59-I128 HydrophobicContact CG2-CD1 3.75Å; V63-I128 HydrophobicContact CG2-CD1 3.79Å; G70-I128 PolarHBondContact O-N 3.01Å; G72-I128 WeakPolarHBondContact CA-O 3.3Å; G72-I128 PolarHBondContact N-O 2.6Å; I77-I128 HydrophobicContact CD1-CG2 4.2Å; I77-I128 WeakPolarHBondContact CD1-O 3.49Å; A80-I128 HydrophobicContact CB-CG2 4.26Å; V126-I128 HydrophobicContact CG2-CG1 4.25Å; I128-V162 WeakPolarHBondContact CA-O 3.06Å; I128-V162 HydrophobicContact CG1-CB 4.34Å; I128-I164 HydrophobicContact CG2-CD1 3.81Å; I128-I164 HydrophobicContact CG2-CG1 4.13Å; I128-I164 HydrophobicContact CG2-CG2 3.92Å
129	D	98.8	Very high	98	Very high	4 Å²	4	44.2 Å²	44.2	2%	0.021	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	160	179.6	-153.5	-7	0	0	0	113.3	G72 S73 I77 K142 E151 F161 V162 V163 I164	G72-D129 WeakPolarHBondContact CA-OD1 3.46Å; S73-D129 PolarHBondContact N-OD1 2.84Å; I77-D129 VanDerWaalsContact CD1-CA 3.49Å; D129-K142 IonicContact OD1-NZ 3.44Å; D129-K142 PolarHBondContact OD1-NZ 2.53Å; D129-K142 VanDerWaalsContact OD2-CE 3.32Å; D129-K142 WeakPolarHBondContact OD2-CE 3.46Å; D129-K142 IonicContact OD2-NZ 2.72Å; D129-K142 PolarHBondContact OD2-NZ 3.45Å; D129-E151 VanDerWaalsContact OD2-CG 3.3Å; D129-E151 WeakPolarHBondContact OD2-CG 3.25Å; D129-F161 HydrophobicContact CB-CE2 3.66Å; D129-F161 HydrophobicContact CB-CZ 4.14Å; D129-V162 PolarHBondContact N-O 3.22Å; D129-V163 CarbonylContact O-C 3.56Å; D129-V163 VanDerWaalsContact O-CA 3.3Å; D129-V163 WeakPolarHBondContact O-CA 3.39Å; D129-I164 PolarHBondContact O-N 2.7Å
130	G	98.6	Very high	98.1	Very high	10 Å²	10	35.4 Å²	35.4	10%	0.103	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	169	172.1	0	0	0	0	0	113.4	K142 I164	G130-K142 WeakPolarHBondContact O-CD 3.42Å; G130-K142 PolarHBondContact O-NZ 3.04Å; G130-I164 WeakPolarHBondContact CA-O 3.48Å
131	A	98.6	Very high	98.1	Very high	13 Å²	13	27.2 Å²	27.2	11%	0.107	15%	0.151	C	C	.	.			trans	-133.4	150.9	168.9	0	0	0	0	0	111.5	V134 L140 K142 V163	A131-V134 HydrophobicContact CB-CG2 3.57Å; A131-L140 HydrophobicContact CB-CB 4.38Å; A131-K142 HydrophobicContact CB-CG 4.29Å; A131-V163 HydrophobicContact CB-CG1 3.73Å
132	D	98.6	Very high	98.1	Very high	28 Å²	28	24.8 Å²	24.8	15%	0.15	14%	0.14	C	C	.	.	S	Bend	trans	-77.8	-31.5	170.6	-66.8	-57.3	0	0	0	111.2	I141 K142 G143 G144 K169 W178	D132-I141 WeakPolarHBondContact CA-O 3.48Å; D132-I141 HydrophobicContact CB-CG2 4.2Å; D132-I141 WeakPolarHBondContact CB-O 3.44Å; D132-I141 PolarHBondContact N-O 3.38Å; D132-K142 VanDerWaalsContact OD2-CA 3.25Å; D132-K142 WeakPolarHBondContact OD2-CA 3.11Å; D132-G143 PolarHBondContact OD2-N 3.16Å; D132-G143 VanDerWaalsContact OD2-N 3.12Å; D132-G144 WeakPolarHBondContact OD2-CA 3.43Å; D132-G144 PolarHBondContact OD2-N 3.05Å; D132-K169 VanDerWaalsContact O-CD 3.26Å; D132-K169 WeakPolarHBondContact O-CD 3.33Å; D132-K169 WeakPolarHBondContact O-CE 3.31Å; D132-K169 PolarHBondContact O-NZ 2.61Å; D132-W178 HydrophobicContact CB-CD2 3.72Å; D132-W178 HydrophobicContact CB-CE3 3.68Å; D132-W178 HydrophobicContact CB-CG 4.32Å; D132-W178 HydrophobicContact CB-CH2 3.94Å; D132-W178 HydrophobicContact CB-CZ2 4.03Å; D132-W178 HydrophobicContact CB-CZ3 3.78Å; D132-W178 VanDerWaalsContact OD1-CH2 3.27Å; D132-W178 WeakPolarHBondContact OD1-CH2 3.27Å; D132-W178 WeakPolarHBondContact OD1-CZ3 3.14Å
133	E	98.4	Very high	98.1	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.9	149.6	174.4	-165.4	171.2	-131.5	0	0	111	L140 I141 S171 L174 G175 E176 Q177 W178	E133-L140 WeakPolarHBondContact O-CA 3.22Å; E133-I141 HydrophobicContact CB-CB 4.31Å; E133-I141 PolarHBondContact N-O 2.85Å; E133-I141 PolarHBondContact O-N 2.91Å; E133-S171 WeakPolarHBondContact CG-OG 3.4Å; E133-S171 PolarHBondContact OE1-OG 3Å; E133-L174 HydrophobicContact CB-CD2 4.19Å; E133-L174 HydrophobicContact CG-CD2 4.02Å; E133-L174 WeakPolarHBondContact OE2-CA 3.26Å; E133-G175 PolarHBondContact OE1-N 3.38Å; E133-G175 PolarHBondContact OE2-N 2.88Å; E133-E176 PolarHBondContact OE1-N 3.12Å; E133-Q177 WeakPolarHBondContact OE1-CA 3.35Å; E133-Q177 PolarHBondContact OE1-N 2.86Å; E133-W178 HydrophobicContact CB-CB 3.82Å; E133-W178 HydrophobicContact CG-CB 4.33Å; E133-W178 PolarHBondContact OE1-N 2.95Å; E133-W178 WeakPolarHBondContact OE2-CB 3.46Å
134	V	98.4	Very high	98.1	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	125.4	179	-175.6	0	0	0	0	109	A131 L138 L140 V163 K169 S171 A263 F265	A131-V134 HydrophobicContact CB-CG2 3.57Å; V134-L138 HydrophobicContact CG1-CD2 3.8Å; V134-L140 HydrophobicContact CB-CD2 4.12Å; V134-L140 HydrophobicContact CG1-CD2 3.64Å; V134-L140 HydrophobicContact CG2-CD2 3.79Å; V134-V163 HydrophobicContact CG2-CG1 4.03Å; V134-K169 PolarHBondContact N-O 3.19Å; V134-S171 PolarHBondContact O-N 3.39Å; V134-A263 HydrophobicContact CG1-CB 4.38Å; V134-F265 HydrophobicContact CB-CE1 3.96Å; V134-F265 HydrophobicContact CB-CZ 3.74Å; V134-F265 HydrophobicContact CG1-CE1 4.46Å; V134-F265 HydrophobicContact CG1-CZ 3.76Å; V134-F265 HydrophobicContact CG2-CE1 3.94Å; V134-F265 HydrophobicContact CG2-CZ 4.05Å
135	D	96.9	Very high	98	Very high	3 Å²	3	18.8 Å²	18.8	2%	0.016	13%	0.13	C	C	.	.			trans	-86.2	179.1	175.9	75.5	11.1	0	0	0	113.4	Q137 L138 T139 S171 L174 R275	D135-Q137 PolarHBondContact O-N 3.03Å; D135-Q137 WeakPolarHBondContact OD1-CA 3.31Å; D135-Q137 PolarHBondContact OD1-N 3.41Å; D135-L138 PolarHBondContact O-N 3.23Å; D135-L138 PolarHBondContact OD1-N 3Å; D135-T139 PolarHBondContact N-O 3.02Å; D135-T139 WeakPolarHBondContact OD1-CB 3.39Å; D135-T139 PolarHBondContact OD1-N 3.14Å; D135-T139 VanDerWaalsContact OD2-CB 3.25Å; D135-T139 WeakPolarHBondContact OD2-CB 3.47Å; D135-T139 PolarHBondContact OD2-OG1 3.28Å; D135-S171 CarbonylContact C-O 3.45Å; D135-S171 WeakPolarHBondContact CA-O 3.44Å; D135-L174 HydrophobicContact CB-CD2 3.96Å; D135-L174 HydrophobicContact CB-CG 3.97Å; D135-R275 PolarHBondContact O-NH1 2.75Å
136	A	95.6	Very high	98	Very high	49 Å²	49	17.2 Å²	17.2	41%	0.405	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-23.6	179.6	0	0	0	0	0	113.7	S171 S172	A136-S171 PolarHBondContact N-O 2.8Å; A136-S172 WeakPolarHBondContact CB-O 3.39Å; A136-S172 PolarHBondContact N-O 3.02Å
137	Q	95	Very high	97.9	Very high	126 Å²	126	17.9 Å²	17.9	59%	0.589	13%	0.127	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.3	6.2	-179.5	-67.2	72.2	33.4	0	0	112.9	D135 T139	D135-Q137 PolarHBondContact O-N 3.03Å; D135-Q137 WeakPolarHBondContact OD1-CA 3.31Å; D135-Q137 PolarHBondContact OD1-N 3.41Å; Q137-T139 PolarHBondContact O-N 3.16Å
138	L	97.1	Very high	97.9	Very high	4 Å²	4	17.7 Å²	17.7	2%	0.021	13%	0.126	C	C	.	.	S	Bend	trans	61.7	24.3	-172	-64.4	176.1	0	0	0	113.9	V134 D135 L140 A260 A263 R275 A277	V134-L138 HydrophobicContact CG1-CD2 3.8Å; D135-L138 PolarHBondContact O-N 3.23Å; D135-L138 PolarHBondContact OD1-N 3Å; L138-L140 WeakPolarHBondContact O-CD2 3.48Å; L138-A260 HydrophobicContact CB-CB 4.36Å; L138-A263 HydrophobicContact CD2-CB 3.51Å; L138-R275 HydrophobicContact CD1-CG 4.35Å; L138-R275 HydrophobicContact CD2-CB 4.11Å; L138-R275 HydrophobicContact CD2-CG 3.81Å; L138-R275 HydrophobicContact CG-CG 4.01Å; L138-A277 HydrophobicContact CD1-CB 4Å
139	T	97.6	Very high	97.9	Very high	8 Å²	8	18 Å²	18	5%	0.049	13%	0.129	C	C	.	.			trans	-74.8	135.6	160.1	-48.9	0	0	0	0	108.3	D135 Q137 L174 W237 F256 V257	D135-T139 PolarHBondContact N-O 3.02Å; D135-T139 WeakPolarHBondContact OD1-CB 3.39Å; D135-T139 PolarHBondContact OD1-N 3.14Å; D135-T139 VanDerWaalsContact OD2-CB 3.25Å; D135-T139 WeakPolarHBondContact OD2-CB 3.47Å; D135-T139 PolarHBondContact OD2-OG1 3.28Å; Q137-T139 PolarHBondContact O-N 3.16Å; T139-L174 HydrophobicContact CG2-CD1 3.77Å; T139-W237 HydrophobicContact CG2-CB 3.97Å; T139-W237 HydrophobicContact CG2-CG 4.1Å; T139-F256 WeakPolarHBondContact CA-O 3.18Å; T139-V257 HydrophobicContact CG2-CB 4.36Å; T139-V257 HydrophobicContact CG2-CG2 3.84Å
140	L	98.6	Very high	97.9	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	146.2	-175.9	-28.2	171.9	0	0	0	111.2	A131 E133 V134 L138 K142 F161 V163 L255 F256 A260	A131-L140 HydrophobicContact CB-CB 4.38Å; E133-L140 WeakPolarHBondContact O-CA 3.22Å; V134-L140 HydrophobicContact CB-CD2 4.12Å; V134-L140 HydrophobicContact CG1-CD2 3.64Å; V134-L140 HydrophobicContact CG2-CD2 3.79Å; L138-L140 WeakPolarHBondContact O-CD2 3.48Å; L140-K142 HydrophobicContact CB-CG 4.36Å; L140-K142 HydrophobicContact CD1-CD 3.91Å; L140-F161 HydrophobicContact CD1-CE1 3.69Å; L140-F161 HydrophobicContact CD1-CZ 4.07Å; L140-V163 HydrophobicContact CD1-CG2 3.45Å; L140-V163 VanDerWaalsContact CD1-CG2 3.45Å; L140-V163 HydrophobicContact CD2-CG2 4.03Å; L140-V163 HydrophobicContact CG-CG2 4.41Å; L140-L255 WeakPolarHBondContact O-CA 3.27Å; L140-F256 HydrophobicContact CB-CB 3.99Å; L140-F256 HydrophobicContact CD1-CB 3.84Å; L140-F256 HydrophobicContact CD1-CG 4.39Å; L140-F256 HydrophobicContact CG-CB 3.92Å; L140-F256 PolarHBondContact N-O 3.46Å; L140-F256 PolarHBondContact O-N 3.22Å; L140-A260 HydrophobicContact CD1-CB 4.25Å; L140-A260 HydrophobicContact CD2-CB 4.28Å
141	I	98.7	Very high	97.9	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	128.6	151.3	-61.7	177.4	0	0	0	108	D132 E133 L174 W178 V182 F231 G254 L255	D132-I141 WeakPolarHBondContact CA-O 3.48Å; D132-I141 HydrophobicContact CB-CG2 4.2Å; D132-I141 WeakPolarHBondContact CB-O 3.44Å; D132-I141 PolarHBondContact N-O 3.38Å; E133-I141 HydrophobicContact CB-CB 4.31Å; E133-I141 PolarHBondContact N-O 2.85Å; E133-I141 PolarHBondContact O-N 2.91Å; I141-L174 HydrophobicContact CD1-CB 4.11Å; I141-L174 HydrophobicContact CD1-CD1 4.34Å; I141-L174 HydrophobicContact CD1-CD2 4.35Å; I141-L174 HydrophobicContact CD1-CG 4.49Å; I141-L174 HydrophobicContact CG1-CB 4.4Å; I141-L174 HydrophobicContact CG1-CD1 3.77Å; I141-L174 HydrophobicContact CG1-CD2 3.96Å; I141-L174 HydrophobicContact CG1-CG 4.25Å; I141-W178 HydrophobicContact CG2-CG 4.48Å; I141-V182 HydrophobicContact CD1-CG2 4.08Å; I141-V182 HydrophobicContact CG1-CG2 4.34Å; I141-F231 HydrophobicContact CD1-CE1 4.05Å; I141-F231 HydrophobicContact CD1-CZ 4.34Å; I141-G254 CarbonylContact C-O 3.5Å; I141-G254 WeakPolarHBondContact CA-O 3.38Å; I141-L255 HydrophobicContact CG1-CD2 4.43Å
142	K	98.8	Very high	98	Very high	4 Å²	4	20.6 Å²	20.6	2%	0.017	14%	0.135	C	C	.	.			trans	-133.5	170	172.7	-78	176.8	57.3	55	0	110.2	D129 G130 A131 D132 L140 E151 F161 P183 G254 F256	D129-K142 IonicContact OD1-NZ 3.44Å; D129-K142 PolarHBondContact OD1-NZ 2.53Å; D129-K142 VanDerWaalsContact OD2-CE 3.32Å; D129-K142 WeakPolarHBondContact OD2-CE 3.46Å; D129-K142 IonicContact OD2-NZ 2.72Å; D129-K142 PolarHBondContact OD2-NZ 3.45Å; G130-K142 WeakPolarHBondContact O-CD 3.42Å; G130-K142 PolarHBondContact O-NZ 3.04Å; A131-K142 HydrophobicContact CB-CG 4.29Å; D132-K142 VanDerWaalsContact OD2-CA 3.25Å; D132-K142 WeakPolarHBondContact OD2-CA 3.11Å; L140-K142 HydrophobicContact CB-CG 4.36Å; L140-K142 HydrophobicContact CD1-CD 3.91Å; K142-E151 WeakPolarHBondContact CE-OE2 3.38Å; K142-E151 IonicContact NZ-OE1 2.74Å; K142-E151 IonicContact NZ-OE2 3.95Å; K142-E151 PolarHBondContact NZ-OE2 3.44Å; K142-F161 HydrophobicContact CD-CZ 4.45Å; K142-P183 VanDerWaalsContact O-CD 3.31Å; K142-P183 WeakPolarHBondContact O-CD 3.45Å; K142-P183 VanDerWaalsContact O-CG 3.31Å; K142-P183 WeakPolarHBondContact O-CG 3.48Å; K142-G254 PolarHBondContact N-O 3.46Å; K142-G254 WeakPolarHBondContact O-CA 3.16Å; K142-F256 HydrophobicContact CB-CD2 3.8Å; K142-F256 HydrophobicContact CB-CE2 3.54Å; K142-F256 HydrophobicContact CB-CZ 4.17Å; K142-F256 HydrophobicContact CD-CD1 3.88Å; K142-F256 HydrophobicContact CD-CD2 3.86Å; K142-F256 HydrophobicContact CD-CE1 3.81Å; K142-F256 HydrophobicContact CD-CE2 3.85Å; K142-F256 HydrophobicContact CD-CG 3.9Å; K142-F256 HydrophobicContact CD-CZ 3.81Å; K142-F256 VanDerWaalsContact CE-CZ 3.42Å; K142-F256 HydrophobicContact CG-CD2 4.19Å; K142-F256 HydrophobicContact CG-CE2 4.22Å
143	G	98.2	Very high	98	Very high	1 Å²	1	23 Å²	23	1%	0.01	15%	0.147	C	C	.	.			trans	101.1	8.4	177.5	0	0	0	0	0	115.5	D132 G145 G146 R209	D132-G143 PolarHBondContact OD2-N 3.16Å; D132-G143 VanDerWaalsContact OD2-N 3.12Å; G143-G145 PolarHBondContact O-N 3.08Å; G143-G146 PolarHBondContact O-N 3.38Å; G143-R209 PolarHBondContact O-NH1 2.88Å; G143-R209 PolarHBondContact O-NH2 3.4Å
144	G	97.4	Very high	98	Very high	28 Å²	28	23.3 Å²	23.3	29%	0.289	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-35.5	170.5	0	0	0	0	0	112.4	D132 R209	D132-G144 WeakPolarHBondContact OD2-CA 3.43Å; D132-G144 PolarHBondContact OD2-N 3.05Å; G144-R209 PolarHBondContact O-NH1 2.7Å
145	G	97.4	Very high	98	Very high	65 Å²	65	23.6 Å²	23.6	67%	0.67	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-7.1	172.9	0	0	0	0	0	115.4	G143	G143-G145 PolarHBondContact O-N 3.08Å
146	G	98.1	Very high	98.1	Very high	5 Å²	5	26 Å²	26	5%	0.052	18%	0.176	C	C	.	.	S	Bend	trans	79.4	19.6	179.1	0	0	0	0	0	116.1	G143 I226	G143-G146 PolarHBondContact O-N 3.38Å; G146-I226 VanDerWaalsContact CA-CD1 3.41Å
147	C	98.3	Very high	98.2	Very high	16 Å²	16	27.2 Å²	27.2	11%	0.108	18%	0.176	C	C	.	.			trans	-108.4	10.3	-177.2	-55.5	0	0	0	0	113.4	S101 T149 Q150 E151	S101-C147 WeakPolarHBondContact CB-SG 3.22Å; C147-T149 VanDerWaalsContact C-N 3.29Å; C147-T149 PolarHBondContact O-N 3.4Å; C147-T149 VanDerWaalsContact O-N 3.08Å; C147-Q150 PolarHBondContact O-N 3.42Å; C147-Q150 VanDerWaalsContact O-N 3.16Å; C147-E151 HydrophobicContact CB-CG 4.09Å; C147-E151 WeakPolarHBondContact O-CG 3.47Å; C147-E151 PolarHBondContact O-N 2.63Å
148	L	98.8	Very high	98.4	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-54.2	-35.9	-165.2	67.7	97.5	0	0	0	115.1	K152 P183 E185 E252 T253	L148-K152 WeakPolarHBondContact O-CB 3.5Å; L148-K152 PolarHBondContact O-N 2.99Å; L148-P183 HydrophobicContact CD2-CB 3.74Å; L148-E185 HydrophobicContact CD1-CB 4.06Å; L148-E185 HydrophobicContact CD2-CB 4.25Å; L148-E185 HydrophobicContact CG-CB 4.33Å; L148-E252 HydrophobicContact CD1-CB 3.57Å; L148-E252 HydrophobicContact CD1-CG 3.69Å; L148-T253 WeakPolarHBondContact CD1-O 3.46Å
149	T	98.9	Very high	98.4	Very high	15 Å²	15	28.2 Å²	28.2	9%	0.092	18%	0.181	C	C	.	.	H	α-helix	trans	-66.9	-49.4	-178.7	-66	0	0	0	0	111.1	C147 K152 I153 E185 V251 E252	C147-T149 VanDerWaalsContact C-N 3.29Å; C147-T149 PolarHBondContact O-N 3.4Å; C147-T149 VanDerWaalsContact O-N 3.08Å; T149-K152 PolarHBondContact O-N 3.45Å; T149-I153 HydrophobicContact CG2-CD1 3.84Å; T149-I153 VanDerWaalsContact O-CG1 3.24Å; T149-I153 WeakPolarHBondContact O-CG1 3.33Å; T149-I153 PolarHBondContact O-N 3.04Å; T149-E185 VanDerWaalsContact CB-OE2 3.23Å; T149-E185 WeakPolarHBondContact CB-OE2 3.41Å; T149-E185 VanDerWaalsContact OG1-CD 3.22Å; T149-E185 PolarHBondContact OG1-OE2 3.08Å; T149-V251 HydrophobicContact CG2-CG1 4.23Å; T149-E252 WeakPolarHBondContact OG1-CB 3.43Å
150	Q	98.8	Very high	98.5	Very high	51 Å²	51	28.8 Å²	28.8	24%	0.238	19%	0.185	C	C	.	.	H	α-helix	trans	-68.7	-38.2	179.2	-70.4	-179.7	28.7	0	0	111	T100 C147 K152 I153 I154 N222	T100-Q150 WeakPolarHBondContact O-CB 3.4Å; T100-Q150 PolarHBondContact O-OE1 3.19Å; C147-Q150 PolarHBondContact O-N 3.42Å; C147-Q150 VanDerWaalsContact O-N 3.16Å; Q150-K152 VanDerWaalsContact C-N 3.34Å; Q150-K152 PolarHBondContact O-N 3.21Å; Q150-I153 PolarHBondContact O-N 3.29Å; Q150-I154 WeakPolarHBondContact O-CG1 3.47Å; Q150-I154 PolarHBondContact O-N 3.45Å; Q150-N222 PolarHBondContact NE2-OD1 3.15Å
151	E	98.9	Very high	98.5	Very high	8 Å²	8	29 Å²	29	4%	0.037	19%	0.186	C	C	.	.	H	α-helix	trans	-54.5	-48.4	171.1	-67.9	174	173.5	0	0	111.7	D129 K142 C147 I154 A155 F256	D129-E151 VanDerWaalsContact OD2-CG 3.3Å; D129-E151 WeakPolarHBondContact OD2-CG 3.25Å; K142-E151 WeakPolarHBondContact CE-OE2 3.38Å; K142-E151 IonicContact NZ-OE1 2.74Å; K142-E151 IonicContact NZ-OE2 3.95Å; K142-E151 PolarHBondContact NZ-OE2 3.44Å; C147-E151 HydrophobicContact CB-CG 4.09Å; C147-E151 WeakPolarHBondContact O-CG 3.47Å; C147-E151 PolarHBondContact O-N 2.63Å; E151-I154 PolarHBondContact O-N 2.91Å; E151-A155 WeakPolarHBondContact O-CB 3.12Å; E151-A155 PolarHBondContact O-N 2.92Å; E151-F256 HydrophobicContact CB-CE1 4.4Å; E151-F256 HydrophobicContact CB-CZ 3.88Å
152	K	98.8	Very high	98.5	Very high	21 Å²	21	29 Å²	29	9%	0.091	19%	0.186	C	C	.	.	H	α-helix	trans	-71	-36.8	-178.2	-159.2	174.7	-61.3	-175.4	0	112.7	L148 T149 Q150 G156 E252 T253 L255 F256 M259	L148-K152 WeakPolarHBondContact O-CB 3.5Å; L148-K152 PolarHBondContact O-N 2.99Å; T149-K152 PolarHBondContact O-N 3.45Å; Q150-K152 VanDerWaalsContact C-N 3.34Å; Q150-K152 PolarHBondContact O-N 3.21Å; K152-G156 PolarHBondContact O-N 3.01Å; K152-E252 HydrophobicContact CB-CG 4.33Å; K152-E252 HydrophobicContact CD-CG 3.94Å; K152-E252 WeakPolarHBondContact CE-OE1 3.3Å; K152-E252 IonicContact NZ-OE1 3.86Å; K152-E252 PolarHBondContact NZ-OE1 3.47Å; K152-T253 WeakPolarHBondContact CE-O 3.23Å; K152-T253 PolarHBondContact NZ-O 3.37Å; K152-T253 PolarHBondContact NZ-OG1 3.17Å; K152-L255 WeakPolarHBondContact CE-O 3.42Å; K152-L255 PolarHBondContact NZ-O 3.23Å; K152-F256 VanDerWaalsContact CA-CE1 3.49Å; K152-F256 HydrophobicContact CB-CE1 3.77Å; K152-F256 HydrophobicContact CB-CE2 4.18Å; K152-F256 HydrophobicContact CB-CZ 3.5Å; K152-F256 HydrophobicContact CG-CD1 4.27Å; K152-F256 HydrophobicContact CG-CE1 3.9Å; K152-F256 HydrophobicContact CG-CE2 4.42Å; K152-F256 HydrophobicContact CG-CZ 3.97Å; K152-M259 HydrophobicContact CD-SD 4.12Å; K152-M259 HydrophobicContact CG-CE 3.79Å; K152-M259 HydrophobicContact CG-SD 3.75Å
153	I	98.8	Very high	98.5	Very high	79 Å²	79	28.8 Å²	28.8	41%	0.405	19%	0.185	S	C	.	.	H	α-helix	trans	-60.2	-48.9	174.4	-71.9	166	0	0	0	110.2	L118 T149 Q150 G156 N157	L118-I153 HydrophobicContact CD1-CG2 3.4Å; L118-I153 VanDerWaalsContact CD1-CG2 3.4Å; T149-I153 HydrophobicContact CG2-CD1 3.84Å; T149-I153 VanDerWaalsContact O-CG1 3.24Å; T149-I153 WeakPolarHBondContact O-CG1 3.33Å; T149-I153 PolarHBondContact O-N 3.04Å; Q150-I153 PolarHBondContact O-N 3.29Å; I153-G156 PolarHBondContact O-N 3.2Å; I153-N157 PolarHBondContact O-N 3.19Å; I153-N157 VanDerWaalsContact O-N 3.13Å; I153-N157 PolarHBondContact O-ND2 3.44Å
154	I	98.8	Very high	98.5	Very high	6 Å²	6	28.8 Å²	28.8	3%	0.031	18%	0.184	C	C	.	.	H	α-helix	trans	-66	-45.4	-179.8	-66.9	-67.1	0	0	0	111.2	V98 T100 L118 L124 A127 Q150 E151 G156 N157 S158	V98-I154 HydrophobicContact CB-CD1 4.28Å; V98-I154 HydrophobicContact CG1-CD1 3.4Å; V98-I154 VanDerWaalsContact CG1-CD1 3.4Å; T100-I154 HydrophobicContact CG2-CB 3.65Å; T100-I154 HydrophobicContact CG2-CG1 3.75Å; T100-I154 HydrophobicContact CG2-CG2 3.8Å; L118-I154 HydrophobicContact CD1-CD1 3.77Å; L118-I154 HydrophobicContact CD2-CD1 3.89Å; L118-I154 HydrophobicContact CG-CD1 3.73Å; L124-I154 HydrophobicContact CD2-CG2 4.03Å; A127-I154 HydrophobicContact CB-CG2 4.15Å; Q150-I154 WeakPolarHBondContact O-CG1 3.47Å; Q150-I154 PolarHBondContact O-N 3.45Å; E151-I154 PolarHBondContact O-N 2.91Å; I154-G156 VanDerWaalsContact C-N 3.31Å; I154-G156 PolarHBondContact O-N 3.48Å; I154-N157 PolarHBondContact O-N 3.27Å; I154-S158 PolarHBondContact O-N 3.27Å; I154-S158 PolarHBondContact O-OG 2.86Å
155	A	98.7	Very high	98.6	Very high	6 Å²	6	27.5 Å²	27.5	5%	0.05	17%	0.172	C	C	.	.	H	α-helix	trans	-59.2	-42.2	176.1	0	0	0	0	0	112	E151 N157 S158 F161 F256 M259	E151-A155 WeakPolarHBondContact O-CB 3.12Å; E151-A155 PolarHBondContact O-N 2.92Å; A155-N157 VanDerWaalsContact C-N 3.29Å; A155-N157 PolarHBondContact O-N 2.68Å; A155-S158 PolarHBondContact O-N 2.8Å; A155-F161 HydrophobicContact CB-CD1 3.91Å; A155-F161 HydrophobicContact CB-CD2 4.01Å; A155-F161 HydrophobicContact CB-CE1 4.08Å; A155-F161 HydrophobicContact CB-CE2 4.19Å; A155-F161 HydrophobicContact CB-CG 3.89Å; A155-F161 HydrophobicContact CB-CZ 4.23Å; A155-F256 HydrophobicContact CB-CD1 4.5Å; A155-F256 HydrophobicContact CB-CE1 4.2Å; A155-M259 HydrophobicContact CB-CE 3.75Å
156	G	98.5	Very high	98.6	Very high	53 Å²	53	24.5 Å²	24.5	55%	0.546	14%	0.14	S	C	.	.	H	α-helix	trans	-71.4	-18.2	179.8	0	0	0	0	0	115	K152 I153 I154	K152-G156 PolarHBondContact O-N 3.01Å; I153-G156 PolarHBondContact O-N 3.2Å; I154-G156 VanDerWaalsContact C-N 3.31Å; I154-G156 PolarHBondContact O-N 3.48Å
157	N	98.7	Very high	98.5	Very high	75 Å²	75	27 Å²	27	40%	0.401	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.9	12.8	174.6	-70.7	-79.6	0	0	0	112.7	L118 P122 L124 I153 I154 A155	L118-N157 HydrophobicContact CD2-CB 4.31Å; P122-N157 WeakPolarHBondContact O-CB 3.39Å; L124-N157 HydrophobicContact CD1-CB 4.25Å; L124-N157 PolarHBondContact N-O 2.85Å; I153-N157 PolarHBondContact O-N 3.19Å; I153-N157 VanDerWaalsContact O-N 3.13Å; I153-N157 PolarHBondContact O-ND2 3.44Å; I154-N157 PolarHBondContact O-N 3.27Å; A155-N157 VanDerWaalsContact C-N 3.29Å; A155-N157 PolarHBondContact O-N 2.68Å
158	S	98.6	Very high	98.5	Very high	19 Å²	19	31.2 Å²	31.2	13%	0.133	16%	0.162	C	C	.	.	B	Isolated β-bridge	trans	-105.6	136.8	178.2	-61.2	0	0	0	0	110.9	L124 A127 I154 A155 C160	L124-S158 CarbonylContact O-C 3.57Å; L124-S158 WeakPolarHBondContact O-CA 3.43Å; A127-S158 VanDerWaalsContact CB-OG 3.25Å; A127-S158 WeakPolarHBondContact CB-OG 3.15Å; I154-S158 PolarHBondContact O-N 3.27Å; I154-S158 PolarHBondContact O-OG 2.86Å; A155-S158 PolarHBondContact O-N 2.8Å; S158-C160 PolarHBondContact O-N 2.86Å
159	K	98.2	Very high	98.4	Very high	133 Å²	133	33.3 Å²	33.3	58%	0.578	17%	0.171	S	C	*	.	S	Bend	trans	-62.4	-34.1	175.2	-65.7	171.2	-166.2	159.9	0	112	L124 D125	L124-K159 WeakPolarHBondContact O-CG 3.28Å; L124-K159 PolarHBondContact O-N 2.91Å; D125-K159 IonicContact OD1-NZ 2.76Å; D125-K159 PolarHBondContact OD1-NZ 3.24Å
160	C	98.1	Very high	98.4	Very high	20 Å²	20	34.1 Å²	34.1	14%	0.135	18%	0.175	C	C	.	.	S	Bend	trans	-134	128.4	176.3	-172.6	0	0	0	0	110.8	D125 V126 A127 S158 E261	D125-C160 PolarHBondContact O-N 2.84Å; V126-C160 CarbonylContact C-O 3.6Å; V126-C160 VanDerWaalsContact CA-O 3.27Å; V126-C160 WeakPolarHBondContact CA-O 3.45Å; A127-C160 PolarHBondContact N-O 2.85Å; S158-C160 PolarHBondContact O-N 2.86Å; C160-E261 VanDerWaalsContact CA-OE1 3.25Å; C160-E261 WeakPolarHBondContact CA-OE1 3.39Å; C160-E261 PolarHBondContact SG-OE2 2.94Å
161	F	98.8	Very high	98.2	Very high	4 Å²	4	31.9 Å²	31.9	2%	0.018	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	118	173.9	177.7	-140	0	0	0	111.2	A127 D129 L140 K142 A155 V163 F256 M259 A260 E261	A127-F161 HydrophobicContact CB-CD2 3.94Å; D129-F161 HydrophobicContact CB-CE2 3.66Å; D129-F161 HydrophobicContact CB-CZ 4.14Å; L140-F161 HydrophobicContact CD1-CE1 3.69Å; L140-F161 HydrophobicContact CD1-CZ 4.07Å; K142-F161 HydrophobicContact CD-CZ 4.45Å; A155-F161 HydrophobicContact CB-CD1 3.91Å; A155-F161 HydrophobicContact CB-CD2 4.01Å; A155-F161 HydrophobicContact CB-CE1 4.08Å; A155-F161 HydrophobicContact CB-CE2 4.19Å; A155-F161 HydrophobicContact CB-CG 3.89Å; A155-F161 HydrophobicContact CB-CZ 4.23Å; F161-V163 HydrophobicContact CE1-CG2 4.03Å; F161-V163 HydrophobicContact CE2-CG2 4.41Å; F161-V163 HydrophobicContact CZ-CG2 3.89Å; F161-F256 AromaticContact CE1-CD1 3.91Å; F161-F256 HydrophobicContact CE1-CD1 3.91Å; F161-F256 HydrophobicContact CZ-CD1 4.37Å; F161-M259 HydrophobicContact CD1-CB 3.96Å; F161-M259 HydrophobicContact CE1-CB 4.46Å; F161-A260 HydrophobicContact CD1-CB 3.99Å; F161-A260 HydrophobicContact CE1-CB 4.21Å; F161-E261 PolarHBondContact O-N 2.84Å
162	V	98.8	Very high	98.1	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	126.2	-176.9	-179.4	0	0	0	0	110.2	A58 N62 V126 A127 I128 D129 Y264	A58-V162 HydrophobicContact CB-CG1 3.98Å; N62-V162 HydrophobicContact CB-CG2 4.07Å; V126-V162 HydrophobicContact CG2-CG2 4.05Å; A127-V162 PolarHBondContact O-N 3.29Å; I128-V162 WeakPolarHBondContact CA-O 3.06Å; I128-V162 HydrophobicContact CG1-CB 4.34Å; D129-V162 PolarHBondContact N-O 3.22Å; V162-Y264 HydrophobicContact CG1-CD2 3.65Å; V162-Y264 HydrophobicContact CG1-CE2 3.66Å
163	V	98.9	Very high	97.9	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	137.9	178	-179.5	0	0	0	0	110.2	D129 A131 V134 L140 F161 A260 R262 A263 Y264	D129-V163 CarbonylContact O-C 3.56Å; D129-V163 VanDerWaalsContact O-CA 3.3Å; D129-V163 WeakPolarHBondContact O-CA 3.39Å; A131-V163 HydrophobicContact CB-CG1 3.73Å; V134-V163 HydrophobicContact CG2-CG1 4.03Å; L140-V163 HydrophobicContact CD1-CG2 3.45Å; L140-V163 VanDerWaalsContact CD1-CG2 3.45Å; L140-V163 HydrophobicContact CD2-CG2 4.03Å; L140-V163 HydrophobicContact CG-CG2 4.41Å; F161-V163 HydrophobicContact CE1-CG2 4.03Å; F161-V163 HydrophobicContact CE2-CG2 4.41Å; F161-V163 HydrophobicContact CZ-CG2 3.89Å; V163-A260 HydrophobicContact CG2-CB 3.64Å; V163-R262 PolarHBondContact N-O 3.44Å; V163-A263 HydrophobicContact CB-CB 3.94Å; V163-A263 HydrophobicContact CG1-CB 4.35Å; V163-A263 CarbonylContact O-C 3.48Å; V163-A263 VanDerWaalsContact O-CA 3.31Å; V163-A263 WeakPolarHBondContact O-CA 3.23Å; V163-Y264 PolarHBondContact O-N 3.46Å
164	I	98.9	Very high	97.8	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	131.4	173.5	59	174	0	0	0	111	A55 A58 T76 I77 A80 I128 D129 G130	A55-I164 HydrophobicContact CB-CD1 3.86Å; A58-I164 HydrophobicContact CB-CG2 3.26Å; T76-I164 HydrophobicContact CG2-CB 4.18Å; T76-I164 HydrophobicContact CG2-CD1 3.76Å; T76-I164 HydrophobicContact CG2-CG1 3.79Å; I77-I164 HydrophobicContact CD1-CD1 3.57Å; I77-I164 HydrophobicContact CD1-CG1 4.05Å; I77-I164 HydrophobicContact CG1-CD1 4.41Å; A80-I164 HydrophobicContact CB-CD1 3.76Å; I128-I164 HydrophobicContact CG2-CD1 3.81Å; I128-I164 HydrophobicContact CG2-CG1 4.13Å; I128-I164 HydrophobicContact CG2-CG2 3.92Å; D129-I164 PolarHBondContact O-N 2.7Å; G130-I164 WeakPolarHBondContact CA-O 3.48Å
165	A	98.3	Very high	97.6	Very high	2 Å²	2	35.7 Å²	35.7	2%	0.017	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	168.1	178.8	0	0	0	0	0	112.2	A54 K169 Y264 F265 G266	A54-A165 VanDerWaalsContact CB-O 3.31Å; A54-A165 WeakPolarHBondContact CB-O 3.41Å; A165-K169 HydrophobicContact CB-CB 3.61Å; A165-K169 HydrophobicContact CB-CG 3.75Å; A165-Y264 PolarHBondContact N-O 3.37Å; A165-F265 HydrophobicContact CB-CD1 4.03Å; A165-F265 HydrophobicContact CB-CE1 4.21Å; A165-F265 VanDerWaalsContact O-CA 3.26Å; A165-F265 WeakPolarHBondContact O-CA 3.45Å; A165-G266 PolarHBondContact O-N 2.78Å
166	D	97.9	Very high	97.4	Very high	2 Å²	2	39.2 Å²	39.2	1%	0.011	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	164.1	164.5	70.2	78.8	0	0	0	110.8	A50 K51 R168 K169	A50-D166 HydrophobicContact CB-CB 3.98Å; K51-D166 HydrophobicContact CG-CB 4.06Å; D166-R168 PolarHBondContact O-N 3.02Å; D166-R168 VanDerWaalsContact OD1-CB 3.23Å; D166-R168 WeakPolarHBondContact OD1-CB 3.38Å; D166-R168 WeakPolarHBondContact OD1-CG 3.21Å; D166-R168 IonicContact OD1-CZ 3.4Å; D166-R168 PolarHBondContact OD1-N 2.91Å; D166-R168 IonicContact OD1-NE 3.49Å; D166-R168 PolarHBondContact OD1-NE 3.33Å; D166-R168 IonicContact OD1-NH2 3.67Å; D166-R168 PolarHBondContact OD1-NH2 2.93Å; D166-R168 IonicContact OD2-CZ 2.81Å; D166-R168 IonicContact OD2-NE 3.7Å; D166-R168 IonicContact OD2-NH2 3.67Å; D166-R168 PolarHBondContact OD2-NH2 3.38Å; D166-K169 WeakPolarHBondContact O-CB 3.2Å; D166-K169 PolarHBondContact O-N 3.29Å
167	Y	97	Very high	97.2	Very high	58 Å²	58	41.7 Å²	41.7	23%	0.227	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-52	-26.8	-176	65.5	-82.7	0	0	0	115.1	A50 K169 D170 G266 E268	A50-Y167 HydrophobicContact CB-CD1 4.39Å; Y167-K169 PolarHBondContact O-N 3.45Å; Y167-K169 VanDerWaalsContact O-N 3.15Å; Y167-D170 WeakPolarHBondContact O-CB 3.35Å; Y167-D170 PolarHBondContact O-N 3.05Å; Y167-D170 VanDerWaalsContact O-N 3.12Å; Y167-G266 WeakPolarHBondContact CB-O 3.42Å; Y167-G266 PolarHBondContact N-O 2.84Å; Y167-E268 HydrophobicContact CD1-CB 4.29Å; Y167-E268 HydrophobicContact CE1-CB 4.02Å; Y167-E268 HydrophobicContact CE2-CB 4.42Å
168	R	96.7	Very high	97	Very high	103 Å²	103	39.2 Å²	39.2	39%	0.389	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-69.5	-11.8	179.1	-56.1	170.1	-62.8	-179.4	0.8	112.7	D166 Q177	D166-R168 PolarHBondContact O-N 3.02Å; D166-R168 VanDerWaalsContact OD1-CB 3.23Å; D166-R168 WeakPolarHBondContact OD1-CB 3.38Å; D166-R168 WeakPolarHBondContact OD1-CG 3.21Å; D166-R168 IonicContact OD1-CZ 3.4Å; D166-R168 PolarHBondContact OD1-N 2.91Å; D166-R168 IonicContact OD1-NE 3.49Å; D166-R168 PolarHBondContact OD1-NE 3.33Å; D166-R168 IonicContact OD1-NH2 3.67Å; D166-R168 PolarHBondContact OD1-NH2 2.93Å; D166-R168 IonicContact OD2-CZ 2.81Å; D166-R168 IonicContact OD2-NE 3.7Å; D166-R168 IonicContact OD2-NH2 3.67Å; D166-R168 PolarHBondContact OD2-NH2 3.38Å; R168-Q177 WeakPolarHBondContact O-CB 3.4Å; R168-Q177 WeakPolarHBondContact O-CG 3.42Å
169	K	97.8	Very high	96.9	Very high	45 Å²	45	45.2 Å²	45.2	20%	0.196	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-95.6	-7.4	178	-49.7	-41	-154.8	163.3	0	112.3	D132 V134 A165 D166 Y167 S171	D132-K169 VanDerWaalsContact O-CD 3.26Å; D132-K169 WeakPolarHBondContact O-CD 3.33Å; D132-K169 WeakPolarHBondContact O-CE 3.31Å; D132-K169 PolarHBondContact O-NZ 2.61Å; V134-K169 PolarHBondContact N-O 3.19Å; A165-K169 HydrophobicContact CB-CB 3.61Å; A165-K169 HydrophobicContact CB-CG 3.75Å; D166-K169 WeakPolarHBondContact O-CB 3.2Å; D166-K169 PolarHBondContact O-N 3.29Å; Y167-K169 PolarHBondContact O-N 3.45Å; Y167-K169 VanDerWaalsContact O-N 3.15Å; K169-S171 PolarHBondContact O-N 3.17Å
170	D	97.6	Very high	96.8	Very high	32 Å²	32	45.4 Å²	45.4	17%	0.171	22%	0.222	C	C	.	.	B	Isolated β-bridge	trans	-86.3	96.8	179.5	-170.4	16.2	0	0	0	110.5	Y167 F265 K273 R275	Y167-D170 WeakPolarHBondContact O-CB 3.35Å; Y167-D170 PolarHBondContact O-N 3.05Å; Y167-D170 VanDerWaalsContact O-N 3.12Å; D170-F265 HydrophobicContact CB-CD1 3.66Å; D170-F265 HydrophobicContact CB-CD2 4.44Å; D170-F265 HydrophobicContact CB-CE1 3.74Å; D170-F265 HydrophobicContact CB-CE2 4.49Å; D170-F265 HydrophobicContact CB-CG 4.01Å; D170-F265 HydrophobicContact CB-CZ 4.15Å; D170-K273 IonicContact OD2-NZ 2.8Å; D170-K273 PolarHBondContact OD2-NZ 2.97Å; D170-R275 IonicContact OD1-CZ 2.82Å; D170-R275 IonicContact OD1-NH1 3.12Å; D170-R275 PolarHBondContact OD1-NH1 3.09Å; D170-R275 IonicContact OD1-NH2 2.74Å; D170-R275 PolarHBondContact OD1-NH2 3.48Å; D170-R275 IonicContact OD2-NH2 3.43Å
171	S	96.4	Very high	96.8	Very high	3 Å²	3	44.6 Å²	44.6	2%	0.021	22%	0.217	C	C	.	.			trans	-111.4	160.4	-178	-60.2	0	0	0	0	111.9	E133 V134 D135 A136 K169 V173 Q177	E133-S171 WeakPolarHBondContact CG-OG 3.4Å; E133-S171 PolarHBondContact OE1-OG 3Å; V134-S171 PolarHBondContact O-N 3.39Å; D135-S171 CarbonylContact C-O 3.45Å; D135-S171 WeakPolarHBondContact CA-O 3.44Å; A136-S171 PolarHBondContact N-O 2.8Å; K169-S171 PolarHBondContact O-N 3.17Å; S171-V173 WeakPolarHBondContact CB-O 3.18Å; S171-Q177 VanDerWaalsContact OG-CG 3.31Å; S171-Q177 WeakPolarHBondContact OG-CG 3.49Å
172	S	95.4	Very high	96.8	Very high	79 Å²	79	44.4 Å²	44.4	55%	0.552	22%	0.216	S	C	*	.	S	Bend	trans	-79.1	-41.9	172.2	-59.9	0	0	0	0	110.7	A136 E176	A136-S172 WeakPolarHBondContact CB-O 3.39Å; A136-S172 PolarHBondContact N-O 3.02Å; S172-E176 PolarHBondContact N-OE2 3.49Å
173	V	95.4	Very high	96.8	Very high	91 Å²	91	44.4 Å²	44.4	55%	0.552	22%	0.216	S	C	*	.	S	Bend	trans	-132.2	150.8	176.5	-63.6	0	0	0	0	109.6	S171 E176	S171-V173 WeakPolarHBondContact CB-O 3.18Å; V173-E176 WeakPolarHBondContact O-CB 3.17Å
174	L	96.8	Very high	96.8	Very high	9 Å²	9	44.4 Å²	44.4	5%	0.047	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	143.5	173.8	-66.5	-175.3	0	0	0	111.2	E133 D135 T139 I141 F231 W237 L255	E133-L174 HydrophobicContact CB-CD2 4.19Å; E133-L174 HydrophobicContact CG-CD2 4.02Å; E133-L174 WeakPolarHBondContact OE2-CA 3.26Å; D135-L174 HydrophobicContact CB-CD2 3.96Å; D135-L174 HydrophobicContact CB-CG 3.97Å; T139-L174 HydrophobicContact CG2-CD1 3.77Å; I141-L174 HydrophobicContact CD1-CB 4.11Å; I141-L174 HydrophobicContact CD1-CD1 4.34Å; I141-L174 HydrophobicContact CD1-CD2 4.35Å; I141-L174 HydrophobicContact CD1-CG 4.49Å; I141-L174 HydrophobicContact CG1-CB 4.4Å; I141-L174 HydrophobicContact CG1-CD1 3.77Å; I141-L174 HydrophobicContact CG1-CD2 3.96Å; I141-L174 HydrophobicContact CG1-CG 4.25Å; L174-F231 HydrophobicContact CB-CZ 4.34Å; L174-W237 HydrophobicContact CB-CH2 4.33Å; L174-W237 HydrophobicContact CB-CZ2 3.53Å; L174-W237 HydrophobicContact CD1-CD2 3.95Å; L174-W237 HydrophobicContact CD1-CE3 4.49Å; L174-W237 HydrophobicContact CD1-CG 4.28Å; L174-W237 HydrophobicContact CD1-CZ2 4.05Å; L174-W237 HydrophobicContact CG-CZ2 4.32Å; L174-L255 HydrophobicContact CD1-CD2 3.99Å
175	G	94.9	Very high	96.8	Very high	15 Å²	15	44.4 Å²	44.4	16%	0.155	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.2	0.3	-176.7	0	0	0	0	0	113.8	E133 K179	E133-G175 PolarHBondContact OE1-N 3.38Å; E133-G175 PolarHBondContact OE2-N 2.88Å; G175-K179 WeakPolarHBondContact O-CD 3.4Å; G175-K179 WeakPolarHBondContact O-CE 3.4Å; G175-K179 PolarHBondContact O-NZ 3.35Å
176	E	93.8	Very high	96.8	Very high	80 Å²	80	44.3 Å²	44.3	37%	0.374	22%	0.215	S	C	.	.	S	Bend	trans	-71.1	-51.1	-178.7	-173.7	178.4	172.1	0	0	111.8	E133 S172 V173 K179	E133-E176 PolarHBondContact OE1-N 3.12Å; S172-E176 PolarHBondContact N-OE2 3.49Å; V173-E176 WeakPolarHBondContact O-CB 3.17Å; E176-K179 WeakPolarHBondContact O-CE 3.25Å; E176-K179 PolarHBondContact O-NZ 2.9Å
177	Q	94	Very high	96.8	Very high	106 Å²	106	47.5 Å²	47.5	50%	0.495	23%	0.232	S	C	.	.	S	Bend	trans	-106.3	-32.4	-178.2	-59.3	-64.1	-27.1	0	0	111.8	E133 R168 S171 K179	E133-Q177 WeakPolarHBondContact OE1-CA 3.35Å; E133-Q177 PolarHBondContact OE1-N 2.86Å; R168-Q177 WeakPolarHBondContact O-CB 3.4Å; R168-Q177 WeakPolarHBondContact O-CG 3.42Å; S171-Q177 VanDerWaalsContact OG-CG 3.31Å; S171-Q177 WeakPolarHBondContact OG-CG 3.49Å; Q177-K179 PolarHBondContact O-N 2.97Å
178	W	95.7	Very high	96.9	Very high	23 Å²	23	46.7 Å²	46.7	9%	0.087	23%	0.234	C	C	.	.			trans	-93.6	98.8	178.6	-178.2	-98.3	0	0	0	112.6	D132 E133 I141 K180 G181	D132-W178 HydrophobicContact CB-CD2 3.72Å; D132-W178 HydrophobicContact CB-CE3 3.68Å; D132-W178 HydrophobicContact CB-CG 4.32Å; D132-W178 HydrophobicContact CB-CH2 3.94Å; D132-W178 HydrophobicContact CB-CZ2 4.03Å; D132-W178 HydrophobicContact CB-CZ3 3.78Å; D132-W178 VanDerWaalsContact OD1-CH2 3.27Å; D132-W178 WeakPolarHBondContact OD1-CH2 3.27Å; D132-W178 WeakPolarHBondContact OD1-CZ3 3.14Å; E133-W178 HydrophobicContact CB-CB 3.82Å; E133-W178 HydrophobicContact CG-CB 4.33Å; E133-W178 PolarHBondContact OE1-N 2.95Å; E133-W178 WeakPolarHBondContact OE2-CB 3.46Å; I141-W178 HydrophobicContact CG2-CG 4.48Å; W178-K180 HydrophobicContact CD2-CB 4.35Å; W178-K180 HydrophobicContact CH2-CB 4.39Å; W178-K180 HydrophobicContact CH2-CD 3.71Å; W178-K180 HydrophobicContact CH2-CG 4.44Å; W178-K180 HydrophobicContact CZ2-CB 3.73Å; W178-K180 HydrophobicContact CZ2-CD 3.9Å; W178-K180 HydrophobicContact CZ2-CG 4.26Å; W178-K180 HydrophobicContact CZ3-CD 4.1Å; W178-G181 PolarHBondContact NE1-O 3.01Å
179	K	95.6	Very high	97	Very high	145 Å²	145	50.1 Å²	50.1	63%	0.63	26%	0.256	S	S	*	.			trans	-94.2	-0.3	-177.8	-54.2	-58.4	-176.9	-177.2	0	115.1	G175 E176 Q177 G181	G175-K179 WeakPolarHBondContact O-CD 3.4Å; G175-K179 WeakPolarHBondContact O-CE 3.4Å; G175-K179 PolarHBondContact O-NZ 3.35Å; E176-K179 WeakPolarHBondContact O-CE 3.25Å; E176-K179 PolarHBondContact O-NZ 2.9Å; Q177-K179 PolarHBondContact O-N 2.97Å; K179-G181 VanDerWaalsContact C-N 3.25Å; K179-G181 PolarHBondContact O-N 3.42Å
180	K	96.6	Very high	97.1	Very high	137 Å²	137	48.5 Å²	48.5	60%	0.596	25%	0.252	S	S	*	.	S	Bend	trans	-77.2	-14.6	-178	-62.7	-176.2	-177.4	175.4	0	112.8	W178	W178-K180 HydrophobicContact CD2-CB 4.35Å; W178-K180 HydrophobicContact CH2-CB 4.39Å; W178-K180 HydrophobicContact CH2-CD 3.71Å; W178-K180 HydrophobicContact CH2-CG 4.44Å; W178-K180 HydrophobicContact CZ2-CB 3.73Å; W178-K180 HydrophobicContact CZ2-CD 3.9Å; W178-K180 HydrophobicContact CZ2-CG 4.26Å; W178-K180 HydrophobicContact CZ3-CD 4.1Å
181	G	96.8	Very high	97.1	Very high	2 Å²	2	51.3 Å²	51.3	2%	0.021	26%	0.26	C	S	.	.			trans	93.4	165.3	-178.2	0	0	0	0	0	113	W178 K179 P183 W229	W178-G181 PolarHBondContact NE1-O 3.01Å; K179-G181 VanDerWaalsContact C-N 3.25Å; K179-G181 PolarHBondContact O-N 3.42Å; G181-P183 VanDerWaalsContact O-CD 3.27Å; G181-P183 WeakPolarHBondContact O-CD 3.36Å; G181-W229 CarbonylContact C-O 3.55Å; G181-W229 WeakPolarHBondContact CA-O 3.4Å
182	V	98.6	Very high	97.2	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	119.9	176.9	177.2	0	0	0	0	108.7	I141 I184 W229 F231 W237 L255	I141-V182 HydrophobicContact CD1-CG2 4.08Å; I141-V182 HydrophobicContact CG1-CG2 4.34Å; V182-I184 HydrophobicContact CG1-CG1 4.33Å; V182-W229 HydrophobicContact CB-CE3 4.25Å; V182-W229 HydrophobicContact CG2-CE3 4.35Å; V182-W229 PolarHBondContact N-O 3.33Å; V182-W229 PolarHBondContact O-N 3.02Å; V182-F231 HydrophobicContact CG2-CD1 3.79Å; V182-F231 HydrophobicContact CG2-CE1 3.71Å; V182-W237 HydrophobicContact CG2-CZ3 4.43Å; V182-L255 HydrophobicContact CG1-CD1 4.36Å; V182-L255 HydrophobicContact CG1-CD2 4.23Å; V182-L255 HydrophobicContact CG1-CG 3.79Å; V182-L255 HydrophobicContact CG2-CD2 3.98Å; V182-L255 HydrophobicContact CG2-CG 4.37Å
183	P	98.9	Very high	97.4	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	137.7	173.1	-22.6	37.7	0	0	0	110.8	K142 L148 G181 R209 I226 L227 T253 G254	K142-P183 VanDerWaalsContact O-CD 3.31Å; K142-P183 WeakPolarHBondContact O-CD 3.45Å; K142-P183 VanDerWaalsContact O-CG 3.31Å; K142-P183 WeakPolarHBondContact O-CG 3.48Å; L148-P183 HydrophobicContact CD2-CB 3.74Å; G181-P183 VanDerWaalsContact O-CD 3.27Å; G181-P183 WeakPolarHBondContact O-CD 3.36Å; P183-R209 VanDerWaalsContact CG-NH2 3.34Å; P183-I226 HydrophobicContact CB-CG2 4.06Å; P183-L227 CarbonylContact C-O 3.54Å; P183-L227 WeakPolarHBondContact CA-O 3.35Å; P183-T253 CarbonylContact O-C 3.58Å; P183-G254 WeakPolarHBondContact O-CA 3.4Å; P183-G254 PolarHBondContact O-N 2.67Å
184	I	98.9	Very high	97.5	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	115.1	178.9	-57.1	166.9	0	0	0	107.3	V182 V186 I198 I226 L227 W229 I244 V250	V182-I184 HydrophobicContact CG1-CG1 4.33Å; I184-V186 HydrophobicContact CG2-CG1 3.93Å; I184-I198 HydrophobicContact CD1-CD1 3.55Å; I184-I226 CarbonylContact O-C 3.53Å; I184-I226 WeakPolarHBondContact O-CA 3.32Å; I184-L227 HydrophobicContact CB-CB 4.38Å; I184-L227 PolarHBondContact N-O 2.91Å; I184-L227 PolarHBondContact O-N 3.25Å; I184-W229 HydrophobicContact CD1-CB 3.88Å; I184-I244 HydrophobicContact CD1-CD1 4.31Å; I184-I244 HydrophobicContact CD1-CG2 3.93Å; I184-I244 HydrophobicContact CG1-CG2 4.42Å; I184-I244 HydrophobicContact CG2-CG2 4.18Å; I184-V250 HydrophobicContact CG2-CG1 3.9Å; I184-V250 HydrophobicContact CG2-CG2 4.12Å
185	E	98.9	Very high	97.6	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	130.1	177.1	-170.7	168.1	169.8	0	0	109.5	L148 T149 T220 N222 N224 F225 V251 E252	L148-E185 HydrophobicContact CD1-CB 4.06Å; L148-E185 HydrophobicContact CD2-CB 4.25Å; L148-E185 HydrophobicContact CG-CB 4.33Å; T149-E185 VanDerWaalsContact CB-OE2 3.23Å; T149-E185 WeakPolarHBondContact CB-OE2 3.41Å; T149-E185 VanDerWaalsContact OG1-CD 3.22Å; T149-E185 PolarHBondContact OG1-OE2 3.08Å; E185-T220 HydrophobicContact CG-CG2 4.02Å; E185-T220 WeakPolarHBondContact OE1-CB 3.45Å; E185-T220 PolarHBondContact OE1-OG1 3.08Å; E185-N222 WeakPolarHBondContact OE1-CB 3.5Å; E185-N222 PolarHBondContact OE1-ND2 3.21Å; E185-N224 HydrophobicContact CG-CB 3.48Å; E185-N224 VanDerWaalsContact CG-CB 3.48Å; E185-N224 WeakPolarHBondContact OE1-CB 3.4Å; E185-N224 PolarHBondContact OE1-ND2 2.81Å; E185-F225 CarbonylContact C-O 3.48Å; E185-F225 WeakPolarHBondContact CA-O 3.49Å; E185-V251 HydrophobicContact CB-CB 4.19Å; E185-V251 HydrophobicContact CG-CB 4.06Å; E185-V251 HydrophobicContact CG-CG1 4.35Å; E185-V251 WeakPolarHBondContact O-CB 3.33Å; E185-V251 PolarHBondContact O-N 2.92Å; E185-E252 PolarHBondContact N-O 3.45Å; E185-E252 PolarHBondContact O-N 3.29Å
186	V	98.9	Very high	97.8	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	146.4	-173.9	-58.4	0	0	0	0	111.8	I184 V194 N224 F225 L227 G249 V250	I184-V186 HydrophobicContact CG2-CG1 3.93Å; V186-V194 HydrophobicContact CG1-CB 4.41Å; V186-V194 HydrophobicContact CG1-CG1 3.87Å; V186-N224 WeakPolarHBondContact O-CB 3.31Å; V186-F225 HydrophobicContact CG2-CB 4.05Å; V186-F225 PolarHBondContact N-O 2.91Å; V186-F225 PolarHBondContact O-N 3.4Å; V186-L227 HydrophobicContact CG1-CD1 3.93Å; V186-L227 HydrophobicContact CG1-CG 4.21Å; V186-L227 HydrophobicContact CG2-CD1 4.3Å; V186-L227 HydrophobicContact CG2-CG 4.03Å; V186-G249 CarbonylContact C-O 3.59Å; V186-G249 VanDerWaalsContact CA-O 3.25Å; V186-G249 WeakPolarHBondContact CA-O 3.16Å; V186-G249 WeakPolarHBondContact CB-O 3.26Å; V186-V250 HydrophobicContact CG1-CG2 4.29Å
187	I	98.9	Very high	98	Very high	69 Å²	69	56.9 Å²	56.9	35%	0.354	28%	0.276	S	S	.	.			trans	-57.2	129.9	170	-57.1	-60.1	0	0	0	108.4	M189 A190 G249 V251	I187-M189 VanDerWaalsContact C-N 3.29Å; I187-M189 HydrophobicContact CG2-CG 3.99Å; I187-M189 PolarHBondContact O-N 2.89Å; I187-M189 VanDerWaalsContact O-N 3.11Å; I187-A190 HydrophobicContact CB-CB 4.41Å; I187-A190 WeakPolarHBondContact O-CB 3.4Å; I187-A190 PolarHBondContact O-N 3.33Å; I187-G249 PolarHBondContact N-O 2.91Å; I187-V251 HydrophobicContact CD1-CG2 3.63Å; I187-V251 HydrophobicContact CG1-CG2 4.07Å
188	P	98.8	Very high	98.2	Very high	42 Å²	42	51.9 Å²	51.9	27%	0.273	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-53.2	-39.3	-171.6	-32.9	37.7	0	0	0	114.9	A190 Y191 F225	P188-A190 PolarHBondContact O-N 3.33Å; P188-Y191 VanDerWaalsContact O-CD1 3.28Å; P188-Y191 WeakPolarHBondContact O-CD1 3.38Å; P188-F225 HydrophobicContact CB-CD1 4.31Å; P188-F225 HydrophobicContact CB-CD2 3.88Å; P188-F225 HydrophobicContact CB-CE1 4.16Å; P188-F225 HydrophobicContact CB-CE2 3.73Å; P188-F225 HydrophobicContact CB-CG 4.17Å; P188-F225 HydrophobicContact CB-CZ 3.87Å; P188-F225 HydrophobicContact CG-CD1 4.2Å; P188-F225 HydrophobicContact CG-CE1 4.29Å; P188-F225 HydrophobicContact CG-CG 4.3Å; P188-F225 HydrophobicContact CG-CZ 4.5Å
189	M	98.6	Very high	98.2	Very high	174 Å²	174	52.6 Å²	52.6	86%	0.857	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-68.2	-17.7	179.2	70.9	179.3	-70.7	0	0	114.1	I187	I187-M189 VanDerWaalsContact C-N 3.29Å; I187-M189 HydrophobicContact CG2-CG 3.99Å; I187-M189 PolarHBondContact O-N 2.89Å; I187-M189 VanDerWaalsContact O-N 3.11Å
190	A	98.7	Very high	98.3	Very high	12 Å²	12	54.8 Å²	54.8	10%	0.099	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-99.8	-1.6	-172.3	0	0	0	0	0	113.8	I187 P188 V192 P193 V194	I187-A190 HydrophobicContact CB-CB 4.41Å; I187-A190 WeakPolarHBondContact O-CB 3.4Å; I187-A190 PolarHBondContact O-N 3.33Å; P188-A190 PolarHBondContact O-N 3.33Å; A190-V192 VanDerWaalsContact C-N 3.32Å; A190-V192 PolarHBondContact O-N 2.86Å; A190-P193 WeakPolarHBondContact O-CD 3.43Å; A190-P193 VanDerWaalsContact O-CG 3.26Å; A190-P193 WeakPolarHBondContact O-CG 3.43Å; A190-V194 HydrophobicContact CB-CG2 4.01Å; A190-V194 WeakPolarHBondContact O-CB 3.41Å; A190-V194 WeakPolarHBondContact O-CG2 3.45Å; A190-V194 PolarHBondContact O-N 2.86Å
191	Y	98.7	Very high	98.3	Very high	90 Å²	90	55.9 Å²	55.9	35%	0.353	27%	0.273	S	S	.	.	H	α-helix	trans	-58.5	-40	-170.8	85.9	-86.2	0	0	0	113.6	P188 S195 L208 F225 L227	P188-Y191 VanDerWaalsContact O-CD1 3.28Å; P188-Y191 WeakPolarHBondContact O-CD1 3.38Å; Y191-S195 WeakPolarHBondContact O-CB 3.34Å; Y191-S195 PolarHBondContact O-N 2.98Å; Y191-L208 HydrophobicContact CD2-CB 4.34Å; Y191-L208 HydrophobicContact CD2-CD1 4.24Å; Y191-L208 HydrophobicContact CD2-CD2 4.01Å; Y191-L208 HydrophobicContact CD2-CG 4.44Å; Y191-L208 HydrophobicContact CE2-CD2 3.87Å; Y191-L208 HydrophobicContact CG-CD1 4.47Å; Y191-F225 HydrophobicContact CD1-CD2 4.31Å; Y191-F225 HydrophobicContact CD1-CE2 4.43Å; Y191-F225 HydrophobicContact CG-CD2 4.42Å; Y191-L227 HydrophobicContact CD2-CD2 4.47Å
192	V	98.7	Very high	98.2	Very high	64 Å²	64	58.4 Å²	58.4	39%	0.388	28%	0.284	S	S	.	.	H	α-helix	trans	-68	-56.7	177.5	179.4	0	0	0	0	112.4	A190 V194 S195 R196	A190-V192 VanDerWaalsContact C-N 3.32Å; A190-V192 PolarHBondContact O-N 2.86Å; V192-V194 VanDerWaalsContact C-N 3.31Å; V192-V194 PolarHBondContact O-N 2.88Å; V192-S195 PolarHBondContact O-N 2.69Å; V192-R196 WeakPolarHBondContact O-CG 3.39Å; V192-R196 PolarHBondContact O-N 3.08Å
193	P	98.6	Very high	98	Very high	73 Å²	73	59.8 Å²	59.8	47%	0.474	30%	0.297	S	S	.	.	H	α-helix	trans	-61.2	-38.9	179.9	20.9	-31.8	0	0	0	112.5	A190 R196 V197	A190-P193 WeakPolarHBondContact O-CD 3.43Å; A190-P193 VanDerWaalsContact O-CG 3.26Å; A190-P193 WeakPolarHBondContact O-CG 3.43Å; P193-R196 PolarHBondContact O-N 2.84Å; P193-V197 VanDerWaalsContact O-CG2 3.31Å; P193-V197 WeakPolarHBondContact O-CG2 3.33Å; P193-V197 PolarHBondContact O-N 2.97Å
194	V	98.8	Very high	97.8	Very high	1 Å²	1	60.9 Å²	60.9	1%	0.006	31%	0.309	C	S	.	.	H	α-helix	trans	-61.5	-49.4	175.8	172.6	0	0	0	0	110.9	V186 A190 V192 R196 V197 I198 L227 I247 V250	V186-V194 HydrophobicContact CG1-CB 4.41Å; V186-V194 HydrophobicContact CG1-CG1 3.87Å; A190-V194 HydrophobicContact CB-CG2 4.01Å; A190-V194 WeakPolarHBondContact O-CB 3.41Å; A190-V194 WeakPolarHBondContact O-CG2 3.45Å; A190-V194 PolarHBondContact O-N 2.86Å; V192-V194 VanDerWaalsContact C-N 3.31Å; V192-V194 PolarHBondContact O-N 2.88Å; V194-R196 VanDerWaalsContact C-N 3.31Å; V194-R196 PolarHBondContact O-N 3.14Å; V194-V197 PolarHBondContact O-N 3.27Å; V194-V197 VanDerWaalsContact O-N 3.13Å; V194-I198 HydrophobicContact CG1-CD1 3.64Å; V194-I198 HydrophobicContact CG1-CG1 4.36Å; V194-I198 WeakPolarHBondContact O-CG1 3.46Å; V194-I198 PolarHBondContact O-N 3.09Å; V194-L227 HydrophobicContact CB-CD1 4.21Å; V194-L227 HydrophobicContact CG1-CD1 3.82Å; V194-I247 HydrophobicContact CG1-CG2 4.47Å; V194-I247 HydrophobicContact CG2-CG2 4.07Å; V194-V250 HydrophobicContact CG1-CG2 3.58Å; V194-V250 HydrophobicContact CG2-CG2 4.27Å
195	S	98.6	Very high	97.7	Very high	26 Å²	26	65.1 Å²	65.1	18%	0.182	33%	0.329	C	S	.	.	H	α-helix	trans	-54.1	-46.4	176.7	165.9	0	0	0	0	112	Y191 V192 V197 I198 A199 V206	Y191-S195 WeakPolarHBondContact O-CB 3.34Å; Y191-S195 PolarHBondContact O-N 2.98Å; V192-S195 PolarHBondContact O-N 2.69Å; S195-V197 PolarHBondContact O-N 2.86Å; S195-I198 PolarHBondContact O-N 3.44Å; S195-A199 WeakPolarHBondContact O-CB 3.39Å; S195-A199 PolarHBondContact O-N 2.94Å; S195-V206 PolarHBondContact OG-O 3.25Å
196	R	98.5	Very high	97.7	Very high	187 Å²	187	66 Å²	66	71%	0.706	33%	0.334	S	S	*	.	H	α-helix	trans	-64.2	-38.8	178.3	-68.5	177.6	71.9	149	4.1	113	V192 P193 V194 K200	V192-R196 WeakPolarHBondContact O-CG 3.39Å; V192-R196 PolarHBondContact O-N 3.08Å; P193-R196 PolarHBondContact O-N 2.84Å; V194-R196 VanDerWaalsContact C-N 3.31Å; V194-R196 PolarHBondContact O-N 3.14Å; R196-K200 WeakPolarHBondContact O-CB 3.19Å; R196-K200 PolarHBondContact O-N 2.71Å
197	V	98.4	Very high	97.7	Very high	44 Å²	44	68.8 Å²	68.8	27%	0.267	35%	0.349	S	S	.	.	H	α-helix	trans	-67.7	-44.1	178.5	172.2	0	0	0	0	110.7	P193 V194 S195 K200 R201 I247	P193-V197 VanDerWaalsContact O-CG2 3.31Å; P193-V197 WeakPolarHBondContact O-CG2 3.33Å; P193-V197 PolarHBondContact O-N 2.97Å; V194-V197 PolarHBondContact O-N 3.27Å; V194-V197 VanDerWaalsContact O-N 3.13Å; S195-V197 PolarHBondContact O-N 2.86Å; V197-K200 PolarHBondContact O-N 3.39Å; V197-R201 HydrophobicContact CG1-CG 4.3Å; V197-R201 WeakPolarHBondContact O-CB 3.36Å; V197-R201 WeakPolarHBondContact O-CG 3.21Å; V197-R201 PolarHBondContact O-N 3.23Å; V197-I247 HydrophobicContact CB-CD1 4.34Å; V197-I247 HydrophobicContact CB-CG2 4.39Å; V197-I247 HydrophobicContact CG1-CD1 3.67Å; V197-I247 HydrophobicContact CG1-CG1 4.01Å; V197-I247 HydrophobicContact CG1-CG2 4.23Å
198	I	97.9	Very high	97.7	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-61.2	-55.1	178.3	-66.7	164.7	0	0	0	110	I184 V194 S195 K200 R201 F202 V206 W229 I244 I247	I184-I198 HydrophobicContact CD1-CD1 3.55Å; V194-I198 HydrophobicContact CG1-CD1 3.64Å; V194-I198 HydrophobicContact CG1-CG1 4.36Å; V194-I198 WeakPolarHBondContact O-CG1 3.46Å; V194-I198 PolarHBondContact O-N 3.09Å; S195-I198 PolarHBondContact O-N 3.44Å; I198-K200 VanDerWaalsContact C-N 3.28Å; I198-K200 PolarHBondContact O-N 2.93Å; I198-R201 PolarHBondContact O-N 2.9Å; I198-R201 VanDerWaalsContact O-N 3.14Å; I198-F202 HydrophobicContact CG2-CD2 4.27Å; I198-F202 PolarHBondContact O-N 2.74Å; I198-V206 HydrophobicContact CB-CG2 3.93Å; I198-V206 HydrophobicContact CG2-CG2 3.57Å; I198-W229 HydrophobicContact CG2-CB 4.44Å; I198-W229 HydrophobicContact CG2-CD2 3.8Å; I198-W229 HydrophobicContact CG2-CG 3.72Å; I198-I244 HydrophobicContact CD1-CG2 4.37Å; I198-I247 HydrophobicContact CG1-CD1 3.73Å
199	A	96.4	Very high	97.7	Very high	39 Å²	39	67.2 Å²	67.2	32%	0.322	34%	0.336	S	S	.	.	H	α-helix	trans	-58.4	-39.2	-179.8	0	0	0	0	0	112.3	S195 G203 V206	S195-A199 WeakPolarHBondContact O-CB 3.39Å; S195-A199 PolarHBondContact O-N 2.94Å; A199-G203 VanDerWaalsContact O-CA 3.23Å; A199-G203 WeakPolarHBondContact O-CA 3.47Å; A199-G203 PolarHBondContact O-N 3.29Å; A199-V206 HydrophobicContact CB-CG2 4.28Å
200	K	97	Very high	97.7	Very high	190 Å²	190	64.3 Å²	64.3	83%	0.826	32%	0.322	S	S	*	.	H	α-helix	trans	-68.3	-38.7	177.5	-177.8	179	177.8	-177.7	0	113.2	R196 V197 I198	R196-K200 WeakPolarHBondContact O-CB 3.19Å; R196-K200 PolarHBondContact O-N 2.71Å; V197-K200 PolarHBondContact O-N 3.39Å; I198-K200 VanDerWaalsContact C-N 3.28Å; I198-K200 PolarHBondContact O-N 2.93Å
201	R	95.6	Very high	97.6	Very high	160 Å²	160	64.8 Å²	64.8	60%	0.604	33%	0.326	S	S	*	.	H	α-helix	trans	-86.4	-35.5	-173.6	-72.5	-175.8	-178	-175.4	2.2	113.2	V197 I198	V197-R201 HydrophobicContact CG1-CG 4.3Å; V197-R201 WeakPolarHBondContact O-CB 3.36Å; V197-R201 WeakPolarHBondContact O-CG 3.21Å; V197-R201 PolarHBondContact O-N 3.23Å; I198-R201 PolarHBondContact O-N 2.9Å; I198-R201 VanDerWaalsContact O-N 3.14Å
202	F	95.2	Very high	97.5	Very high	56 Å²	56	67.5 Å²	67.5	25%	0.246	35%	0.352	C	S	.	.	H	α-helix	trans	-123.4	-1	-169.5	-51.4	-71.5	0	0	0	113.5	I198 W229 V240 A243 I244	I198-F202 HydrophobicContact CG2-CD2 4.27Å; I198-F202 PolarHBondContact O-N 2.74Å; F202-W229 HydrophobicContact CB-CH2 3.82Å; F202-W229 HydrophobicContact CB-CZ2 3.37Å; F202-W229 HydrophobicContact CG-CH2 4.35Å; F202-W229 HydrophobicContact CG-CZ2 4.3Å; F202-V240 HydrophobicContact CD1-CG2 4.3Å; F202-V240 HydrophobicContact CE1-CG2 4.34Å; F202-A243 HydrophobicContact CE1-CB 4.26Å; F202-A243 HydrophobicContact CZ-CB 3.64Å; F202-I244 HydrophobicContact CD2-CD1 4.39Å; F202-I244 HydrophobicContact CD2-CG1 4.07Å; F202-I244 HydrophobicContact CE2-CD1 4.38Å; F202-I244 HydrophobicContact CE2-CG1 3.6Å; F202-I244 HydrophobicContact CZ-CG1 4.19Å
203	G	94.9	Very high	97.3	Very high	28 Å²	28	70.5 Å²	70.5	29%	0.289	38%	0.375	S	S	.	.			trans	70.1	-165.2	-176.2	0	0	0	0	0	113.3	A199 W229	A199-G203 VanDerWaalsContact O-CA 3.23Å; A199-G203 WeakPolarHBondContact O-CA 3.47Å; A199-G203 PolarHBondContact O-N 3.29Å; G203-W229 PolarHBondContact O-NE1 3.4Å
204	G	95.2	Very high	97.2	Very high	24 Å²	24	71.8 Å²	71.8	25%	0.247	37%	0.373	C	S	.	.	S	Bend	trans	71.6	-170.4	179.6	0	0	0	0	0	115.1	K230	G204-K230 CarbonylContact C-O 3.41Å; G204-K230 VanDerWaalsContact CA-O 3.23Å; G204-K230 WeakPolarHBondContact CA-O 3.31Å
205	E	97.1	Very high	97.1	Very high	89 Å²	89	76.4 Å²	76.4	42%	0.416	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	127	-174.3	-168.3	-165.5	175.5	0	0	110.4	N207 W229 K230	E205-N207 WeakPolarHBondContact CG-ND2 3.5Å; E205-N207 PolarHBondContact OE1-ND2 3.12Å; E205-N207 PolarHBondContact OE1-OD1 2.78Å; E205-N207 PolarHBondContact OE2-ND2 2.78Å; E205-W229 CarbonylContact O-C 3.57Å; E205-W229 WeakPolarHBondContact O-CA 3.42Å; E205-K230 HydrophobicContact CB-CB 4.33Å; E205-K230 PolarHBondContact N-O 3.11Å; E205-K230 PolarHBondContact O-N 3.14Å; E205-K230 WeakPolarHBondContact OE2-CD 3.27Å; E205-K230 IonicContact OE2-NZ 2.6Å; E205-K230 PolarHBondContact OE2-NZ 3.22Å
206	V	98.4	Very high	97.1	Very high	18 Å²	18	76.5 Å²	76.5	11%	0.109	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	109.8	179.6	-173	0	0	0	0	110.1	S195 I198 A199 L227 W229	S195-V206 PolarHBondContact OG-O 3.25Å; I198-V206 HydrophobicContact CB-CG2 3.93Å; I198-V206 HydrophobicContact CG2-CG2 3.57Å; A199-V206 HydrophobicContact CB-CG2 4.28Å; V206-L227 HydrophobicContact CG1-CB 3.84Å; V206-L227 HydrophobicContact CG1-CD1 3.91Å; V206-L227 HydrophobicContact CG1-CD2 4.39Å; V206-L227 HydrophobicContact CG1-CG 4.26Å; V206-W229 HydrophobicContact CG2-CB 4.23Å; V206-W229 VanDerWaalsContact CG2-CD1 3.41Å; V206-W229 HydrophobicContact CG2-CG 4.04Å
207	N	98.4	Very high	97.1	Very high	58 Å²	58	68.8 Å²	68.8	31%	0.31	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	138.4	-174.8	-73.6	-54.3	0	0	0	112.4	E205 R209 L227 D228	E205-N207 WeakPolarHBondContact CG-ND2 3.5Å; E205-N207 PolarHBondContact OE1-ND2 3.12Å; E205-N207 PolarHBondContact OE1-OD1 2.78Å; E205-N207 PolarHBondContact OE2-ND2 2.78Å; N207-R209 PolarHBondContact O-N 3.34Å; N207-L227 CarbonylContact O-C 3.37Å; N207-L227 VanDerWaalsContact O-CA 3.27Å; N207-L227 WeakPolarHBondContact O-CA 3.33Å; N207-D228 PolarHBondContact N-O 3.03Å; N207-D228 PolarHBondContact O-N 3.44Å
208	L	98.8	Very high	97.1	Very high	43 Å²	43	68.4 Å²	68.4	23%	0.225	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	124.5	166.9	179.5	64	0	0	0	109.3	Y191 M210 P217 F225 L227	Y191-L208 HydrophobicContact CD2-CB 4.34Å; Y191-L208 HydrophobicContact CD2-CD1 4.24Å; Y191-L208 HydrophobicContact CD2-CD2 4.01Å; Y191-L208 HydrophobicContact CD2-CG 4.44Å; Y191-L208 HydrophobicContact CE2-CD2 3.87Å; Y191-L208 HydrophobicContact CG-CD1 4.47Å; L208-M210 HydrophobicContact CD2-SD 4.36Å; L208-M210 HydrophobicContact CG-SD 4.38Å; L208-M210 PolarHBondContact O-N 3.5Å; L208-M210 VanDerWaalsContact O-N 3.16Å; L208-P217 HydrophobicContact CD1-CB 4.06Å; L208-P217 HydrophobicContact CD2-CB 3.93Å; L208-P217 HydrophobicContact CD2-CG 4.37Å; L208-P217 HydrophobicContact CG-CB 3.99Å; L208-F225 HydrophobicContact CD1-CB 3.91Å; L208-F225 HydrophobicContact CD1-CD2 3.97Å; L208-F225 HydrophobicContact CD1-CG 4.12Å; L208-L227 HydrophobicContact CB-CD2 4.28Å; L208-L227 HydrophobicContact CD1-CD2 4.18Å
209	R	98.7	Very high	97.1	Very high	36 Å²	36	71.7 Å²	71.7	14%	0.136	41%	0.409	C	S	.	.			trans	-69.8	112.5	179.9	-168.1	-178.3	-73.5	178.6	0.3	110.5	G143 G144 P183 N207 P217 V218 I226 D228	G143-R209 PolarHBondContact O-NH1 2.88Å; G143-R209 PolarHBondContact O-NH2 3.4Å; G144-R209 PolarHBondContact O-NH1 2.7Å; P183-R209 VanDerWaalsContact CG-NH2 3.34Å; N207-R209 PolarHBondContact O-N 3.34Å; R209-P217 WeakPolarHBondContact O-CA 3.34Å; R209-V218 HydrophobicContact CB-CB 4.47Å; R209-V218 HydrophobicContact CB-CG2 4.39Å; R209-V218 HydrophobicContact CG-CB 4.37Å; R209-V218 HydrophobicContact CG-CG2 3.82Å; R209-V218 PolarHBondContact O-N 2.89Å; R209-I226 HydrophobicContact CB-CB 4.08Å; R209-I226 HydrophobicContact CB-CG2 4.35Å; R209-I226 WeakPolarHBondContact CB-O 3.48Å; R209-I226 PolarHBondContact N-O 2.95Å; R209-D228 WeakPolarHBondContact CB-OD2 3.35Å; R209-D228 WeakPolarHBondContact CG-OD2 3.31Å; R209-D228 IonicContact CZ-OD1 2.66Å; R209-D228 IonicContact CZ-OD2 3.71Å; R209-D228 IonicContact NE-OD1 2.78Å; R209-D228 PolarHBondContact NE-OD1 3.49Å; R209-D228 IonicContact NE-OD2 3.37Å; R209-D228 PolarHBondContact NE-OD2 3.13Å; R209-D228 IonicContact NH2-OD1 3.31Å; R209-D228 PolarHBondContact NH2-OD1 3.34Å; R209-D228 IonicContact NH2-OD2 2.84Å
210	M	98.4	Very high	97.2	Very high	112 Å²	112	70.3 Å²	70.3	55%	0.552	40%	0.396	S	S	*	.	B	Isolated β-bridge	trans	-83.1	139.6	176.3	-59.7	-52.9	-67.7	0	0	111.3	L208 G216	L208-M210 HydrophobicContact CD2-SD 4.36Å; L208-M210 HydrophobicContact CG-SD 4.38Å; L208-M210 PolarHBondContact O-N 3.5Å; L208-M210 VanDerWaalsContact O-N 3.16Å; M210-G216 WeakPolarHBondContact CE-O 3.25Å
211	A	97.8	Very high	97.3	Very high	23 Å²	23	65.2 Å²	65.2	19%	0.19	38%	0.378	C	S	.	.			trans	-79	148.7	177.9	0	0	0	0	0	111.5	K214 G216 V218	A211-K214 HydrophobicContact CB-CD 3.96Å; A211-K214 HydrophobicContact CB-CG 3.27Å; A211-G216 WeakPolarHBondContact CB-O 3.33Å; A211-G216 PolarHBondContact N-O 2.98Å; A211-V218 HydrophobicContact CB-CG2 3.98Å
212	V	96	Very high	97.4	Very high	147 Å²	147	60.3 Å²	60.3	89%	0.891	36%	0.364	S	S	*	.	S	Bend	trans	-91.2	-42.3	177.2	179.7	0	0	0	0	111.2
213	S	95.2	Very high	97.6	Very high	127 Å²	127	61.8 Å²	61.8	89%	0.888	38%	0.381	S	S	*	.	S	Bend	trans	-96.3	13.4	-175.4	-52.8	0	0	0	0	114.1
214	K	96.4	Very high	97.8	Very high	99 Å²	99	61.3 Å²	61.3	43%	0.43	37%	0.372	S	S	.	.	S	Bend	trans	-151.1	158.4	168.8	61	168.1	-74.4	-145.5	0	109.5	A211 P217	A211-K214 HydrophobicContact CB-CD 3.96Å; A211-K214 HydrophobicContact CB-CG 3.27Å; K214-P217 PolarHBondContact NZ-O 2.72Å
215	A	96.9	Very high	97.9	Very high	98 Å²	98	62 Å²	62	81%	0.81	37%	0.368	S	S	*	.	S	Bend	trans	-71.5	141	167.7	0	0	0	0	0	110.8
216	G	98.1	Very high	98	Very high	29 Å²	29	57.7 Å²	57.7	30%	0.299	35%	0.348	S	S	.	.	S	Bend	trans	90.2	-167.4	177.6	0	0	0	0	0	114.4	M210 A211	M210-G216 WeakPolarHBondContact CE-O 3.25Å; A211-G216 WeakPolarHBondContact CB-O 3.33Å; A211-G216 PolarHBondContact N-O 2.98Å
217	P	98.3	Very high	98	Very high	25 Å²	25	56.9 Å²	56.9	16%	0.162	34%	0.343	C	S	.	.	B	Isolated β-bridge	trans	-70.8	157.4	-176.5	27.3	-34	0	0	0	113.2	L208 R209 K214 F225	L208-P217 HydrophobicContact CD1-CB 4.06Å; L208-P217 HydrophobicContact CD2-CB 3.93Å; L208-P217 HydrophobicContact CD2-CG 4.37Å; L208-P217 HydrophobicContact CG-CB 3.99Å; R209-P217 WeakPolarHBondContact O-CA 3.34Å; K214-P217 PolarHBondContact NZ-O 2.72Å; P217-F225 HydrophobicContact CB-CD1 4.08Å; P217-F225 HydrophobicContact CB-CE1 4.06Å; P217-F225 HydrophobicContact CB-CG 4.36Å; P217-F225 HydrophobicContact CB-CZ 4.3Å; P217-F225 HydrophobicContact CG-CD1 3.93Å; P217-F225 HydrophobicContact CG-CD2 4.36Å; P217-F225 HydrophobicContact CG-CE1 3.4Å; P217-F225 HydrophobicContact CG-CE2 3.87Å; P217-F225 HydrophobicContact CG-CG 4.4Å; P217-F225 HydrophobicContact CG-CZ 3.36Å
218	V	98.4	Very high	98.1	Very high	35 Å²	35	55.1 Å²	55.1	21%	0.212	33%	0.334	C	S	.	.			trans	-58.3	138	164.1	171.6	0	0	0	0	109	R209 A211 F225 I226	R209-V218 HydrophobicContact CB-CB 4.47Å; R209-V218 HydrophobicContact CB-CG2 4.39Å; R209-V218 HydrophobicContact CG-CB 4.37Å; R209-V218 HydrophobicContact CG-CG2 3.82Å; R209-V218 PolarHBondContact O-N 2.89Å; A211-V218 HydrophobicContact CB-CG2 3.98Å; V218-F225 WeakPolarHBondContact O-CD1 3.39Å; V218-I226 HydrophobicContact CG1-CD1 4.1Å
219	V	98.4	Very high	98.1	Very high	69 Å²	69	53.1 Å²	53.1	42%	0.418	32%	0.323	S	S	.	.			trans	-117.5	124.2	171.9	177.6	0	0	0	0	106.8	N224 F225	V219-N224 CarbonylContact C-O 3.55Å; V219-N224 VanDerWaalsContact CA-O 3.3Å; V219-N224 WeakPolarHBondContact CA-O 3.39Å; V219-F225 HydrophobicContact CG2-CD1 4.37Å; V219-F225 HydrophobicContact CG2-CE1 4.07Å
220	T	98.8	Very high	98	Very high	10 Å²	10	55.4 Å²	55.4	6%	0.061	33%	0.334	C	S	.	.			trans	-72.4	168.5	179.7	67.1	0	0	0	0	111.5	E185 N222 S223 N224 I226	E185-T220 HydrophobicContact CG-CG2 4.02Å; E185-T220 WeakPolarHBondContact OE1-CB 3.45Å; E185-T220 PolarHBondContact OE1-OG1 3.08Å; T220-N222 PolarHBondContact O-N 2.55Å; T220-N222 VanDerWaalsContact O-N 3.08Å; T220-N222 PolarHBondContact OG1-N 2.92Å; T220-S223 PolarHBondContact O-N 3.05Å; T220-N224 PolarHBondContact N-O 3.4Å; T220-N224 PolarHBondContact OG1-N 2.74Å; T220-N224 VanDerWaalsContact OG1-N 3.09Å; T220-I226 HydrophobicContact CG2-CD1 3.75Å; T220-I226 HydrophobicContact CG2-CG1 3.57Å
221	D	97.9	Very high	97.9	Very high	84 Å²	84	51.6 Å²	51.6	45%	0.449	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-21.7	170.4	-71.6	-4.2	0	0	0	112.1	F102	F102-D221 PolarHBondContact N-OD2 3.05Å; F102-D221 VanDerWaalsContact N-OD2 3.16Å
222	N	98.5	Very high	97.4	Very high	57 Å²	57	57.6 Å²	57.6	31%	0.305	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	15.4	175.9	-40.4	-62.2	0	0	0	113.2	Q150 E185 T220 N224	Q150-N222 PolarHBondContact NE2-OD1 3.15Å; E185-N222 WeakPolarHBondContact OE1-CB 3.5Å; E185-N222 PolarHBondContact OE1-ND2 3.21Å; T220-N222 PolarHBondContact O-N 2.55Å; T220-N222 VanDerWaalsContact O-N 3.08Å; T220-N222 PolarHBondContact OG1-N 2.92Å; N222-N224 VanDerWaalsContact C-N 3.28Å; N222-N224 PolarHBondContact O-N 2.7Å; N222-N224 PolarHBondContact O-ND2 3.03Å
223	S	98.4	Very high	96.6	Very high	87 Å²	87	57.2 Å²	57.2	61%	0.608	33%	0.332	S	S	*	.	S	Bend	trans	64.4	22.8	179.1	-55.8	0	0	0	0	115.8	T220	T220-S223 PolarHBondContact O-N 3.05Å
224	N	98.9	Very high	95.5	Very high	17 Å²	17	52.8 Å²	52.8	9%	0.091	30%	0.299	C	S	.	.			trans	-103.4	170.6	-179.1	-65.4	-50	0	0	0	112.7	E185 V186 V219 T220 N222	E185-N224 HydrophobicContact CG-CB 3.48Å; E185-N224 VanDerWaalsContact CG-CB 3.48Å; E185-N224 WeakPolarHBondContact OE1-CB 3.4Å; E185-N224 PolarHBondContact OE1-ND2 2.81Å; V186-N224 WeakPolarHBondContact O-CB 3.31Å; V219-N224 CarbonylContact C-O 3.55Å; V219-N224 VanDerWaalsContact CA-O 3.3Å; V219-N224 WeakPolarHBondContact CA-O 3.39Å; T220-N224 PolarHBondContact N-O 3.4Å; T220-N224 PolarHBondContact OG1-N 2.74Å; T220-N224 VanDerWaalsContact OG1-N 3.09Å; N222-N224 VanDerWaalsContact C-N 3.28Å; N222-N224 PolarHBondContact O-N 2.7Å; N222-N224 PolarHBondContact O-ND2 3.03Å
225	F	98.9	Very high	94.3	Very high	38 Å²	38	56.8 Å²	56.8	17%	0.167	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	164	169.6	-70	-12.6	0	0	0	111.2	E185 V186 P188 Y191 L208 P217 V218 V219	E185-F225 CarbonylContact C-O 3.48Å; E185-F225 WeakPolarHBondContact CA-O 3.49Å; V186-F225 HydrophobicContact CG2-CB 4.05Å; V186-F225 PolarHBondContact N-O 2.91Å; V186-F225 PolarHBondContact O-N 3.4Å; P188-F225 HydrophobicContact CB-CD1 4.31Å; P188-F225 HydrophobicContact CB-CD2 3.88Å; P188-F225 HydrophobicContact CB-CE1 4.16Å; P188-F225 HydrophobicContact CB-CE2 3.73Å; P188-F225 HydrophobicContact CB-CG 4.17Å; P188-F225 HydrophobicContact CB-CZ 3.87Å; P188-F225 HydrophobicContact CG-CD1 4.2Å; P188-F225 HydrophobicContact CG-CE1 4.29Å; P188-F225 HydrophobicContact CG-CG 4.3Å; P188-F225 HydrophobicContact CG-CZ 4.5Å; Y191-F225 HydrophobicContact CD1-CD2 4.31Å; Y191-F225 HydrophobicContact CD1-CE2 4.43Å; Y191-F225 HydrophobicContact CG-CD2 4.42Å; L208-F225 HydrophobicContact CD1-CB 3.91Å; L208-F225 HydrophobicContact CD1-CD2 3.97Å; L208-F225 HydrophobicContact CD1-CG 4.12Å; P217-F225 HydrophobicContact CB-CD1 4.08Å; P217-F225 HydrophobicContact CB-CE1 4.06Å; P217-F225 HydrophobicContact CB-CG 4.36Å; P217-F225 HydrophobicContact CB-CZ 4.3Å; P217-F225 HydrophobicContact CG-CD1 3.93Å; P217-F225 HydrophobicContact CG-CD2 4.36Å; P217-F225 HydrophobicContact CG-CE1 3.4Å; P217-F225 HydrophobicContact CG-CE2 3.87Å; P217-F225 HydrophobicContact CG-CG 4.4Å; P217-F225 HydrophobicContact CG-CZ 3.36Å; V218-F225 WeakPolarHBondContact O-CD1 3.39Å; V219-F225 HydrophobicContact CG2-CD1 4.37Å; V219-F225 HydrophobicContact CG2-CE1 4.07Å
226	I	98.9	Very high	94.1	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	130.1	172.8	-57.9	176.9	0	0	0	109.3	G146 P183 I184 R209 V218 T220	G146-I226 VanDerWaalsContact CA-CD1 3.41Å; P183-I226 HydrophobicContact CB-CG2 4.06Å; I184-I226 CarbonylContact O-C 3.53Å; I184-I226 WeakPolarHBondContact O-CA 3.32Å; R209-I226 HydrophobicContact CB-CB 4.08Å; R209-I226 HydrophobicContact CB-CG2 4.35Å; R209-I226 WeakPolarHBondContact CB-O 3.48Å; R209-I226 PolarHBondContact N-O 2.95Å; V218-I226 HydrophobicContact CG1-CD1 4.1Å; T220-I226 HydrophobicContact CG2-CD1 3.75Å; T220-I226 HydrophobicContact CG2-CG1 3.57Å
227	L	98.9	Very high	94	Very high	1 Å²	1	55.3 Å²	55.3	1%	0.005	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	135.4	162.9	-60.6	178.2	0	0	0	109.4	P183 I184 V186 Y191 V194 V206 N207 L208	P183-L227 CarbonylContact C-O 3.54Å; P183-L227 WeakPolarHBondContact CA-O 3.35Å; I184-L227 HydrophobicContact CB-CB 4.38Å; I184-L227 PolarHBondContact N-O 2.91Å; I184-L227 PolarHBondContact O-N 3.25Å; V186-L227 HydrophobicContact CG1-CD1 3.93Å; V186-L227 HydrophobicContact CG1-CG 4.21Å; V186-L227 HydrophobicContact CG2-CD1 4.3Å; V186-L227 HydrophobicContact CG2-CG 4.03Å; Y191-L227 HydrophobicContact CD2-CD2 4.47Å; V194-L227 HydrophobicContact CB-CD1 4.21Å; V194-L227 HydrophobicContact CG1-CD1 3.82Å; V206-L227 HydrophobicContact CG1-CB 3.84Å; V206-L227 HydrophobicContact CG1-CD1 3.91Å; V206-L227 HydrophobicContact CG1-CD2 4.39Å; V206-L227 HydrophobicContact CG1-CG 4.26Å; N207-L227 CarbonylContact O-C 3.37Å; N207-L227 VanDerWaalsContact O-CA 3.27Å; N207-L227 WeakPolarHBondContact O-CA 3.33Å; L208-L227 HydrophobicContact CB-CD2 4.28Å; L208-L227 HydrophobicContact CD1-CD2 4.18Å
228	D	98.8	Very high	93.9	Very high	21 Å²	21	56.5 Å²	56.5	11%	0.112	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	108.9	170.8	-72.4	-49.8	0	0	0	108.6	N207 R209	N207-D228 PolarHBondContact N-O 3.03Å; N207-D228 PolarHBondContact O-N 3.44Å; R209-D228 WeakPolarHBondContact CB-OD2 3.35Å; R209-D228 WeakPolarHBondContact CG-OD2 3.31Å; R209-D228 IonicContact CZ-OD1 2.66Å; R209-D228 IonicContact CZ-OD2 3.71Å; R209-D228 IonicContact NE-OD1 2.78Å; R209-D228 PolarHBondContact NE-OD1 3.49Å; R209-D228 IonicContact NE-OD2 3.37Å; R209-D228 PolarHBondContact NE-OD2 3.13Å; R209-D228 IonicContact NH2-OD1 3.31Å; R209-D228 PolarHBondContact NH2-OD1 3.34Å; R209-D228 IonicContact NH2-OD2 2.84Å
229	W	98.6	Very high	93.8	Very high	1 Å²	1	61.2 Å²	61.2	0%	0.004	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	104.5	179.3	175.5	43.8	0	0	0	111.3	G181 V182 I184 I198 F202 G203 E205 V206 F231 V234 V240 I244	G181-W229 CarbonylContact C-O 3.55Å; G181-W229 WeakPolarHBondContact CA-O 3.4Å; V182-W229 HydrophobicContact CB-CE3 4.25Å; V182-W229 HydrophobicContact CG2-CE3 4.35Å; V182-W229 PolarHBondContact N-O 3.33Å; V182-W229 PolarHBondContact O-N 3.02Å; I184-W229 HydrophobicContact CD1-CB 3.88Å; I198-W229 HydrophobicContact CG2-CB 4.44Å; I198-W229 HydrophobicContact CG2-CD2 3.8Å; I198-W229 HydrophobicContact CG2-CG 3.72Å; F202-W229 HydrophobicContact CB-CH2 3.82Å; F202-W229 HydrophobicContact CB-CZ2 3.37Å; F202-W229 HydrophobicContact CG-CH2 4.35Å; F202-W229 HydrophobicContact CG-CZ2 4.3Å; G203-W229 PolarHBondContact O-NE1 3.4Å; E205-W229 CarbonylContact O-C 3.57Å; E205-W229 WeakPolarHBondContact O-CA 3.42Å; V206-W229 HydrophobicContact CG2-CB 4.23Å; V206-W229 VanDerWaalsContact CG2-CD1 3.41Å; V206-W229 HydrophobicContact CG2-CG 4.04Å; W229-F231 HydrophobicContact CD2-CB 4.19Å; W229-F231 HydrophobicContact CE3-CB 4.35Å; W229-F231 HydrophobicContact CH2-CB 3.74Å; W229-F231 HydrophobicContact CZ2-CB 3.53Å; W229-F231 HydrophobicContact CZ3-CB 4.14Å; W229-F231 PolarHBondContact O-N 3.5Å; W229-V234 HydrophobicContact CH2-CG2 4.07Å; W229-V240 HydrophobicContact CH2-CG1 3.83Å; W229-V240 HydrophobicContact CZ3-CG1 3.65Å; W229-I244 HydrophobicContact CE3-CD1 3.72Å; W229-I244 HydrophobicContact CH2-CD1 4.31Å; W229-I244 HydrophobicContact CZ3-CD1 3.58Å
230	K	97.6	Very high	93.7	Very high	83 Å²	83	58.6 Å²	58.6	36%	0.361	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	100.2	169.8	-57.4	-178.6	-162	154.4	0	108.3	G204 E205	G204-K230 CarbonylContact C-O 3.41Å; G204-K230 VanDerWaalsContact CA-O 3.23Å; G204-K230 WeakPolarHBondContact CA-O 3.31Å; E205-K230 HydrophobicContact CB-CB 4.33Å; E205-K230 PolarHBondContact N-O 3.11Å; E205-K230 PolarHBondContact O-N 3.14Å; E205-K230 WeakPolarHBondContact OE2-CD 3.27Å; E205-K230 IonicContact OE2-NZ 2.6Å; E205-K230 PolarHBondContact OE2-NZ 3.22Å
231	F	95.2	Very high	93.7	Very high	33 Å²	33	59.5 Å²	59.5	15%	0.145	31%	0.306	C	S	.	.			trans	-77.1	160.4	175.2	58.5	-88.5	0	0	0	111.1	I141 L174 V182 W229 V234 W237	I141-F231 HydrophobicContact CD1-CE1 4.05Å; I141-F231 HydrophobicContact CD1-CZ 4.34Å; L174-F231 HydrophobicContact CB-CZ 4.34Å; V182-F231 HydrophobicContact CG2-CD1 3.79Å; V182-F231 HydrophobicContact CG2-CE1 3.71Å; W229-F231 HydrophobicContact CD2-CB 4.19Å; W229-F231 HydrophobicContact CE3-CB 4.35Å; W229-F231 HydrophobicContact CH2-CB 3.74Å; W229-F231 HydrophobicContact CZ2-CB 3.53Å; W229-F231 HydrophobicContact CZ3-CB 4.14Å; W229-F231 PolarHBondContact O-N 3.5Å; F231-V234 HydrophobicContact CB-CG2 3.84Å; F231-V234 HydrophobicContact CD2-CG2 3.72Å; F231-V234 HydrophobicContact CG-CG2 3.92Å; F231-W237 AromaticContact CD1-CH2 3.94Å; F231-W237 HydrophobicContact CD1-CH2 3.94Å; F231-W237 AromaticContact CD2-CH2 3.84Å; F231-W237 HydrophobicContact CD2-CH2 3.84Å; F231-W237 HydrophobicContact CD2-CZ2 4.41Å; F231-W237 AromaticContact CE1-CH2 3.72Å; F231-W237 HydrophobicContact CE1-CH2 3.72Å; F231-W237 AromaticContact CE2-CH2 3.59Å; F231-W237 HydrophobicContact CE2-CH2 3.59Å; F231-W237 AromaticContact CE2-CZ2 3.84Å; F231-W237 HydrophobicContact CE2-CZ2 3.84Å; F231-W237 AromaticContact CG-CH2 4Å; F231-W237 HydrophobicContact CG-CH2 4Å; F231-W237 AromaticContact CZ-CH2 3.52Å; F231-W237 HydrophobicContact CZ-CH2 3.52Å; F231-W237 AromaticContact CZ-CZ2 3.89Å; F231-W237 HydrophobicContact CZ-CZ2 3.89Å
232	E	87.3	Confident	93.7	Very high	149 Å²	149	59.2 Å²	59.2	70%	0.696	31%	0.307	S	S	*	.	S	Bend	trans	-104.4	-78.7	174.8	-67.5	173	-176.9	0	0	109.1
233	D	80.6	Confident	93.7	Very high	139 Å²	139	58.1 Å²	58.1	74%	0.743	31%	0.306	S	S	*	.			trans	-111.9	125.2	177.1	-69	-42.2	0	0	0	110.7
234	V	72.4	Confident	93.7	Very high	34 Å²	34	54 Å²	54	21%	0.206	28%	0.277	C	S	.	.			trans	-124.4	128.2	174.7	177.3	0	0	0	0	110.4	W229 F231 W237 V240	W229-V234 HydrophobicContact CH2-CG2 4.07Å; F231-V234 HydrophobicContact CB-CG2 3.84Å; F231-V234 HydrophobicContact CD2-CG2 3.72Å; F231-V234 HydrophobicContact CG-CG2 3.92Å; V234-W237 HydrophobicContact CB-CE3 4.47Å; V234-W237 HydrophobicContact CB-CH2 3.65Å; V234-W237 HydrophobicContact CB-CZ2 3.74Å; V234-W237 HydrophobicContact CB-CZ3 4.05Å; V234-W237 HydrophobicContact CG1-CD2 3.78Å; V234-W237 HydrophobicContact CG1-CE3 3.67Å; V234-W237 HydrophobicContact CG1-CH2 3.78Å; V234-W237 HydrophobicContact CG1-CZ2 3.87Å; V234-W237 HydrophobicContact CG1-CZ3 3.69Å; V234-W237 HydrophobicContact CG2-CH2 3.55Å; V234-W237 HydrophobicContact CG2-CZ2 4.15Å; V234-W237 HydrophobicContact CG2-CZ3 3.85Å; V234-V240 HydrophobicContact CG1-CB 4.49Å; V234-V240 HydrophobicContact CG1-CG2 3.88Å
235	Q	69.9	Low	93.7	Very high	183 Å²	183	56.7 Å²	56.7	86%	0.855	29%	0.288	S	S	*	.	S	Bend	trans	-95.7	-36.1	-176.2	-60.4	-63.1	-49.8	0	0	112.7
236	N	93.3	Very high	93.6	Very high	62 Å²	62	61.8 Å²	61.8	33%	0.332	31%	0.314	S	S	.	.			trans	-145.6	107.6	-176.4	-173.9	-23.5	0	0	0	111.8	S238 E239 V240	N236-S238 VanDerWaalsContact C-N 3.32Å; N236-S238 PolarHBondContact O-N 2.96Å; N236-S238 WeakPolarHBondContact OD1-CB 3.45Å; N236-S238 PolarHBondContact OD1-N 3.23Å; N236-E239 HydrophobicContact CB-CB 4.17Å; N236-E239 HydrophobicContact CB-CG 4.32Å; N236-E239 VanDerWaalsContact ND2-CD 3.29Å; N236-E239 PolarHBondContact ND2-OE1 3Å; N236-E239 PolarHBondContact O-N 2.86Å; N236-E239 PolarHBondContact OD1-N 2.92Å; N236-V240 WeakPolarHBondContact O-CB 3.41Å; N236-V240 WeakPolarHBondContact O-CG2 3.27Å; N236-V240 PolarHBondContact O-N 3.45Å
237	W	96.2	Very high	93.6	Very high	33 Å²	33	62.3 Å²	62.3	13%	0.125	32%	0.317	C	S	.	.	H	α-helix	trans	-64.9	-31.4	-179.3	-70	121.9	0	0	0	114.1	T139 L174 V182 F231 V234 N241 L255 V257	T139-W237 HydrophobicContact CG2-CB 3.97Å; T139-W237 HydrophobicContact CG2-CG 4.1Å; L174-W237 HydrophobicContact CB-CH2 4.33Å; L174-W237 HydrophobicContact CB-CZ2 3.53Å; L174-W237 HydrophobicContact CD1-CD2 3.95Å; L174-W237 HydrophobicContact CD1-CE3 4.49Å; L174-W237 HydrophobicContact CD1-CG 4.28Å; L174-W237 HydrophobicContact CD1-CZ2 4.05Å; L174-W237 HydrophobicContact CG-CZ2 4.32Å; V182-W237 HydrophobicContact CG2-CZ3 4.43Å; F231-W237 AromaticContact CD1-CH2 3.94Å; F231-W237 HydrophobicContact CD1-CH2 3.94Å; F231-W237 AromaticContact CD2-CH2 3.84Å; F231-W237 HydrophobicContact CD2-CH2 3.84Å; F231-W237 HydrophobicContact CD2-CZ2 4.41Å; F231-W237 AromaticContact CE1-CH2 3.72Å; F231-W237 HydrophobicContact CE1-CH2 3.72Å; F231-W237 AromaticContact CE2-CH2 3.59Å; F231-W237 HydrophobicContact CE2-CH2 3.59Å; F231-W237 AromaticContact CE2-CZ2 3.84Å; F231-W237 HydrophobicContact CE2-CZ2 3.84Å; F231-W237 AromaticContact CG-CH2 4Å; F231-W237 HydrophobicContact CG-CH2 4Å; F231-W237 AromaticContact CZ-CH2 3.52Å; F231-W237 HydrophobicContact CZ-CH2 3.52Å; F231-W237 AromaticContact CZ-CZ2 3.89Å; F231-W237 HydrophobicContact CZ-CZ2 3.89Å; V234-W237 HydrophobicContact CB-CE3 4.47Å; V234-W237 HydrophobicContact CB-CH2 3.65Å; V234-W237 HydrophobicContact CB-CZ2 3.74Å; V234-W237 HydrophobicContact CB-CZ3 4.05Å; V234-W237 HydrophobicContact CG1-CD2 3.78Å; V234-W237 HydrophobicContact CG1-CE3 3.67Å; V234-W237 HydrophobicContact CG1-CH2 3.78Å; V234-W237 HydrophobicContact CG1-CZ2 3.87Å; V234-W237 HydrophobicContact CG1-CZ3 3.69Å; V234-W237 HydrophobicContact CG2-CH2 3.55Å; V234-W237 HydrophobicContact CG2-CZ2 4.15Å; V234-W237 HydrophobicContact CG2-CZ3 3.85Å; W237-N241 WeakPolarHBondContact O-CB 3.5Å; W237-N241 PolarHBondContact O-N 3.13Å; W237-L255 HydrophobicContact CD2-CD2 4.19Å; W237-L255 HydrophobicContact CE3-CD1 3.74Å; W237-L255 HydrophobicContact CE3-CD2 3.48Å; W237-L255 VanDerWaalsContact CE3-CD2 3.48Å; W237-L255 HydrophobicContact CE3-CG 4.27Å; W237-L255 HydrophobicContact CZ3-CD1 4.09Å; W237-L255 HydrophobicContact CZ3-CD2 3.73Å; W237-V257 HydrophobicContact CB-CG2 4.2Å
238	S	95.9	Very high	93.6	Very high	51 Å²	51	67.9 Å²	67.9	36%	0.357	35%	0.353	S	S	.	.	H	α-helix	trans	-67.8	-46.8	179	-173.9	0	0	0	0	111.5	N236 T242	N236-S238 VanDerWaalsContact C-N 3.32Å; N236-S238 PolarHBondContact O-N 2.96Å; N236-S238 WeakPolarHBondContact OD1-CB 3.45Å; N236-S238 PolarHBondContact OD1-N 3.23Å; S238-T242 WeakPolarHBondContact O-CB 3.43Å; S238-T242 PolarHBondContact O-N 3.03Å; S238-T242 PolarHBondContact O-OG1 3.4Å
239	E	96.6	Very high	93.6	Very high	133 Å²	133	67.9 Å²	67.9	62%	0.621	36%	0.358	S	S	*	.	H	α-helix	trans	-65.4	-46.1	176.7	-73.7	174	-153	0	0	111.4	N236 T242 A243	N236-E239 HydrophobicContact CB-CB 4.17Å; N236-E239 HydrophobicContact CB-CG 4.32Å; N236-E239 VanDerWaalsContact ND2-CD 3.29Å; N236-E239 PolarHBondContact ND2-OE1 3Å; N236-E239 PolarHBondContact O-N 2.86Å; N236-E239 PolarHBondContact OD1-N 2.92Å; E239-T242 PolarHBondContact O-N 3.31Å; E239-A243 WeakPolarHBondContact O-CB 3.4Å; E239-A243 PolarHBondContact O-N 2.88Å
240	V	96.7	Very high	93.6	Very high	14 Å²	14	68.5 Å²	68.5	9%	0.085	36%	0.362	C	S	.	.	H	α-helix	trans	-61.8	-46.9	178.3	168.6	0	0	0	0	111.2	F202 W229 V234 N236 T242 A243 I244 L255	F202-V240 HydrophobicContact CD1-CG2 4.3Å; F202-V240 HydrophobicContact CE1-CG2 4.34Å; W229-V240 HydrophobicContact CH2-CG1 3.83Å; W229-V240 HydrophobicContact CZ3-CG1 3.65Å; V234-V240 HydrophobicContact CG1-CB 4.49Å; V234-V240 HydrophobicContact CG1-CG2 3.88Å; N236-V240 WeakPolarHBondContact O-CB 3.41Å; N236-V240 WeakPolarHBondContact O-CG2 3.27Å; N236-V240 PolarHBondContact O-N 3.45Å; V240-T242 PolarHBondContact O-N 3Å; V240-A243 PolarHBondContact O-N 3.03Å; V240-I244 HydrophobicContact CG1-CD1 3.74Å; V240-I244 HydrophobicContact CG1-CG1 4.39Å; V240-I244 WeakPolarHBondContact O-CB 3.26Å; V240-I244 WeakPolarHBondContact O-CG1 3.38Å; V240-I244 PolarHBondContact O-N 3.01Å; V240-L255 HydrophobicContact CG1-CD1 4.21Å
241	N	98	Very high	93.7	Very high	29 Å²	29	66.2 Å²	66.2	16%	0.155	36%	0.355	C	S	.	.	H	α-helix	trans	-56.1	-50.8	176.9	177.3	46.5	0	0	0	111.2	W237 I244 K245 T253 L255 V257	W237-N241 WeakPolarHBondContact O-CB 3.5Å; W237-N241 PolarHBondContact O-N 3.13Å; N241-I244 PolarHBondContact O-N 3.37Å; N241-K245 WeakPolarHBondContact O-CB 3.48Å; N241-K245 PolarHBondContact O-N 2.93Å; N241-T253 PolarHBondContact OD1-OG1 3.33Å; N241-L255 HydrophobicContact CB-CB 4.09Å; N241-L255 HydrophobicContact CB-CD1 3.96Å; N241-V257 HydrophobicContact CB-CG2 3.92Å
242	T	98.2	Very high	93.9	Very high	78 Å²	78	66.1 Å²	66.1	48%	0.479	36%	0.355	S	S	.	.	H	α-helix	trans	-62	-47.6	179.9	-57.2	0	0	0	0	111.3	S238 E239 V240 I244 K245 M246	S238-T242 WeakPolarHBondContact O-CB 3.43Å; S238-T242 PolarHBondContact O-N 3.03Å; S238-T242 PolarHBondContact O-OG1 3.4Å; E239-T242 PolarHBondContact O-N 3.31Å; V240-T242 PolarHBondContact O-N 3Å; T242-I244 PolarHBondContact O-N 2.97Å; T242-K245 PolarHBondContact O-N 2.78Å; T242-M246 HydrophobicContact CG2-CG 4.46Å; T242-M246 WeakPolarHBondContact O-CB 3.31Å; T242-M246 VanDerWaalsContact O-CG 3.25Å; T242-M246 WeakPolarHBondContact O-CG 3.42Å; T242-M246 PolarHBondContact O-N 2.84Å
243	A	98.1	Very high	94.4	Very high	34 Å²	34	59 Å²	59	28%	0.281	32%	0.322	S	S	.	.	H	α-helix	trans	-67.1	-35.8	-176.2	0	0	0	0	0	112.6	F202 E239 V240	F202-A243 HydrophobicContact CE1-CB 4.26Å; F202-A243 HydrophobicContact CZ-CB 3.64Å; E239-A243 WeakPolarHBondContact O-CB 3.4Å; E239-A243 PolarHBondContact O-N 2.88Å; V240-A243 PolarHBondContact O-N 3.03Å
244	I	98.4	Very high	95.3	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-69.5	-47.2	172.1	-68.5	176	0	0	0	110.4	I184 I198 F202 W229 V240 N241 T242 M246 I247 V250 T253	I184-I244 HydrophobicContact CD1-CD1 4.31Å; I184-I244 HydrophobicContact CD1-CG2 3.93Å; I184-I244 HydrophobicContact CG1-CG2 4.42Å; I184-I244 HydrophobicContact CG2-CG2 4.18Å; I198-I244 HydrophobicContact CD1-CG2 4.37Å; F202-I244 HydrophobicContact CD2-CD1 4.39Å; F202-I244 HydrophobicContact CD2-CG1 4.07Å; F202-I244 HydrophobicContact CE2-CD1 4.38Å; F202-I244 HydrophobicContact CE2-CG1 3.6Å; F202-I244 HydrophobicContact CZ-CG1 4.19Å; W229-I244 HydrophobicContact CE3-CD1 3.72Å; W229-I244 HydrophobicContact CH2-CD1 4.31Å; W229-I244 HydrophobicContact CZ3-CD1 3.58Å; V240-I244 HydrophobicContact CG1-CD1 3.74Å; V240-I244 HydrophobicContact CG1-CG1 4.39Å; V240-I244 WeakPolarHBondContact O-CB 3.26Å; V240-I244 WeakPolarHBondContact O-CG1 3.38Å; V240-I244 PolarHBondContact O-N 3.01Å; N241-I244 PolarHBondContact O-N 3.37Å; T242-I244 PolarHBondContact O-N 2.97Å; I244-M246 PolarHBondContact O-N 2.66Å; I244-M246 VanDerWaalsContact O-N 3.14Å; I244-I247 WeakPolarHBondContact O-CB 3.38Å; I244-I247 WeakPolarHBondContact O-CG1 3.23Å; I244-I247 PolarHBondContact O-N 3.31Å; I244-V250 HydrophobicContact CG2-CG1 4.43Å; I244-V250 HydrophobicContact CG2-CG2 4.41Å; I244-V250 WeakPolarHBondContact O-CG2 3.3Å; I244-T253 HydrophobicContact CB-CG2 4.22Å; I244-T253 HydrophobicContact CG2-CG2 3.78Å
245	K	98.6	Very high	96.6	Very high	75 Å²	75	50.8 Å²	50.8	33%	0.326	28%	0.277	S	S	.	.	H	α-helix	trans	-56.7	-31.3	179.9	-176.1	69.5	-176.9	86.4	0	112.8	N241 T242 I247 V251 E252 T253	N241-K245 WeakPolarHBondContact O-CB 3.48Å; N241-K245 PolarHBondContact O-N 2.93Å; T242-K245 PolarHBondContact O-N 2.78Å; K245-I247 VanDerWaalsContact C-N 3.34Å; K245-V251 WeakPolarHBondContact CE-O 3.28Å; K245-V251 PolarHBondContact NZ-O 2.79Å; K245-E252 VanDerWaalsContact CE-OE2 3.22Å; K245-E252 WeakPolarHBondContact CE-OE2 3.43Å; K245-T253 HydrophobicContact CB-CG2 4.37Å
246	M	98.6	Very high	97.9	Very high	145 Å²	145	42.1 Å²	42.1	71%	0.714	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-1.1	179.4	-69.4	-57.6	-63.3	0	0	114.7	T242 I244 P248	T242-M246 HydrophobicContact CG2-CG 4.46Å; T242-M246 WeakPolarHBondContact O-CB 3.31Å; T242-M246 VanDerWaalsContact O-CG 3.25Å; T242-M246 WeakPolarHBondContact O-CG 3.42Å; T242-M246 PolarHBondContact O-N 2.84Å; I244-M246 PolarHBondContact O-N 2.66Å; I244-M246 VanDerWaalsContact O-N 3.14Å; M246-P248 WeakPolarHBondContact O-CD 3.34Å
247	I	98.8	Very high	98.1	Very high	11 Å²	11	40.1 Å²	40.1	6%	0.056	23%	0.226	C	C	.	.	S	Bend	trans	-74.5	126.1	174.8	-59.5	169.3	0	0	0	109.2	V194 V197 I198 I244 K245 G249 V250	V194-I247 HydrophobicContact CG1-CG2 4.47Å; V194-I247 HydrophobicContact CG2-CG2 4.07Å; V197-I247 HydrophobicContact CB-CD1 4.34Å; V197-I247 HydrophobicContact CB-CG2 4.39Å; V197-I247 HydrophobicContact CG1-CD1 3.67Å; V197-I247 HydrophobicContact CG1-CG1 4.01Å; V197-I247 HydrophobicContact CG1-CG2 4.23Å; I198-I247 HydrophobicContact CG1-CD1 3.73Å; I244-I247 WeakPolarHBondContact O-CB 3.38Å; I244-I247 WeakPolarHBondContact O-CG1 3.23Å; I244-I247 PolarHBondContact O-N 3.31Å; K245-I247 VanDerWaalsContact C-N 3.34Å; I247-G249 PolarHBondContact O-N 3.26Å; I247-V250 HydrophobicContact CB-CG2 3.9Å; I247-V250 HydrophobicContact CG2-CG2 4.41Å; I247-V250 WeakPolarHBondContact O-CB 3.34Å; I247-V250 PolarHBondContact O-N 3.02Å
248	P	98.8	Very high	98.1	Very high	118 Å²	118	45.1 Å²	45.1	77%	0.766	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	123.7	176	-26.7	35.4	0	0	0	112.3	M246	M246-P248 WeakPolarHBondContact O-CD 3.34Å
249	G	98.7	Very high	98.2	Very high	21 Å²	21	44.9 Å²	44.9	22%	0.216	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	101.6	-12	-176.2	0	0	0	0	0	114.5	V186 I187 I247	V186-G249 CarbonylContact C-O 3.59Å; V186-G249 VanDerWaalsContact CA-O 3.25Å; V186-G249 WeakPolarHBondContact CA-O 3.16Å; V186-G249 WeakPolarHBondContact CB-O 3.26Å; I187-G249 PolarHBondContact N-O 2.91Å; I247-G249 PolarHBondContact O-N 3.26Å
250	V	98.9	Very high	98.3	Very high	14 Å²	14	38.9 Å²	38.9	9%	0.085	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	125	168.2	174.4	0	0	0	0	109.6	I184 V186 V194 I244 I247	I184-V250 HydrophobicContact CG2-CG1 3.9Å; I184-V250 HydrophobicContact CG2-CG2 4.12Å; V186-V250 HydrophobicContact CG1-CG2 4.29Å; V194-V250 HydrophobicContact CG1-CG2 3.58Å; V194-V250 HydrophobicContact CG2-CG2 4.27Å; I244-V250 HydrophobicContact CG2-CG1 4.43Å; I244-V250 HydrophobicContact CG2-CG2 4.41Å; I244-V250 WeakPolarHBondContact O-CG2 3.3Å; I247-V250 HydrophobicContact CB-CG2 3.9Å; I247-V250 HydrophobicContact CG2-CG2 4.41Å; I247-V250 WeakPolarHBondContact O-CB 3.34Å; I247-V250 PolarHBondContact O-N 3.02Å
251	V	98.9	Very high	98.3	Very high	35 Å²	35	41.7 Å²	41.7	21%	0.212	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	-57	174.2	177.8	0	0	0	0	108.7	T149 E185 I187 K245	T149-V251 HydrophobicContact CG2-CG1 4.23Å; E185-V251 HydrophobicContact CB-CB 4.19Å; E185-V251 HydrophobicContact CG-CB 4.06Å; E185-V251 HydrophobicContact CG-CG1 4.35Å; E185-V251 WeakPolarHBondContact O-CB 3.33Å; E185-V251 PolarHBondContact O-N 2.92Å; I187-V251 HydrophobicContact CD1-CG2 3.63Å; I187-V251 HydrophobicContact CG1-CG2 4.07Å; K245-V251 WeakPolarHBondContact CE-O 3.28Å; K245-V251 PolarHBondContact NZ-O 2.79Å
252	E	98.9	Very high	98.3	Very high	31 Å²	31	43.8 Å²	43.8	15%	0.145	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	161.8	179.6	-169.9	47.6	-98	0	0	111.3	L148 T149 K152 E185 K245	L148-E252 HydrophobicContact CD1-CB 3.57Å; L148-E252 HydrophobicContact CD1-CG 3.69Å; T149-E252 WeakPolarHBondContact OG1-CB 3.43Å; K152-E252 HydrophobicContact CB-CG 4.33Å; K152-E252 HydrophobicContact CD-CG 3.94Å; K152-E252 WeakPolarHBondContact CE-OE1 3.3Å; K152-E252 IonicContact NZ-OE1 3.86Å; K152-E252 PolarHBondContact NZ-OE1 3.47Å; E185-E252 PolarHBondContact N-O 3.45Å; E185-E252 PolarHBondContact O-N 3.29Å; K245-E252 VanDerWaalsContact CE-OE2 3.22Å; K245-E252 WeakPolarHBondContact CE-OE2 3.43Å
253	T	98.9	Very high	98.3	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	155.8	177.3	80	0	0	0	0	111.3	L148 K152 P183 N241 I244 K245 L255	L148-T253 WeakPolarHBondContact CD1-O 3.46Å; K152-T253 WeakPolarHBondContact CE-O 3.23Å; K152-T253 PolarHBondContact NZ-O 3.37Å; K152-T253 PolarHBondContact NZ-OG1 3.17Å; P183-T253 CarbonylContact O-C 3.58Å; N241-T253 PolarHBondContact OD1-OG1 3.33Å; I244-T253 HydrophobicContact CB-CG2 4.22Å; I244-T253 HydrophobicContact CG2-CG2 3.78Å; K245-T253 HydrophobicContact CB-CG2 4.37Å; T253-L255 PolarHBondContact O-N 3.05Å; T253-L255 PolarHBondContact OG1-N 2.89Å
254	G	98.8	Very high	98.3	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.206	C	C	.	.	S	Bend	trans	-76	3.9	170.5	0	0	0	0	0	113.9	I141 K142 P183	I141-G254 CarbonylContact C-O 3.5Å; I141-G254 WeakPolarHBondContact CA-O 3.38Å; K142-G254 PolarHBondContact N-O 3.46Å; K142-G254 WeakPolarHBondContact O-CA 3.16Å; P183-G254 WeakPolarHBondContact O-CA 3.4Å; P183-G254 PolarHBondContact O-N 2.67Å
255	L	98.6	Very high	98.3	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	112.2	178.9	-66.5	169.1	0	0	0	110.3	L140 I141 K152 L174 V182 W237 V240 N241 T253 V257	L140-L255 WeakPolarHBondContact O-CA 3.27Å; I141-L255 HydrophobicContact CG1-CD2 4.43Å; K152-L255 WeakPolarHBondContact CE-O 3.42Å; K152-L255 PolarHBondContact NZ-O 3.23Å; L174-L255 HydrophobicContact CD1-CD2 3.99Å; V182-L255 HydrophobicContact CG1-CD1 4.36Å; V182-L255 HydrophobicContact CG1-CD2 4.23Å; V182-L255 HydrophobicContact CG1-CG 3.79Å; V182-L255 HydrophobicContact CG2-CD2 3.98Å; V182-L255 HydrophobicContact CG2-CG 4.37Å; W237-L255 HydrophobicContact CD2-CD2 4.19Å; W237-L255 HydrophobicContact CE3-CD1 3.74Å; W237-L255 HydrophobicContact CE3-CD2 3.48Å; W237-L255 VanDerWaalsContact CE3-CD2 3.48Å; W237-L255 HydrophobicContact CE3-CG 4.27Å; W237-L255 HydrophobicContact CZ3-CD1 4.09Å; W237-L255 HydrophobicContact CZ3-CD2 3.73Å; V240-L255 HydrophobicContact CG1-CD1 4.21Å; N241-L255 HydrophobicContact CB-CB 4.09Å; N241-L255 HydrophobicContact CB-CD1 3.96Å; T253-L255 PolarHBondContact O-N 3.05Å; T253-L255 PolarHBondContact OG1-N 2.89Å; L255-V257 HydrophobicContact CB-CG2 4.11Å
256	F	98.6	Very high	98.3	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	92.1	174.9	-74	-125	0	0	0	107.2	T139 L140 K142 E151 K152 A155 F161 M259	T139-F256 WeakPolarHBondContact CA-O 3.18Å; L140-F256 HydrophobicContact CB-CB 3.99Å; L140-F256 HydrophobicContact CD1-CB 3.84Å; L140-F256 HydrophobicContact CD1-CG 4.39Å; L140-F256 HydrophobicContact CG-CB 3.92Å; L140-F256 PolarHBondContact N-O 3.46Å; L140-F256 PolarHBondContact O-N 3.22Å; K142-F256 HydrophobicContact CB-CD2 3.8Å; K142-F256 HydrophobicContact CB-CE2 3.54Å; K142-F256 HydrophobicContact CB-CZ 4.17Å; K142-F256 HydrophobicContact CD-CD1 3.88Å; K142-F256 HydrophobicContact CD-CD2 3.86Å; K142-F256 HydrophobicContact CD-CE1 3.81Å; K142-F256 HydrophobicContact CD-CE2 3.85Å; K142-F256 HydrophobicContact CD-CG 3.9Å; K142-F256 HydrophobicContact CD-CZ 3.81Å; K142-F256 VanDerWaalsContact CE-CZ 3.42Å; K142-F256 HydrophobicContact CG-CD2 4.19Å; K142-F256 HydrophobicContact CG-CE2 4.22Å; E151-F256 HydrophobicContact CB-CE1 4.4Å; E151-F256 HydrophobicContact CB-CZ 3.88Å; K152-F256 VanDerWaalsContact CA-CE1 3.49Å; K152-F256 HydrophobicContact CB-CE1 3.77Å; K152-F256 HydrophobicContact CB-CE2 4.18Å; K152-F256 HydrophobicContact CB-CZ 3.5Å; K152-F256 HydrophobicContact CG-CD1 4.27Å; K152-F256 HydrophobicContact CG-CE1 3.9Å; K152-F256 HydrophobicContact CG-CE2 4.42Å; K152-F256 HydrophobicContact CG-CZ 3.97Å; A155-F256 HydrophobicContact CB-CD1 4.5Å; A155-F256 HydrophobicContact CB-CE1 4.2Å; F161-F256 AromaticContact CE1-CD1 3.91Å; F161-F256 HydrophobicContact CE1-CD1 3.91Å; F161-F256 HydrophobicContact CZ-CD1 4.37Å; F256-M259 HydrophobicContact CB-SD 4.11Å; F256-M259 HydrophobicContact CD1-CE 4.42Å; F256-M259 HydrophobicContact CD1-SD 3.69Å; F256-M259 HydrophobicContact CE1-SD 4.46Å; F256-M259 HydrophobicContact CG-SD 4.09Å
257	V	97.9	Very high	98.3	Very high	21 Å²	21	30.7 Å²	30.7	13%	0.127	17%	0.168	C	C	.	.			trans	-100.9	128.9	-174.5	-170.5	0	0	0	0	109	T139 W237 N241 L255 M259	T139-V257 HydrophobicContact CG2-CB 4.36Å; T139-V257 HydrophobicContact CG2-CG2 3.84Å; W237-V257 HydrophobicContact CB-CG2 4.2Å; N241-V257 HydrophobicContact CB-CG2 3.92Å; L255-V257 HydrophobicContact CB-CG2 4.11Å; V257-M259 WeakPolarHBondContact O-CG 3.46Å; V257-M259 PolarHBondContact O-N 2.98Å
258	N	96.1	Very high	98.1	Very high	137 Å²	137	35.6 Å²	35.6	73%	0.733	19%	0.19	S	C	*	.	S	Bend	trans	55.2	34	178.9	-56.8	-28.6	0	0	0	114.1
259	M	97.4	Very high	97.9	Very high	47 Å²	47	36 Å²	36	23%	0.232	19%	0.186	C	C	.	.			trans	-109	-43.3	179.1	-60.7	-173.9	76.1	0	0	112.6	K152 A155 F161 F256 V257	K152-M259 HydrophobicContact CD-SD 4.12Å; K152-M259 HydrophobicContact CG-CE 3.79Å; K152-M259 HydrophobicContact CG-SD 3.75Å; A155-M259 HydrophobicContact CB-CE 3.75Å; F161-M259 HydrophobicContact CD1-CB 3.96Å; F161-M259 HydrophobicContact CE1-CB 4.46Å; F256-M259 HydrophobicContact CB-SD 4.11Å; F256-M259 HydrophobicContact CD1-CE 4.42Å; F256-M259 HydrophobicContact CD1-SD 3.69Å; F256-M259 HydrophobicContact CE1-SD 4.46Å; F256-M259 HydrophobicContact CG-SD 4.09Å; V257-M259 WeakPolarHBondContact O-CG 3.46Å; V257-M259 PolarHBondContact O-N 2.98Å
260	A	98	Very high	97.7	Very high	7 Å²	7	37.2 Å²	37.2	6%	0.058	20%	0.198	C	C	.	.			trans	-76.9	127.4	-175.1	0	0	0	0	0	111	L138 L140 F161 V163	L138-A260 HydrophobicContact CB-CB 4.36Å; L140-A260 HydrophobicContact CD1-CB 4.25Å; L140-A260 HydrophobicContact CD2-CB 4.28Å; F161-A260 HydrophobicContact CD1-CB 3.99Å; F161-A260 HydrophobicContact CE1-CB 4.21Å; V163-A260 HydrophobicContact CG2-CB 3.64Å
261	E	97.4	Very high	97.6	Very high	73 Å²	73	39 Å²	39	34%	0.341	21%	0.212	S	C	.	.	S	Bend	trans	-83	-33.3	172.5	-74.8	-173.1	-142.2	0	0	111.8	C160 F161 K276 A277	C160-E261 VanDerWaalsContact CA-OE1 3.25Å; C160-E261 WeakPolarHBondContact CA-OE1 3.39Å; C160-E261 PolarHBondContact SG-OE2 2.94Å; F161-E261 PolarHBondContact O-N 2.84Å; E261-K276 CarbonylContact O-C 3.55Å; E261-K276 WeakPolarHBondContact O-CA 3.39Å; E261-A277 PolarHBondContact O-N 2.84Å
262	R	97.2	Very high	97.6	Very high	73 Å²	73	39.6 Å²	39.6	28%	0.275	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	147.8	-175.6	-51.8	-176.7	-178	147.5	4.5	110.9	N62 V163 Y264 R275 K276	N62-R262 PolarHBondContact OD1-NH1 3.16Å; V163-R262 PolarHBondContact N-O 3.44Å; R262-Y264 HydrophobicContact CB-CE2 4.18Å; R262-R275 CarbonylContact C-O 3.59Å; R262-R275 WeakPolarHBondContact CA-O 3.23Å; R262-K276 HydrophobicContact CG-CG 4.05Å
263	A	98.6	Very high	97.6	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	131.3	168.4	0	0	0	0	0	110.7	V134 L138 V163 F265 V274 R275	V134-A263 HydrophobicContact CG1-CB 4.38Å; L138-A263 HydrophobicContact CD2-CB 3.51Å; V163-A263 HydrophobicContact CB-CB 3.94Å; V163-A263 HydrophobicContact CG1-CB 4.35Å; V163-A263 CarbonylContact O-C 3.48Å; V163-A263 VanDerWaalsContact O-CA 3.31Å; V163-A263 WeakPolarHBondContact O-CA 3.23Å; A263-F265 HydrophobicContact CB-CD2 4.38Å; A263-F265 HydrophobicContact CB-CE1 4.47Å; A263-F265 HydrophobicContact CB-CE2 3.54Å; A263-F265 HydrophobicContact CB-CZ 3.6Å; A263-V274 WeakPolarHBondContact O-CA 3.47Å; A263-R275 PolarHBondContact N-O 2.89Å; A263-R275 PolarHBondContact O-N 2.83Å
264	Y	98.8	Very high	97.6	Very high	9 Å²	9	45.3 Å²	45.3	4%	0.035	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	122.2	174.5	-69.3	-106.2	0	0	0	108.6	A58 N62 V162 V163 A165 R262 V272 V274	A58-Y264 HydrophobicContact CB-CD1 4.3Å; A58-Y264 HydrophobicContact CB-CD2 3.75Å; A58-Y264 HydrophobicContact CB-CE2 4.14Å; A58-Y264 HydrophobicContact CB-CG 3.87Å; N62-Y264 WeakPolarHBondContact ND2-CE2 3.06Å; N62-Y264 PolarHBondContact ND2-OH 3.42Å; V162-Y264 HydrophobicContact CG1-CD2 3.65Å; V162-Y264 HydrophobicContact CG1-CE2 3.66Å; V163-Y264 PolarHBondContact O-N 3.46Å; A165-Y264 PolarHBondContact N-O 3.37Å; R262-Y264 HydrophobicContact CB-CE2 4.18Å; Y264-V272 HydrophobicContact CD1-CG1 3.99Å; Y264-V274 HydrophobicContact CD1-CG2 3.62Å; Y264-V274 HydrophobicContact CE1-CG1 4.2Å; Y264-V274 HydrophobicContact CE1-CG2 3.58Å; Y264-V274 HydrophobicContact CE2-CG1 4.31Å; Y264-V274 HydrophobicContact CG-CG2 4.36Å
265	F	98.7	Very high	97.5	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	118.1	177.9	-56	-82.6	0	0	0	109.9	V134 A165 D170 A263 M267 V272 K273 R275	V134-F265 HydrophobicContact CB-CE1 3.96Å; V134-F265 HydrophobicContact CB-CZ 3.74Å; V134-F265 HydrophobicContact CG1-CE1 4.46Å; V134-F265 HydrophobicContact CG1-CZ 3.76Å; V134-F265 HydrophobicContact CG2-CE1 3.94Å; V134-F265 HydrophobicContact CG2-CZ 4.05Å; A165-F265 HydrophobicContact CB-CD1 4.03Å; A165-F265 HydrophobicContact CB-CE1 4.21Å; A165-F265 VanDerWaalsContact O-CA 3.26Å; A165-F265 WeakPolarHBondContact O-CA 3.45Å; D170-F265 HydrophobicContact CB-CD1 3.66Å; D170-F265 HydrophobicContact CB-CD2 4.44Å; D170-F265 HydrophobicContact CB-CE1 3.74Å; D170-F265 HydrophobicContact CB-CE2 4.49Å; D170-F265 HydrophobicContact CB-CG 4.01Å; D170-F265 HydrophobicContact CB-CZ 4.15Å; A263-F265 HydrophobicContact CB-CD2 4.38Å; A263-F265 HydrophobicContact CB-CE1 4.47Å; A263-F265 HydrophobicContact CB-CE2 3.54Å; A263-F265 HydrophobicContact CB-CZ 3.6Å; F265-M267 HydrophobicContact CB-SD 4.05Å; F265-M267 PolarHBondContact O-N 2.96Å; F265-V272 CarbonylContact O-C 3.5Å; F265-V272 WeakPolarHBondContact O-CA 3.49Å; F265-K273 HydrophobicContact CB-CB 4.35Å; F265-K273 PolarHBondContact N-O 3.01Å; F265-K273 PolarHBondContact O-N 3.3Å; F265-R275 HydrophobicContact CE2-CB 4.12Å
266	G	98.4	Very high	97.4	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	124.5	168.9	0	0	0	0	0	109.2	A50 A165 Y167	A50-G266 WeakPolarHBondContact CB-O 3.37Å; A50-G266 WeakPolarHBondContact O-CA 3.01Å; A165-G266 PolarHBondContact O-N 2.78Å; Y167-G266 WeakPolarHBondContact CB-O 3.42Å; Y167-G266 PolarHBondContact N-O 2.84Å
267	M	97.4	Very high	96.9	Very high	48 Å²	48	55.8 Å²	55.8	24%	0.236	30%	0.296	C	S	.	.			trans	-94.7	156.9	-175	-55.1	-53	-63.7	0	0	111.1	F265 D269 G270 S271 K273	F265-M267 HydrophobicContact CB-SD 4.05Å; F265-M267 PolarHBondContact O-N 2.96Å; M267-D269 WeakPolarHBondContact CB-OD1 3.36Å; M267-D269 PolarHBondContact O-N 3.44Å; M267-G270 PolarHBondContact O-N 2.81Å; M267-G270 VanDerWaalsContact O-N 3.08Å; M267-S271 WeakPolarHBondContact CB-O 3.49Å; M267-S271 WeakPolarHBondContact CB-OG 3.42Å; M267-S271 WeakPolarHBondContact CG-OG 3.47Å; M267-S271 PolarHBondContact N-O 2.73Å; M267-K273 HydrophobicContact CG-CB 4.02Å; M267-K273 HydrophobicContact SD-CB 3.69Å; M267-K273 HydrophobicContact SD-CD 4.32Å
268	E	94.4	Very high	95.8	Very high	113 Å²	113	59.8 Å²	59.8	53%	0.528	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-26.3	-179.9	-171.2	169	-151.3	0	0	112.7	M46 Y167 G270	M46-E268 HydrophobicContact SD-CG 4.27Å; Y167-E268 HydrophobicContact CD1-CB 4.29Å; Y167-E268 HydrophobicContact CE1-CB 4.02Å; Y167-E268 HydrophobicContact CE2-CB 4.42Å; E268-G270 VanDerWaalsContact C-N 3.25Å; E268-G270 PolarHBondContact O-N 2.8Å
269	D	94.3	Very high	94.1	Very high	128 Å²	128	58.2 Å²	58.2	68%	0.684	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	3.4	177.1	68.8	-4.5	0	0	0	114.1	M267 S271	M267-D269 WeakPolarHBondContact CB-OD1 3.36Å; M267-D269 PolarHBondContact O-N 3.44Å; D269-S271 VanDerWaalsContact C-N 3.31Å; D269-S271 WeakPolarHBondContact OD1-CB 3.48Å; D269-S271 PolarHBondContact OD1-N 2.85Å; D269-S271 PolarHBondContact OD1-OG 2.83Å; D269-S271 PolarHBondContact OD2-OG 2.83Å
270	G	95	Very high	91.8	Very high	45 Å²	45	67 Å²	67	46%	0.464	38%	0.377	S	S	.	.	S	Bend	trans	81.9	3.8	-177.3	0	0	0	0	0	114.6	L53 M267 E268	L53-G270 WeakPolarHBondContact CD1-O 3.5Å; M267-G270 PolarHBondContact O-N 2.81Å; M267-G270 VanDerWaalsContact O-N 3.08Å; E268-G270 VanDerWaalsContact C-N 3.25Å; E268-G270 PolarHBondContact O-N 2.8Å
271	S	97.8	Very high	91.5	Very high	53 Å²	53	70.1 Å²	70.1	37%	0.371	39%	0.393	S	S	.	.			trans	-81.5	167.1	170.5	72.8	0	0	0	0	111.9	M267 D269	M267-S271 WeakPolarHBondContact CB-O 3.49Å; M267-S271 WeakPolarHBondContact CB-OG 3.42Å; M267-S271 WeakPolarHBondContact CG-OG 3.47Å; M267-S271 PolarHBondContact N-O 2.73Å; D269-S271 VanDerWaalsContact C-N 3.31Å; D269-S271 WeakPolarHBondContact OD1-CB 3.48Å; D269-S271 PolarHBondContact OD1-N 2.85Å; D269-S271 PolarHBondContact OD1-OG 2.83Å; D269-S271 PolarHBondContact OD2-OG 2.83Å
272	V	98.6	Very high	91.2	Very high	46 Å²	46	69.9 Å²	69.9	28%	0.279	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	116	171.5	-179.3	0	0	0	0	109	L53 Y264 F265 V274	L53-V272 HydrophobicContact CB-CG2 3.83Å; Y264-V272 HydrophobicContact CD1-CG1 3.99Å; F265-V272 CarbonylContact O-C 3.5Å; F265-V272 WeakPolarHBondContact O-CA 3.49Å; V272-V274 HydrophobicContact CG1-CG2 4.49Å
273	K	98.4	Very high	90.8	Very high	88 Å²	88	69.7 Å²	69.7	38%	0.383	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	133.8	172.8	178.2	-177	176.3	-172.1	0	109.4	D170 F265 M267	D170-K273 IonicContact OD2-NZ 2.8Å; D170-K273 PolarHBondContact OD2-NZ 2.97Å; F265-K273 HydrophobicContact CB-CB 4.35Å; F265-K273 PolarHBondContact N-O 3.01Å; F265-K273 PolarHBondContact O-N 3.3Å; M267-K273 HydrophobicContact CG-CB 4.02Å; M267-K273 HydrophobicContact SD-CB 3.69Å; M267-K273 HydrophobicContact SD-CD 4.32Å
274	V	98.3	Very high	90.4	Very high	64 Å²	64	73.8 Å²	73.8	39%	0.388	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	121.3	176.5	-172.9	0	0	0	0	109.5	A263 Y264 V272 K276	A263-V274 WeakPolarHBondContact O-CA 3.47Å; Y264-V274 HydrophobicContact CD1-CG2 3.62Å; Y264-V274 HydrophobicContact CE1-CG1 4.2Å; Y264-V274 HydrophobicContact CE1-CG2 3.58Å; Y264-V274 HydrophobicContact CE2-CG1 4.31Å; Y264-V274 HydrophobicContact CG-CG2 4.36Å; V272-V274 HydrophobicContact CG1-CG2 4.49Å; V274-K276 HydrophobicContact CG1-CG 4.36Å
275	R	97.6	Very high	89.8	Confident	44 Å²	44	77.9 Å²	77.9	17%	0.166	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	135.6	168.7	-176	-180	-68.8	139.2	7	108.5	D135 L138 D170 R262 A263 F265	D135-R275 PolarHBondContact O-NH1 2.75Å; L138-R275 HydrophobicContact CD1-CG 4.35Å; L138-R275 HydrophobicContact CD2-CB 4.11Å; L138-R275 HydrophobicContact CD2-CG 3.81Å; L138-R275 HydrophobicContact CG-CG 4.01Å; D170-R275 IonicContact OD1-CZ 2.82Å; D170-R275 IonicContact OD1-NH1 3.12Å; D170-R275 PolarHBondContact OD1-NH1 3.09Å; D170-R275 IonicContact OD1-NH2 2.74Å; D170-R275 PolarHBondContact OD1-NH2 3.48Å; D170-R275 IonicContact OD2-NH2 3.43Å; R262-R275 CarbonylContact C-O 3.59Å; R262-R275 WeakPolarHBondContact CA-O 3.23Å; A263-R275 PolarHBondContact N-O 2.89Å; A263-R275 PolarHBondContact O-N 2.83Å; F265-R275 HydrophobicContact CE2-CB 4.12Å
276	K	96.1	Very high	89.2	Confident	135 Å²	135	83.1 Å²	83.1	59%	0.587	48%	0.48	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.5	147	175.4	-59.2	-172.7	178.3	176.6	0	109.4	E261 R262 V274	E261-K276 CarbonylContact O-C 3.55Å; E261-K276 WeakPolarHBondContact O-CA 3.39Å; R262-K276 HydrophobicContact CG-CG 4.05Å; V274-K276 HydrophobicContact CG1-CG 4.36Å
277	A	88.9	Confident	88.6	Confident	40 Å²	40	89 Å²	89	33%	0.331	51%	0.514	S	S	.	.	P	Polyproline II helix	trans	-59.8	146.5	169.4	0	0	0	0	0	108.9	L138 E261 A279	L138-A277 HydrophobicContact CD1-CB 4Å; E261-A277 PolarHBondContact O-N 2.84Å; A277-A279 PolarHBondContact O-N 2.93Å
278	P	74.1	Confident	87.9	Confident	106 Å²	106	92.2 Å²	92.2	69%	0.688	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-53.6	138.7	170.2	-18.4	30.1	0	0	0	109.3	N280	P278-N280 PolarHBondContact O-N 3.4Å
279	A	60.4	Low	87.4	Confident	103 Å²	103	90.4 Å²	90.4	85%	0.851	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-64.7	120.9	168.1	0	0	0	0	0	107.6	A277	A277-A279 PolarHBondContact O-N 2.93Å
280	N	49.2	Very low	86.7	Confident	233 Å²	233	87 Å²	87	100%	1.246	52%	0.523	S	S	*	.			trans	-69.3	0	171.3	-72.2	-23.8	0	0	0	111	P278	P278-N280 PolarHBondContact O-N 3.4Å

Retrieved 280 of 280 residues in 468.2 ms (Link to these results)

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