A0A096NJT5_PAPAN Loading...

Thioredoxin, mitochondrial

AlphaFold DB , UniProt , Accession A0A096NJT5, Species PAPAN (Papio anubis, Olive baboon), Gene TXN2, Length 166 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	50.9	Low	48.4	Very low	253 Å²	253	182.4 Å²	182.4	100%	1.246	86%	0.86	S	S	*	*				0	116.2	0	-54.2	-167.7	-161.6	0	0	105.4
2	A	46.1	Very low	47.7	Very low	95 Å²	95	174.9 Å²	174.9	79%	0.785	85%	0.852	S	S	*	*			cis	-144.1	130.6	32.2	0	0	0	0	0	109.3
3	Q	42.6	Very low	47.6	Very low	172 Å²	172	170.2 Å²	170.2	80%	0.804	85%	0.848	S	S	*	*				51.9	103.3	97.1	-76.6	-173.6	8.3	0	0	114.7
4	R	45.6	Very low	47.8	Very low	219 Å²	219	167.1 Å²	167.1	83%	0.826	84%	0.842	S	S	*	*				101.9	107.6	86.3	-89.7	-177	174.5	-145.1	-1	110.5
5	L	50.1	Low	47.9	Very low	145 Å²	145	165.5 Å²	165.5	76%	0.759	84%	0.835	S	S	*	*				48.8	120.2	109.2	-97.3	96.1	0	0	0	114.6
6	L	51.4	Low	47.6	Very low	162 Å²	162	161.6 Å²	161.6	85%	0.848	83%	0.828	S	S	*	*				-178.2	149.1	102.7	-90.4	173.5	0	0	0	113.3
7	L	47	Very low	47.2	Very low	140 Å²	140	165.7 Å²	165.7	73%	0.733	83%	0.83	S	S	*	*			trans	-65.9	149.3	-171.1	-83.8	69.5	0	0	0	115.3
8	R	50.8	Low	47.1	Very low	227 Å²	227	167.1 Å²	167.1	86%	0.857	83%	0.83	S	S	*	*			trans	-5.5	122.8	141.6	-68.4	179.2	164.5	-152.3	-5	115.6
9	R	52.5	Low	46.8	Very low	240 Å²	240	164.4 Å²	164.4	91%	0.906	83%	0.827	S	S	*	*			trans	-119.7	107.9	157.5	-60.6	-169.8	98.2	-166.2	6.3	109.6
10	F	46.2	Very low	46.7	Very low	184 Å²	184	162.2 Å²	162.2	81%	0.807	83%	0.827	S	S	*	*			trans	-58.1	131.2	159	-103.7	-104.2	0	0	0	109.6
11	L	49.3	Very low	46.9	Very low	169 Å²	169	163.5 Å²	163.5	89%	0.885	83%	0.83	S	S	*	*			trans	-140.2	97.5	154	-85.9	169.2	0	0	0	107.8
12	A	39.9	Very low	46.4	Very low	93 Å²	93	154.2 Å²	154.2	77%	0.769	80%	0.799	S	S	*	*			trans	-72.4	127.2	162.5	0	0	0	0	0	108.1
13	S	46	Very low	46.1	Very low	114 Å²	114	161 Å²	161	80%	0.797	80%	0.804	S	S	*	*			trans	-115.6	119.7	169	-169.8	0	0	0	0	109.4
14	V	51.1	Low	45.7	Very low	126 Å²	126	164.7 Å²	164.7	76%	0.764	81%	0.811	S	S	*	*			trans	-74.4	125.5	179.2	169.9	0	0	0	0	109.1
15	I	48.3	Very low	45.7	Very low	143 Å²	143	159.1 Å²	159.1	73%	0.733	80%	0.803	S	S	*	*			trans	-131.3	91.3	158.3	-55.6	179.2	0	0	0	108.5	R17	I15-R17 HydrophobicContact CG2-CG 4.44Å
16	S	43.8	Very low	45.5	Very low	104 Å²	104	160.6 Å²	160.6	73%	0.727	81%	0.806	S	S	*	*			trans	-71.3	118.6	167.1	-178.9	0	0	0	0	109.2
17	R	41.2	Very low	45.3	Very low	231 Å²	231	161.4 Å²	161.4	87%	0.872	81%	0.81	S	S	*	*			trans	-102.8	109.2	167.6	-71.1	-170.9	-175.4	-139.3	2.3	108.9	I15	I15-R17 HydrophobicContact CG2-CG 4.44Å
18	K	45.5	Very low	45.5	Very low	190 Å²	190	161.1 Å²	161.1	83%	0.826	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-83.6	130.4	176.6	-170.3	176.1	-174.2	179.3	0	109.6
19	P	41	Very low	45.5	Very low	117 Å²	117	156.4 Å²	156.4	76%	0.76	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-78.5	141.1	169.1	-9	25.8	0	0	0	111.1
20	S	45.3	Very low	45.2	Very low	119 Å²	119	156.5 Å²	156.5	83%	0.832	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-68.3	128.4	-178	53.9	0	0	0	0	112.9	G22	S20-G22 PolarHBondContact O-N 3.5Å
21	Q	50.5	Low	45.4	Very low	191 Å²	191	151.9 Å²	151.9	89%	0.893	81%	0.813	S	S	*	*			trans	-72	109.9	169.4	-74.2	-85.3	7.6	0	0	110.1
22	G	39.3	Very low	45.3	Very low	58 Å²	58	151.2 Å²	151.2	60%	0.598	81%	0.809	S	S	*	*			trans	-101	119.1	172	0	0	0	0	0	110.9	S20	S20-G22 PolarHBondContact O-N 3.5Å
23	R	40.1	Very low	45.6	Very low	237 Å²	237	156 Å²	156	89%	0.894	82%	0.815	S	S	*	*			trans	-69	124.9	-175	175.5	-178.1	-68.9	-129.1	-3	112.6
24	W	35.1	Very low	45.6	Very low	249 Å²	249	155.8 Å²	155.8	94%	0.943	81%	0.81	S	S	*	*			trans	-109	119.5	168.2	-72.5	72.8	0	0	0	110.1
25	P	44.6	Very low	45.2	Very low	102 Å²	102	155.8 Å²	155.8	66%	0.662	81%	0.812	S	S	*	*			trans	-96.6	126.7	170.3	30	-20.8	0	0	0	112.7
26	H	46.7	Very low	45	Very low	176 Å²	176	157.9 Å²	157.9	82%	0.815	82%	0.819	S	S	*	*			trans	58	105.7	138.5	-59.4	-71.6	0	0	0	121.1	T28	H26-T28 PolarHBondContact O-N 3.28Å
27	L	47.5	Very low	44.9	Very low	179 Å²	179	162.9 Å²	162.9	94%	0.937	82%	0.823	S	S	*	*			trans	-39.6	120.1	149.6	-73	147.6	0	0	0	112.1
28	T	49.9	Very low	45.5	Very low	134 Å²	134	158.7 Å²	158.7	82%	0.822	82%	0.818	S	S	*	*			trans	-102.9	117.8	155.3	49.6	0	0	0	0	107.8	H26 R30	H26-T28 PolarHBondContact O-N 3.28Å; T28-R30 PolarHBondContact O-N 3.04Å
29	S	50.9	Low	46	Very low	128 Å²	128	155.2 Å²	155.2	90%	0.895	82%	0.815	S	S	*	*			trans	-70	116.5	176.3	-162.3	0	0	0	0	108.5
30	R	47.6	Very low	46.4	Very low	242 Å²	242	153 Å²	153	91%	0.913	81%	0.814	S	S	*	*			trans	-131.1	99.4	167.4	-145.8	175.8	-172.2	-151.5	1.1	109.8	T28	T28-R30 PolarHBondContact O-N 3.04Å
31	A	49.9	Very low	46.8	Very low	88 Å²	88	150.8 Å²	150.8	73%	0.727	81%	0.809	S	S	*	*			trans	28.3	127.6	150.4	0	0	0	0	0	119.8
32	L	47.7	Very low	46.4	Very low	154 Å²	154	149.7 Å²	149.7	81%	0.806	81%	0.809	S	S	*	*			trans	-40.3	136.9	162.7	-77.1	85.4	0	0	0	113.3
33	Q	44.6	Very low	46.8	Very low	193 Å²	193	153.2 Å²	153.2	90%	0.902	82%	0.819	S	S	*	*			trans	-145.2	113.7	136.5	-99.9	148.1	29	0	0	108.3
34	T	46.5	Very low	47.3	Very low	111 Å²	111	147.4 Å²	147.4	68%	0.681	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-71	133.4	171.5	41.2	0	0	0	0	109.4	Q36	T34-Q36 PolarHBondContact O-N 3.06Å
35	P	42.5	Very low	48.2	Very low	125 Å²	125	141.6 Å²	141.6	81%	0.812	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-71.6	122.1	162.5	-2.1	18.7	0	0	0	107.7	Y37	P35-Y37 PolarHBondContact O-N 2.94Å
36	Q	43.9	Very low	48.8	Very low	187 Å²	187	144 Å²	144	87%	0.874	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-62.7	121	172.9	-68.3	-177.8	-83.9	0	0	109.8	T34	T34-Q36 PolarHBondContact O-N 3.06Å
37	Y	42.9	Very low	49.5	Very low	209 Å²	209	142.5 Å²	142.5	82%	0.82	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-90	116.3	172.5	178.6	-99.3	0	0	0	109.4	P35	P35-Y37 PolarHBondContact O-N 2.94Å
38	N	53.8	Low	50	Low	144 Å²	144	140.1 Å²	140.1	77%	0.77	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-85.4	128.2	172	-96.3	-17.7	0	0	0	109.9	G40	N38-G40 PolarHBondContact O-N 3.02Å
39	P	55	Low	50.6	Low	116 Å²	116	137.4 Å²	137.4	75%	0.753	79%	0.793	S	S	*	*			trans	-84.5	102.9	176.3	32.9	-27.8	0	0	0	108.8
40	G	49.6	Very low	51.1	Low	72 Å²	72	142.6 Å²	142.6	74%	0.742	79%	0.793	S	S	*	*			trans	-158.3	87.6	179.9	0	0	0	0	0	112.9	N38	N38-G40 PolarHBondContact O-N 3.02Å
41	G	53.4	Low	51.8	Low	71 Å²	71	135.9 Å²	135.9	73%	0.732	78%	0.778	S	S	*	*			trans	68.8	81.8	144.9	0	0	0	0	0	118.5
42	L	43.8	Very low	52.5	Low	168 Å²	168	138.9 Å²	138.9	88%	0.88	78%	0.781	S	S	*	*			trans	-136.2	87.5	148	-74.1	172.8	0	0	0	108.3	V44	L42-V44 VanDerWaalsContact C-N 3.33Å; L42-V44 PolarHBondContact O-N 3.37Å
43	T	46	Very low	53.1	Low	132 Å²	132	140.6 Å²	140.6	81%	0.81	78%	0.778	S	S	*	*			trans	-70.1	93.7	164.8	37.1	0	0	0	0	108.1	T45	T43-T45 VanDerWaalsContact C-N 3.33Å; T43-T45 PolarHBondContact O-N 3.31Å; T43-T45 PolarHBondContact O-OG1 3.08Å
44	V	51.4	Low	54	Low	115 Å²	115	137.3 Å²	137.3	70%	0.697	77%	0.771	S	S	*	*			trans	-66	98.7	166.4	178.6	0	0	0	0	106.9	L42 L46	L42-V44 VanDerWaalsContact C-N 3.33Å; L42-V44 PolarHBondContact O-N 3.37Å; V44-L46 HydrophobicContact CG1-CD2 4.21Å; V44-L46 HydrophobicContact CG1-CG 4.47Å; V44-L46 PolarHBondContact O-N 3.36Å
45	T	53.7	Low	54.7	Low	127 Å²	127	137.6 Å²	137.6	78%	0.779	77%	0.773	S	S	*	*			trans	-72.8	99.2	173.2	-29.7	0	0	0	0	107	T43 N47	T43-T45 VanDerWaalsContact C-N 3.33Å; T43-T45 PolarHBondContact O-N 3.31Å; T43-T45 PolarHBondContact O-OG1 3.08Å; T45-N47 PolarHBondContact O-N 3.02Å
46	L	56.5	Low	55.6	Low	153 Å²	153	143.1 Å²	143.1	80%	0.801	78%	0.777	S	S	*	*			trans	-68.2	103.7	171.6	-69.2	171.4	0	0	0	107.6	V44 P48	V44-L46 HydrophobicContact CG1-CD2 4.21Å; V44-L46 HydrophobicContact CG1-CG 4.47Å; V44-L46 PolarHBondContact O-N 3.36Å; L46-P48 VanDerWaalsContact O-CD 3.3Å; L46-P48 WeakPolarHBondContact O-CD 3.3Å
47	N	61.3	Low	56.3	Low	145 Å²	145	140.7 Å²	140.7	78%	0.775	77%	0.769	S	S	*	*			trans	-73.1	114.4	177.7	-152.2	6.9	0	0	0	108.6	T45 A49	T45-N47 PolarHBondContact O-N 3.02Å; N47-A49 PolarHBondContact O-N 3.06Å
48	P	60.1	Low	57.1	Low	129 Å²	129	135.4 Å²	135.4	84%	0.838	76%	0.763	S	S	*	*			trans	-83.5	33	-167.1	33.7	-35.7	0	0	0	114.5	L46	L46-P48 VanDerWaalsContact O-CD 3.3Å; L46-P48 WeakPolarHBondContact O-CD 3.3Å
49	A	60.6	Low	58.2	Low	77 Å²	77	134.6 Å²	134.6	64%	0.636	76%	0.758	S	S	*	*			trans	-141.9	55.2	-168.5	0	0	0	0	0	115	N47	N47-A49 PolarHBondContact O-N 3.06Å
50	R	63.2	Low	60	Low	237 Å²	237	130.3 Å²	130.3	89%	0.894	73%	0.729	S	S	*	*			trans	-127.2	80	157.6	-70.8	-171	-177.2	177.7	1.8	109.8	I52	R50-I52 PolarHBondContact O-N 3.05Å; R50-I52 VanDerWaalsContact O-N 3.08Å
51	T	60.4	Low	62.2	Low	100 Å²	100	128.3 Å²	128.3	61%	0.613	70%	0.703	S	S	*	*			trans	-65.7	102.2	164.4	-53.7	0	0	0	0	107.7	Y53	T51-Y53 HydrophobicContact CG2-CD1 4.42Å; T51-Y53 HydrophobicContact CG2-CD2 3.99Å; T51-Y53 HydrophobicContact CG2-CE1 4.08Å; T51-Y53 HydrophobicContact CG2-CE2 3.62Å; T51-Y53 HydrophobicContact CG2-CG 4.38Å; T51-Y53 WeakPolarHBondContact O-CD2 3.42Å; T51-Y53 PolarHBondContact O-N 3.01Å
52	I	66.1	Low	64.3	Low	152 Å²	152	126.3 Å²	126.3	78%	0.779	67%	0.674	S	S	*	*			trans	-74.4	96.4	170.5	-56.9	179.1	0	0	0	106.3	R50 T54	R50-I52 PolarHBondContact O-N 3.05Å; R50-I52 VanDerWaalsContact O-N 3.08Å; I52-T54 PolarHBondContact O-N 3.39Å
53	Y	60.9	Low	66.9	Low	190 Å²	190	122.5 Å²	122.5	75%	0.745	66%	0.655	S	S	*	*			trans	-68.2	101.8	165.8	-66.9	-86.6	0	0	0	107.2	T51 T55	T51-Y53 HydrophobicContact CG2-CD1 4.42Å; T51-Y53 HydrophobicContact CG2-CD2 3.99Å; T51-Y53 HydrophobicContact CG2-CE1 4.08Å; T51-Y53 HydrophobicContact CG2-CE2 3.62Å; T51-Y53 HydrophobicContact CG2-CG 4.38Å; T51-Y53 WeakPolarHBondContact O-CD2 3.42Å; T51-Y53 PolarHBondContact O-N 3.01Å; Y53-T55 VanDerWaalsContact C-N 3.29Å; Y53-T55 PolarHBondContact O-N 3.46Å
54	T	62.2	Low	69.4	Low	124 Å²	124	116.5 Å²	116.5	76%	0.761	62%	0.617	S	S	*	*			trans	-70.5	94.9	164.2	146.1	0	0	0	0	106	I52 R56	I52-T54 PolarHBondContact O-N 3.39Å; T54-R56 PolarHBondContact O-N 2.84Å; T54-R56 VanDerWaalsContact O-N 3.13Å
55	T	61.7	Low	71.7	Confident	117 Å²	117	117.3 Å²	117.3	72%	0.718	61%	0.613	S	S	*	*			trans	-59.2	115.2	161	40.6	0	0	0	0	106	Y53 I57	Y53-T55 VanDerWaalsContact C-N 3.29Å; Y53-T55 PolarHBondContact O-N 3.46Å; T55-I57 PolarHBondContact O-N 3.13Å
56	R	61.5	Low	73.8	Confident	240 Å²	240	115 Å²	115	91%	0.906	60%	0.596	S	S	*	*			trans	-52.6	104.5	169	-108.9	-172.2	-176.2	-157.9	1.7	106.9	T54 S58	T54-R56 PolarHBondContact O-N 2.84Å; T54-R56 VanDerWaalsContact O-N 3.13Å; R56-S58 PolarHBondContact O-N 2.92Å
57	I	58.9	Low	75.8	Confident	137 Å²	137	109 Å²	109	70%	0.703	57%	0.572	S	S	*	*			trans	-68.1	94.7	162.3	-60.2	176.6	0	0	0	103.5	T55 L59	T55-I57 PolarHBondContact O-N 3.13Å; I57-L59 VanDerWaalsContact C-N 3.26Å; I57-L59 HydrophobicContact CG2-CD2 4.05Å; I57-L59 HydrophobicContact CG2-CG 4.02Å; I57-L59 PolarHBondContact O-N 3.4Å
58	S	59.9	Low	77.5	Confident	98 Å²	98	106.7 Å²	106.7	69%	0.685	57%	0.565	S	S	*	*			trans	-67.9	100.7	163.6	-162.9	0	0	0	0	104.9	R56 T60	R56-S58 PolarHBondContact O-N 2.92Å; S58-T60 PolarHBondContact O-N 2.74Å
59	L	76.8	Confident	79.4	Confident	127 Å²	127	102 Å²	102	67%	0.665	53%	0.533	S	S	*	.			trans	-65.5	105.7	177.1	-78.6	159.7	0	0	0	106.3	I57 T61	I57-L59 VanDerWaalsContact C-N 3.26Å; I57-L59 HydrophobicContact CG2-CD2 4.05Å; I57-L59 HydrophobicContact CG2-CG 4.02Å; I57-L59 PolarHBondContact O-N 3.4Å; L59-T61 PolarHBondContact O-N 3.28Å; L59-T61 VanDerWaalsContact O-N 3.08Å
60	T	91.3	Very high	81.2	Confident	25 Å²	25	98.5 Å²	98.5	15%	0.153	50%	0.503	C	S	.	.	S	Bend	trans	-65.8	-5	177	52	0	0	0	0	112.6	S58 V112 M113	S58-T60 PolarHBondContact O-N 2.74Å; T60-V112 CarbonylContact O-C 3.55Å; T60-V112 WeakPolarHBondContact O-CA 3.41Å; T60-M113 PolarHBondContact O-N 3.35Å
61	T	97.3	Very high	82.9	Confident	30 Å²	30	91.6 Å²	91.6	18%	0.184	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	138.2	179	-57.5	0	0	0	0	109.7	L59 E101 M113 K115	L59-T61 PolarHBondContact O-N 3.28Å; L59-T61 VanDerWaalsContact O-N 3.08Å; T61-E101 HydrophobicContact CG2-CG 3.88Å; T61-M113 CarbonylContact C-O 3.56Å; T61-M113 VanDerWaalsContact CA-O 3.27Å; T61-M113 WeakPolarHBondContact CA-O 3.35Å; T61-M113 HydrophobicContact CG2-CB 4.21Å; T61-M113 HydrophobicContact CG2-CG 4.13Å; T61-M113 HydrophobicContact CG2-SD 4.12Å; T61-K115 HydrophobicContact CG2-CD 3.7Å; T61-K115 HydrophobicContact CG2-CG 4.16Å
62	F	97.9	Very high	84.7	Confident	29 Å²	29	91.9 Å²	91.9	13%	0.127	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	156.2	177.1	52.4	-94.5	0	0	0	112.4	I64 R73 V112 M113 A114 K115	F62-I64 HydrophobicContact CD2-CD1 4.08Å; F62-I64 HydrophobicContact CE2-CD1 3.72Å; F62-R73 HydrophobicContact CE2-CB 3.86Å; F62-R73 VanDerWaalsContact CG-CZ 3.47Å; F62-R73 HydrophobicContact CZ-CB 3.92Å; F62-V112 HydrophobicContact CE1-CB 4.14Å; F62-V112 HydrophobicContact CE1-CG2 4.07Å; F62-M113 PolarHBondContact N-O 2.84Å; F62-A114 HydrophobicContact CD2-CB 4.25Å; F62-A114 HydrophobicContact CE2-CB 3.63Å; F62-A114 HydrophobicContact CZ-CB 4Å; F62-A114 CarbonylContact O-C 3.47Å; F62-A114 WeakPolarHBondContact O-CA 3.31Å; F62-K115 PolarHBondContact O-N 3.25Å
63	N	98.3	Very high	86.2	Confident	89 Å²	89	88.4 Å²	88.4	48%	0.476	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	137.3	172	-54.9	-37.9	0	0	0	109.4	Q65 K115	N63-Q65 PolarHBondContact O-NE2 2.91Å; N63-K115 WeakPolarHBondContact OD1-CB 3.41Å
64	I	98.6	Very high	88	Confident	6 Å²	6	79.5 Å²	79.5	3%	0.031	42%	0.421	C	S	.	.			trans	-71.5	140.2	172.5	-64.4	-60.6	0	0	0	109.6	F62 D69 F70 V74 A114 K115 V116 H121 L124	F62-I64 HydrophobicContact CD2-CD1 4.08Å; F62-I64 HydrophobicContact CE2-CD1 3.72Å; I64-D69 WeakPolarHBondContact CA-OD2 3.11Å; I64-F70 HydrophobicContact CD1-CB 4.44Å; I64-F70 HydrophobicContact CD1-CD2 4.14Å; I64-F70 HydrophobicContact CG1-CD2 4.04Å; I64-F70 HydrophobicContact CG2-CB 4Å; I64-F70 HydrophobicContact CG2-CD2 4.31Å; I64-V74 HydrophobicContact CD1-CG2 3.92Å; I64-A114 HydrophobicContact CD1-CB 4.03Å; I64-A114 HydrophobicContact CG1-CB 4.07Å; I64-K115 PolarHBondContact N-O 3.41Å; I64-V116 HydrophobicContact CB-CG2 4.17Å; I64-V116 HydrophobicContact CG1-CG2 3.76Å; I64-H121 PolarHBondContact O-NE2 3.18Å; I64-H121 VanDerWaalsContact O-NE2 3.17Å; I64-L124 HydrophobicContact CG2-CD1 4.09Å
65	Q	98.1	Very high	89.7	Confident	131 Å²	131	74.9 Å²	74.9	61%	0.612	39%	0.393	S	S	*	.			trans	-102.3	-37.2	-178.7	-57.6	-54.2	-66.8	0	0	113.2	N63 D69 H121	N63-Q65 PolarHBondContact O-NE2 2.91Å; Q65-D69 HydrophobicContact CB-CB 4.23Å; Q65-D69 PolarHBondContact N-OD2 3.12Å; Q65-H121 PolarHBondContact O-CE1 3.18Å
66	D	98.4	Very high	91.5	Very high	78 Å²	78	74 Å²	74	42%	0.417	38%	0.384	S	S	.	.	S	Bend	trans	-165.4	-179.6	-179.9	56.2	29	0	0	0	110.9	P68 D69 F70	D66-P68 VanDerWaalsContact OD1-CD 3.3Å; D66-P68 WeakPolarHBondContact OD1-CD 3.42Å; D66-D69 PolarHBondContact O-N 3.01Å; D66-D69 VanDerWaalsContact OD1-CB 3.31Å; D66-D69 WeakPolarHBondContact OD1-CB 3.37Å; D66-D69 PolarHBondContact OD1-N 2.98Å; D66-F70 PolarHBondContact O-N 3.09Å
67	G	98	Very high	93.2	Very high	29 Å²	29	63.7 Å²	63.7	30%	0.299	35%	0.348	S	S	.	.	H	α-helix	trans	-57.9	-47.9	177.8	0	0	0	0	0	114.1	D69 F70 Q71	G67-D69 VanDerWaalsContact C-N 3.34Å; G67-D69 PolarHBondContact O-N 2.65Å; G67-F70 WeakPolarHBondContact O-CB 3.4Å; G67-F70 PolarHBondContact O-N 3.37Å; G67-Q71 PolarHBondContact O-N 3.24Å
68	P	98.6	Very high	95	Very high	95 Å²	95	66.4 Å²	66.4	62%	0.617	36%	0.358	S	S	*	.	H	α-helix	trans	-56.4	-41.4	173.2	-28.6	35.6	0	0	0	114.3	D66 Q71 D72	D66-P68 VanDerWaalsContact OD1-CD 3.3Å; D66-P68 WeakPolarHBondContact OD1-CD 3.42Å; P68-Q71 PolarHBondContact O-N 3.07Å; P68-D72 PolarHBondContact O-N 3.39Å
69	D	98.7	Very high	96.8	Very high	31 Å²	31	64 Å²	64	17%	0.166	34%	0.339	C	S	.	.	H	α-helix	trans	-63	-40.7	175.2	-173.9	56.8	0	0	0	111.5	I64 Q65 D66 G67 R73	I64-D69 WeakPolarHBondContact CA-OD2 3.11Å; Q65-D69 HydrophobicContact CB-CB 4.23Å; Q65-D69 PolarHBondContact N-OD2 3.12Å; D66-D69 PolarHBondContact O-N 3.01Å; D66-D69 VanDerWaalsContact OD1-CB 3.31Å; D66-D69 WeakPolarHBondContact OD1-CB 3.37Å; D66-D69 PolarHBondContact OD1-N 2.98Å; G67-D69 VanDerWaalsContact C-N 3.34Å; G67-D69 PolarHBondContact O-N 2.65Å; D69-R73 WeakPolarHBondContact O-CB 3.48Å; D69-R73 WeakPolarHBondContact O-CG 3.33Å; D69-R73 PolarHBondContact O-N 3.41Å; D69-R73 WeakPolarHBondContact OD1-CD 3.33Å; D69-R73 IonicContact OD1-CZ 2.65Å; D69-R73 IonicContact OD1-NE 3.13Å; D69-R73 IonicContact OD1-NH1 2.77Å; D69-R73 PolarHBondContact OD1-NH1 3.07Å; D69-R73 VanDerWaalsContact OD1-NH1 3.13Å; D69-R73 IonicContact OD2-NH1 3.9Å; D69-R73 PolarHBondContact OD2-NH1 3.43Å
70	F	98.7	Very high	97.8	Very high	4 Å²	4	58.8 Å²	58.8	2%	0.018	31%	0.313	C	S	.	.	H	α-helix	trans	-63.3	-45.4	173.4	-170.3	-85.9	0	0	0	112.1	I64 D66 G67 D72 V74 V75 V83 V116 L124 Y128 M139	I64-F70 HydrophobicContact CD1-CB 4.44Å; I64-F70 HydrophobicContact CD1-CD2 4.14Å; I64-F70 HydrophobicContact CG1-CD2 4.04Å; I64-F70 HydrophobicContact CG2-CB 4Å; I64-F70 HydrophobicContact CG2-CD2 4.31Å; D66-F70 PolarHBondContact O-N 3.09Å; G67-F70 WeakPolarHBondContact O-CB 3.4Å; G67-F70 PolarHBondContact O-N 3.37Å; F70-D72 PolarHBondContact O-N 3.12Å; F70-V74 HydrophobicContact CD1-CB 4.2Å; F70-V74 HydrophobicContact CD2-CB 4.21Å; F70-V74 HydrophobicContact CD2-CG2 3.78Å; F70-V74 HydrophobicContact CE1-CB 4.01Å; F70-V74 HydrophobicContact CE1-CG1 4.05Å; F70-V74 HydrophobicContact CE2-CB 4.05Å; F70-V74 HydrophobicContact CE2-CG1 4.03Å; F70-V74 HydrophobicContact CE2-CG2 3.83Å; F70-V74 HydrophobicContact CG-CB 4.29Å; F70-V74 HydrophobicContact CG-CG2 4.19Å; F70-V74 HydrophobicContact CZ-CB 3.95Å; F70-V74 HydrophobicContact CZ-CG1 3.68Å; F70-V74 HydrophobicContact CZ-CG2 4.26Å; F70-V74 WeakPolarHBondContact O-CA 3.27Å; F70-V74 VanDerWaalsContact O-CB 3.23Å; F70-V74 WeakPolarHBondContact O-CB 3.33Å; F70-V74 PolarHBondContact O-N 2.91Å; F70-V75 HydrophobicContact CD1-CG2 3.86Å; F70-V75 HydrophobicContact CE1-CG2 3.73Å; F70-V75 PolarHBondContact O-N 3.37Å; F70-V83 HydrophobicContact CE2-CG1 3.99Å; F70-V83 HydrophobicContact CE2-CG2 4.37Å; F70-V83 HydrophobicContact CZ-CG2 4.46Å; F70-V116 HydrophobicContact CD2-CG2 4.32Å; F70-V116 HydrophobicContact CE2-CG2 4.2Å; F70-L124 HydrophobicContact CB-CD1 3.99Å; F70-L124 HydrophobicContact CB-CD2 4.28Å; F70-L124 HydrophobicContact CD1-CD2 4.01Å; F70-L124 HydrophobicContact CD2-CD1 3.61Å; F70-L124 HydrophobicContact CD2-CD2 4.3Å; F70-L124 HydrophobicContact CE1-CD2 4.46Å; F70-L124 HydrophobicContact CE2-CD1 4.28Å; F70-L124 HydrophobicContact CG-CD1 3.85Å; F70-L124 HydrophobicContact CG-CD2 3.93Å; F70-Y128 AromaticContact CE1-CE2 3.63Å; F70-Y128 HydrophobicContact CE1-CE2 3.63Å; F70-Y128 AromaticContact CE1-CZ 3.69Å; F70-Y128 WeakPolarHBondContact CE1-OH 3.3Å; F70-Y128 HydrophobicContact CZ-CD2 4.44Å; F70-Y128 AromaticContact CZ-CE2 3.76Å; F70-Y128 HydrophobicContact CZ-CE2 3.76Å; F70-Y128 AromaticContact CZ-CZ 3.91Å; F70-M139 HydrophobicContact CZ-SD 4.11Å
71	Q	98.5	Very high	98.2	Very high	91 Å²	91	57.6 Å²	57.6	43%	0.425	31%	0.306	S	S	.	.	I	π-helix	trans	-59	-46.9	178.2	-177.9	65	40.1	0	0	111.4	G67 P68 V75 N76	G67-Q71 PolarHBondContact O-N 3.24Å; P68-Q71 PolarHBondContact O-N 3.07Å; Q71-V75 VanDerWaalsContact NE2-CG1 3.29Å; Q71-V75 WeakPolarHBondContact O-CB 3.33Å; Q71-V75 PolarHBondContact O-N 3.08Å; Q71-N76 PolarHBondContact NE2-OD1 2.86Å; Q71-N76 VanDerWaalsContact NE2-OD1 3.14Å; Q71-N76 WeakPolarHBondContact O-CB 3.34Å; Q71-N76 VanDerWaalsContact O-CG 3.24Å; Q71-N76 PolarHBondContact O-N 3.37Å; Q71-N76 PolarHBondContact O-ND2 2.88Å
72	D	98.4	Very high	98.3	Very high	107 Å²	107	56.2 Å²	56.2	57%	0.572	30%	0.297	S	S	*	.	I	π-helix	trans	-68	-47	-178.3	-175.6	60.2	0	0	0	112.2	P68 F70	P68-D72 PolarHBondContact O-N 3.39Å; F70-D72 PolarHBondContact O-N 3.12Å
73	R	98.2	Very high	98.3	Very high	78 Å²	78	54.8 Å²	54.8	29%	0.294	29%	0.291	S	S	.	.	I	π-helix	trans	-99.6	-12.1	-165.7	-59.7	169.8	69.5	-170.3	8.4	114.7	F62 D69 S77	F62-R73 HydrophobicContact CE2-CB 3.86Å; F62-R73 VanDerWaalsContact CG-CZ 3.47Å; F62-R73 HydrophobicContact CZ-CB 3.92Å; D69-R73 WeakPolarHBondContact O-CB 3.48Å; D69-R73 WeakPolarHBondContact O-CG 3.33Å; D69-R73 PolarHBondContact O-N 3.41Å; D69-R73 WeakPolarHBondContact OD1-CD 3.33Å; D69-R73 IonicContact OD1-CZ 2.65Å; D69-R73 IonicContact OD1-NE 3.13Å; D69-R73 IonicContact OD1-NH1 2.77Å; D69-R73 PolarHBondContact OD1-NH1 3.07Å; D69-R73 VanDerWaalsContact OD1-NH1 3.13Å; D69-R73 IonicContact OD2-NH1 3.9Å; D69-R73 PolarHBondContact OD2-NH1 3.43Å; R73-S77 WeakPolarHBondContact O-CB 3.47Å
74	V	98.5	Very high	98.3	Very high	3 Å²	3	50.7 Å²	50.7	2%	0.018	27%	0.269	C	S	.	.	I	π-helix	trans	-115.9	-59.6	177.6	-172.9	0	0	0	0	110.2	I64 F70 S77 V81 V83 A114 M139	I64-V74 HydrophobicContact CD1-CG2 3.92Å; F70-V74 HydrophobicContact CD1-CB 4.2Å; F70-V74 HydrophobicContact CD2-CB 4.21Å; F70-V74 HydrophobicContact CD2-CG2 3.78Å; F70-V74 HydrophobicContact CE1-CB 4.01Å; F70-V74 HydrophobicContact CE1-CG1 4.05Å; F70-V74 HydrophobicContact CE2-CB 4.05Å; F70-V74 HydrophobicContact CE2-CG1 4.03Å; F70-V74 HydrophobicContact CE2-CG2 3.83Å; F70-V74 HydrophobicContact CG-CB 4.29Å; F70-V74 HydrophobicContact CG-CG2 4.19Å; F70-V74 HydrophobicContact CZ-CB 3.95Å; F70-V74 HydrophobicContact CZ-CG1 3.68Å; F70-V74 HydrophobicContact CZ-CG2 4.26Å; F70-V74 WeakPolarHBondContact O-CA 3.27Å; F70-V74 VanDerWaalsContact O-CB 3.23Å; F70-V74 WeakPolarHBondContact O-CB 3.33Å; F70-V74 PolarHBondContact O-N 2.91Å; V74-S77 WeakPolarHBondContact O-CB 3.44Å; V74-S77 PolarHBondContact O-N 3.11Å; V74-V81 HydrophobicContact CG1-CB 4.21Å; V74-V81 HydrophobicContact CG1-CG1 4.05Å; V74-V81 HydrophobicContact CG2-CG1 4.28Å; V74-V83 HydrophobicContact CG1-CG2 3.63Å; V74-A114 HydrophobicContact CG2-CB 3.71Å; V74-M139 HydrophobicContact CG1-CB 4.43Å; V74-M139 HydrophobicContact CG1-CE 4.18Å; V74-M139 HydrophobicContact CG1-SD 3.51Å; V74-M139 VanDerWaalsContact CG1-SD 3.51Å
75	V	98.6	Very high	98.4	Very high	28 Å²	28	50.4 Å²	50.4	17%	0.17	27%	0.268	C	S	.	.	I	π-helix	trans	-68.7	-46.1	-174	-177.2	0	0	0	0	111.1	F70 Q71 S77 G142	F70-V75 HydrophobicContact CD1-CG2 3.86Å; F70-V75 HydrophobicContact CE1-CG2 3.73Å; F70-V75 PolarHBondContact O-N 3.37Å; Q71-V75 VanDerWaalsContact NE2-CG1 3.29Å; Q71-V75 WeakPolarHBondContact O-CB 3.33Å; Q71-V75 PolarHBondContact O-N 3.08Å; V75-S77 VanDerWaalsContact C-N 3.3Å; V75-S77 PolarHBondContact O-N 3.43Å; V75-G142 VanDerWaalsContact O-CA 3.31Å; V75-G142 WeakPolarHBondContact O-CA 3.3Å; V75-G142 PolarHBondContact O-N 2.73Å
76	N	98.3	Very high	98.4	Very high	98 Å²	98	45.2 Å²	45.2	52%	0.524	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	9.7	-179.8	-61	-23.4	0	0	0	113.5	Q71 E78	Q71-N76 PolarHBondContact NE2-OD1 2.86Å; Q71-N76 VanDerWaalsContact NE2-OD1 3.14Å; Q71-N76 WeakPolarHBondContact O-CB 3.34Å; Q71-N76 VanDerWaalsContact O-CG 3.24Å; Q71-N76 PolarHBondContact O-N 3.37Å; Q71-N76 PolarHBondContact O-ND2 2.88Å; N76-E78 PolarHBondContact O-N 2.98Å
77	S	97.9	Very high	98.4	Very high	23 Å²	23	41.6 Å²	41.6	16%	0.161	23%	0.225	C	C	.	.			trans	-68.3	130.3	-176	-177.6	0	0	0	0	112.2	R73 V74 V75 T79 V81	R73-S77 WeakPolarHBondContact O-CB 3.47Å; V74-S77 WeakPolarHBondContact O-CB 3.44Å; V74-S77 PolarHBondContact O-N 3.11Å; V75-S77 VanDerWaalsContact C-N 3.3Å; V75-S77 PolarHBondContact O-N 3.43Å; S77-T79 VanDerWaalsContact C-N 3.26Å; S77-T79 WeakPolarHBondContact CB-O 3.5Å; S77-T79 PolarHBondContact OG-N 3.34Å; S77-T79 PolarHBondContact OG-O 2.76Å; S77-V81 WeakPolarHBondContact OG-CG2 3.4Å
78	E	96.7	Very high	98.4	Very high	194 Å²	194	46.3 Å²	46.3	91%	0.907	24%	0.239	S	C	*	.	S	Bend	trans	-71.5	-23.8	170.2	-61.6	-176.8	170.3	0	0	112.4	N76	N76-E78 PolarHBondContact O-N 2.98Å
79	T	97.4	Very high	98.4	Very high	47 Å²	47	49.5 Å²	49.5	29%	0.288	24%	0.239	S	C	.	.	S	Bend	trans	-99.5	138.1	178.8	-57.3	0	0	0	0	109.7	S77 V81 G109 V112	S77-T79 VanDerWaalsContact C-N 3.26Å; S77-T79 WeakPolarHBondContact CB-O 3.5Å; S77-T79 PolarHBondContact OG-N 3.34Å; S77-T79 PolarHBondContact OG-O 2.76Å; T79-V81 VanDerWaalsContact O-CG2 3.26Å; T79-V81 WeakPolarHBondContact O-CG2 3.45Å; T79-V81 PolarHBondContact O-N 3.38Å; T79-G109 WeakPolarHBondContact CG2-O 3.48Å; T79-V112 HydrophobicContact CG2-CG1 4.26Å
80	P	98.5	Very high	98.4	Very high	18 Å²	18	48.3 Å²	48.3	12%	0.117	23%	0.233	C	C	.	.			trans	-53.5	140.9	172.6	-23.7	32.2	0	0	0	112	V111 V112 K140 L164	P80-V111 WeakPolarHBondContact O-CA 3.41Å; P80-V111 WeakPolarHBondContact O-CG2 3.28Å; P80-V112 PolarHBondContact O-N 2.78Å; P80-K140 HydrophobicContact CG-CD 4.32Å; P80-K140 HydrophobicContact CG-CG 4.38Å; P80-L164 HydrophobicContact CB-CD1 3.86Å; P80-L164 HydrophobicContact CB-CD2 3.97Å; P80-L164 HydrophobicContact CB-CG 3.67Å
81	V	98.8	Very high	98.4	Very high	1 Å²	1	50.1 Å²	50.1	1%	0.006	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	134.2	-174.6	-171.5	0	0	0	0	109.9	V74 S77 T79 V83 V112 A114 M139	V74-V81 HydrophobicContact CG1-CB 4.21Å; V74-V81 HydrophobicContact CG1-CG1 4.05Å; V74-V81 HydrophobicContact CG2-CG1 4.28Å; S77-V81 WeakPolarHBondContact OG-CG2 3.4Å; T79-V81 VanDerWaalsContact O-CG2 3.26Å; T79-V81 WeakPolarHBondContact O-CG2 3.45Å; T79-V81 PolarHBondContact O-N 3.38Å; V81-V83 HydrophobicContact CG1-CG2 4.2Å; V81-V112 CarbonylContact C-O 3.57Å; V81-V112 WeakPolarHBondContact CA-O 3.25Å; V81-V112 HydrophobicContact CB-CG2 4.31Å; V81-V112 HydrophobicContact CG1-CG2 4.2Å; V81-V112 HydrophobicContact CG2-CG2 3.73Å; V81-A114 HydrophobicContact CG1-CB 3.98Å; V81-M139 PolarHBondContact N-O 3.09Å; V81-M139 PolarHBondContact O-N 2.93Å
82	V	98.8	Very high	98.4	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	126.3	162	-66.1	0	0	0	0	109.5	V104 V111 V112 M113 A114 V136 L137 F160 L161 L164	V82-V104 HydrophobicContact CG2-CG2 3.64Å; V82-V111 HydrophobicContact CG1-CG2 4.07Å; V82-V111 HydrophobicContact CG2-CG2 4.42Å; V82-V112 WeakPolarHBondContact CG2-O 3.49Å; V82-V112 PolarHBondContact N-O 2.86Å; V82-M113 HydrophobicContact CG2-CB 3.79Å; V82-M113 HydrophobicContact CG2-CG 4.01Å; V82-M113 CarbonylContact O-C 3.59Å; V82-M113 VanDerWaalsContact O-CA 3.27Å; V82-M113 WeakPolarHBondContact O-CA 3.27Å; V82-A114 PolarHBondContact O-N 2.89Å; V82-V136 HydrophobicContact CB-CG1 4.35Å; V82-L137 CarbonylContact C-O 3.51Å; V82-L137 VanDerWaalsContact CA-O 3.27Å; V82-L137 WeakPolarHBondContact CA-O 3.34Å; V82-F160 HydrophobicContact CG1-CE1 3.86Å; V82-L161 HydrophobicContact CG1-CD2 3.65Å; V82-L164 HydrophobicContact CG1-CD2 3.7Å
83	V	98.9	Very high	98.4	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	113.4	-179.9	-171.2	0	0	0	0	108.6	F70 V74 V81 F85 A114 V116 V136 L137 M139	F70-V83 HydrophobicContact CE2-CG1 3.99Å; F70-V83 HydrophobicContact CE2-CG2 4.37Å; F70-V83 HydrophobicContact CZ-CG2 4.46Å; V74-V83 HydrophobicContact CG1-CG2 3.63Å; V81-V83 HydrophobicContact CG1-CG2 4.2Å; V83-F85 HydrophobicContact CB-CE2 4.08Å; V83-F85 HydrophobicContact CG1-CD2 3.91Å; V83-F85 HydrophobicContact CG1-CE2 3.43Å; V83-F85 VanDerWaalsContact CG1-CE2 3.43Å; V83-F85 HydrophobicContact CG1-CZ 3.88Å; V83-A114 CarbonylContact C-O 3.53Å; V83-A114 WeakPolarHBondContact CA-O 3.23Å; V83-A114 HydrophobicContact CG2-CB 4.41Å; V83-V116 HydrophobicContact CG1-CG2 3.61Å; V83-V136 CarbonylContact O-C 3.54Å; V83-V136 VanDerWaalsContact O-CA 3.25Å; V83-V136 WeakPolarHBondContact O-CA 3.25Å; V83-L137 HydrophobicContact CB-CB 4.32Å; V83-L137 PolarHBondContact N-O 3.48Å; V83-L137 PolarHBondContact O-N 3.34Å; V83-M139 HydrophobicContact CG2-CG 4.21Å; V83-M139 HydrophobicContact CG2-SD 3.7Å
84	D	98.9	Very high	98.4	Very high	2 Å²	2	46.9 Å²	46.9	1%	0.011	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	102.2	177.2	177.9	31.8	0	0	0	110	H86 L100 M113 A114 V116	D84-H86 IonicContact OD2-CD2 3.41Å; D84-L100 HydrophobicContact CB-CD2 4.43Å; D84-M113 HydrophobicContact CB-CE 3.49Å; D84-M113 VanDerWaalsContact CB-CE 3.49Å; D84-M113 WeakPolarHBondContact OD2-CE 3.34Å; D84-A114 PolarHBondContact N-O 3Å; D84-V116 PolarHBondContact O-N 2.9Å
85	F	98.9	Very high	98.4	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	115.4	170.9	-68.9	-92.8	0	0	0	109.4	V83 V116 I118 L124 Y128 V130 V133 P134 T135 L137	V83-F85 HydrophobicContact CB-CE2 4.08Å; V83-F85 HydrophobicContact CG1-CD2 3.91Å; V83-F85 HydrophobicContact CG1-CE2 3.43Å; V83-F85 VanDerWaalsContact CG1-CE2 3.43Å; V83-F85 HydrophobicContact CG1-CZ 3.88Å; F85-V116 WeakPolarHBondContact CA-O 3.43Å; F85-V116 HydrophobicContact CD1-CB 3.77Å; F85-V116 HydrophobicContact CD1-CG1 3.67Å; F85-V116 HydrophobicContact CE1-CB 3.95Å; F85-V116 HydrophobicContact CE1-CG1 3.65Å; F85-V116 HydrophobicContact CE1-CG2 4.3Å; F85-V116 HydrophobicContact CG-CB 4.34Å; F85-I118 HydrophobicContact CB-CG2 3.99Å; F85-I118 HydrophobicContact CD1-CG2 3.98Å; F85-I118 HydrophobicContact CG-CG2 4.5Å; F85-L124 HydrophobicContact CE1-CB 4.2Å; F85-Y128 HydrophobicContact CZ-CD2 4.34Å; F85-Y128 HydrophobicContact CZ-CG 4.32Å; F85-V130 HydrophobicContact CB-CG1 3.94Å; F85-V130 HydrophobicContact CB-CG2 4.39Å; F85-V130 HydrophobicContact CD1-CB 4.49Å; F85-V130 HydrophobicContact CD1-CG1 4.47Å; F85-V130 HydrophobicContact CD1-CG2 3.93Å; F85-V130 HydrophobicContact CD2-CG2 3.77Å; F85-V130 HydrophobicContact CE1-CG2 4.04Å; F85-V130 HydrophobicContact CE2-CG2 3.91Å; F85-V130 HydrophobicContact CG-CB 4.48Å; F85-V130 HydrophobicContact CG-CG1 4.18Å; F85-V130 HydrophobicContact CG-CG2 3.77Å; F85-V130 HydrophobicContact CZ-CG2 4.04Å; F85-V133 WeakPolarHBondContact O-CG1 3.36Å; F85-P134 WeakPolarHBondContact O-CA 3.09Å; F85-T135 WeakPolarHBondContact CB-O 3.32Å; F85-T135 PolarHBondContact N-O 3.49Å; F85-T135 PolarHBondContact O-N 3.15Å; F85-L137 HydrophobicContact CD2-CD1 4.44Å; F85-L137 HydrophobicContact CD2-CG 4.32Å; F85-L137 HydrophobicContact CE2-CD1 3.6Å; F85-L137 HydrophobicContact CE2-CG 3.91Å; F85-L137 HydrophobicContact CZ-CD1 4.36Å
86	H	98.9	Very high	98.4	Very high	22 Å²	22	49.7 Å²	49.7	10%	0.102	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	176.5	-175.3	72.4	69.3	0	0	0	112.2	D84 C93 V116 D117 I118	D84-H86 IonicContact OD2-CD2 3.41Å; H86-C93 HydrophobicContact CB-CB 4.09Å; H86-V116 PolarHBondContact N-O 3.38Å; H86-D117 IonicContact CE1-OD2 3.52Å; H86-D117 PolarHBondContact CE1-OD2 2.98Å; H86-D117 IonicContact ND1-OD2 2.7Å; H86-D117 WeakPolarHBondContact O-CA 3.36Å; H86-I118 WeakPolarHBondContact O-CG1 3.45Å; H86-I118 PolarHBondContact O-N 3.17Å
87	A	98.7	Very high	98.4	Very high	3 Å²	3	45.2 Å²	45.2	3%	0.025	23%	0.232	C	C	.	.			trans	-148.7	156.6	169.7	0	0	0	0	0	111.2	W89 C90 I118 V133	A87-W89 VanDerWaalsContact C-N 3.3Å; A87-W89 HydrophobicContact CB-CD2 3.85Å; A87-W89 HydrophobicContact CB-CE3 4.48Å; A87-W89 HydrophobicContact CB-CG 4.23Å; A87-W89 HydrophobicContact CB-CH2 4.27Å; A87-W89 HydrophobicContact CB-CZ2 3.6Å; A87-W89 PolarHBondContact O-N 2.94Å; A87-C90 HydrophobicContact CB-CB 4.29Å; A87-C90 VanDerWaalsContact O-CB 3.32Å; A87-C90 WeakPolarHBondContact O-CB 3.44Å; A87-C90 PolarHBondContact O-N 3.01Å; A87-C90 VanDerWaalsContact O-N 3.15Å; A87-I118 HydrophobicContact CB-CD1 4.36Å; A87-I118 HydrophobicContact CB-CG1 3.93Å; A87-V133 HydrophobicContact CB-CG2 4.33Å
88	Q	98.3	Very high	98.5	Very high	127 Å²	127	47.7 Å²	47.7	59%	0.593	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-32.2	-178.4	-60	-52.5	-50.9	0	0	113.8	C90 K94 D117	Q88-C90 VanDerWaalsContact C-N 3.28Å; Q88-K94 VanDerWaalsContact O-CE 3.28Å; Q88-K94 WeakPolarHBondContact O-CE 3.38Å; Q88-K94 PolarHBondContact O-NZ 2.99Å; Q88-D117 PolarHBondContact NE2-OD2 2.9Å
89	W	98.1	Very high	98.5	Very high	162 Å²	162	41.9 Å²	41.9	61%	0.614	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-8.5	178.5	50.1	-100.6	0	0	0	113.1	A87 G91 I118 D119 V133	A87-W89 VanDerWaalsContact C-N 3.3Å; A87-W89 HydrophobicContact CB-CD2 3.85Å; A87-W89 HydrophobicContact CB-CE3 4.48Å; A87-W89 HydrophobicContact CB-CG 4.23Å; A87-W89 HydrophobicContact CB-CH2 4.27Å; A87-W89 HydrophobicContact CB-CZ2 3.6Å; A87-W89 PolarHBondContact O-N 2.94Å; W89-G91 PolarHBondContact O-N 3.17Å; W89-I118 HydrophobicContact CH2-CD1 4.36Å; W89-I118 HydrophobicContact CZ2-CD1 3.88Å; W89-D119 VanDerWaalsContact CD1-OD2 3.23Å; W89-D119 PolarHBondContact NE1-OD1 3.46Å; W89-D119 PolarHBondContact NE1-OD2 3.4Å; W89-V133 HydrophobicContact CH2-CG2 3.55Å; W89-V133 HydrophobicContact CZ2-CG2 4.28Å; W89-V133 HydrophobicContact CZ3-CG2 3.89Å
90	C	98.3	Very high	98.6	Very high	6 Å²	6	39.7 Å²	39.7	4%	0.041	20%	0.204	C	C	.	.			trans	-82	106	-177.4	173.1	0	0	0	0	111.6	A87 Q88 C93 V133	A87-C90 HydrophobicContact CB-CB 4.29Å; A87-C90 VanDerWaalsContact O-CB 3.32Å; A87-C90 WeakPolarHBondContact O-CB 3.44Å; A87-C90 PolarHBondContact O-N 3.01Å; A87-C90 VanDerWaalsContact O-N 3.15Å; Q88-C90 VanDerWaalsContact C-N 3.28Å; C90-C93 HydrophobicContact CB-CB 3.66Å; C90-C93 WeakPolarHBondContact CB-SG 3.38Å; C90-C93 PolarHBondContact O-N 3.44Å; C90-C93 WeakPolarHBondContact SG-CB 3.44Å; C90-C93 PolarHBondContact SG-N 2.89Å; C90-C93 CovalentContact SG-SG 2.04Å; C90-C93 PolarHBondContact SG-SG 2.82Å; C90-V133 HydrophobicContact CB-CG2 3.91Å
91	G	98.5	Very high	98.6	Very high	43 Å²	43	41.6 Å²	41.6	44%	0.443	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-54.2	174.5	0	0	0	0	0	113.7	W89 C93 K94	W89-G91 PolarHBondContact O-N 3.17Å; G91-C93 PolarHBondContact O-N 3.14Å; G91-K94 WeakPolarHBondContact O-CB 3.27Å; G91-K94 PolarHBondContact O-N 3.23Å; G91-K94 VanDerWaalsContact O-N 3.1Å
92	P	98.6	Very high	98.5	Very high	64 Å²	64	46.5 Å²	46.5	42%	0.416	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-34.7	177.7	-31.8	39.4	0	0	0	114.9	K94 I95 L96 I151	P92-K94 VanDerWaalsContact C-N 3.25Å; P92-K94 PolarHBondContact O-N 3.3Å; P92-I95 PolarHBondContact O-N 3.42Å; P92-I95 VanDerWaalsContact O-N 3.08Å; P92-L96 PolarHBondContact O-N 2.97Å; P92-L96 VanDerWaalsContact O-N 3.08Å; P92-I151 HydrophobicContact CB-CD1 3.83Å; P92-I151 HydrophobicContact CB-CG1 3.96Å
93	C	98.8	Very high	98.5	Very high	9 Å²	9	46.6 Å²	46.6	6%	0.061	23%	0.233	C	C	.	.	H	α-helix	trans	-62.2	-34	179.2	-57.3	0	0	0	0	111.9	H86 C90 G91 I95 L96 G97	H86-C93 HydrophobicContact CB-CB 4.09Å; C90-C93 HydrophobicContact CB-CB 3.66Å; C90-C93 WeakPolarHBondContact CB-SG 3.38Å; C90-C93 PolarHBondContact O-N 3.44Å; C90-C93 WeakPolarHBondContact SG-CB 3.44Å; C90-C93 PolarHBondContact SG-N 2.89Å; C90-C93 CovalentContact SG-SG 2.04Å; C90-C93 PolarHBondContact SG-SG 2.82Å; G91-C93 PolarHBondContact O-N 3.14Å; C93-I95 PolarHBondContact O-N 3.34Å; C93-L96 PolarHBondContact O-N 3.25Å; C93-G97 PolarHBondContact O-N 2.77Å
94	K	98.5	Very high	98.4	Very high	134 Å²	134	46.6 Å²	46.6	58%	0.583	23%	0.233	S	C	*	.	H	α-helix	trans	-66.5	-17.5	177.3	-62	175.5	-177.1	175.1	0	113.3	Q88 G91 P92 P98	Q88-K94 VanDerWaalsContact O-CE 3.28Å; Q88-K94 WeakPolarHBondContact O-CE 3.38Å; Q88-K94 PolarHBondContact O-NZ 2.99Å; G91-K94 WeakPolarHBondContact O-CB 3.27Å; G91-K94 PolarHBondContact O-N 3.23Å; G91-K94 VanDerWaalsContact O-N 3.1Å; P92-K94 VanDerWaalsContact C-N 3.25Å; P92-K94 PolarHBondContact O-N 3.3Å; K94-P98 WeakPolarHBondContact O-CD 3.29Å
95	I	98.4	Very high	98.3	Very high	90 Å²	90	48.8 Å²	48.8	46%	0.462	25%	0.251	S	S	.	.	H	α-helix	trans	-93.8	-46.3	173.5	-57.1	-59.2	0	0	0	110.7	P92 C93 R99 I151	P92-I95 PolarHBondContact O-N 3.42Å; P92-I95 VanDerWaalsContact O-N 3.08Å; C93-I95 PolarHBondContact O-N 3.34Å; I95-R99 WeakPolarHBondContact O-CB 3.5Å; I95-I151 HydrophobicContact CB-CD1 4.4Å
96	L	98.8	Very high	98.2	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-68.4	-46.2	-176.2	-176.6	67.1	0	0	0	112.2	P92 C93 R99 L100 P134 V136 F148 L157	P92-L96 PolarHBondContact O-N 2.97Å; P92-L96 VanDerWaalsContact O-N 3.08Å; C93-L96 PolarHBondContact O-N 3.25Å; L96-R99 WeakPolarHBondContact O-CB 3.38Å; L96-R99 PolarHBondContact O-N 2.88Å; L96-R99 VanDerWaalsContact O-N 3.14Å; L96-L100 WeakPolarHBondContact O-CB 3.42Å; L96-L100 PolarHBondContact O-N 2.91Å; L96-P134 HydrophobicContact CB-CG 4.45Å; L96-P134 HydrophobicContact CD2-CB 3.57Å; L96-P134 HydrophobicContact CD2-CG 3.64Å; L96-V136 HydrophobicContact CD2-CG2 3.91Å; L96-F148 HydrophobicContact CD1-CE2 4.48Å; L96-F148 HydrophobicContact CD2-CE2 4.03Å; L96-F148 HydrophobicContact CD2-CZ 4.5Å; L96-L157 HydrophobicContact CD1-CD1 4.29Å; L96-L157 HydrophobicContact CD1-CD2 4.41Å
97	G	98.4	Very high	98	Very high	4 Å²	4	53.9 Å²	53.9	4%	0.041	27%	0.273	C	S	.	.	H	α-helix	trans	-52.9	-60.1	-174.4	0	0	0	0	0	112.8	C93 R99 L100 E101	C93-G97 PolarHBondContact O-N 2.77Å; G97-R99 VanDerWaalsContact C-N 3.25Å; G97-R99 PolarHBondContact O-N 3.23Å; G97-L100 PolarHBondContact O-N 3.06Å; G97-L100 VanDerWaalsContact O-N 3.17Å; G97-E101 WeakPolarHBondContact O-CB 3.35Å; G97-E101 VanDerWaalsContact O-CG 3.29Å; G97-E101 WeakPolarHBondContact O-CG 3.49Å; G97-E101 PolarHBondContact O-N 2.91Å
98	P	98.4	Very high	97.8	Very high	75 Å²	75	61.8 Å²	61.8	49%	0.487	31%	0.31	S	S	.	.	H	α-helix	trans	-61.3	-32	179.1	-24.3	34.5	0	0	0	113.8	K94 K102	K94-P98 WeakPolarHBondContact O-CD 3.29Å; P98-K102 WeakPolarHBondContact O-CB 3.42Å; P98-K102 PolarHBondContact O-N 2.64Å; P98-K102 VanDerWaalsContact O-N 3.09Å
99	R	98.4	Very high	97.7	Very high	73 Å²	73	57.2 Å²	57.2	28%	0.275	30%	0.296	S	S	.	.	H	α-helix	trans	-68.4	-46.2	176.7	-173.7	-176.7	-67.1	163.5	-0.5	110.7	I95 L96 G97 K102 M103 K152 E154 L157	I95-R99 WeakPolarHBondContact O-CB 3.5Å; L96-R99 WeakPolarHBondContact O-CB 3.38Å; L96-R99 PolarHBondContact O-N 2.88Å; L96-R99 VanDerWaalsContact O-N 3.14Å; G97-R99 VanDerWaalsContact C-N 3.25Å; G97-R99 PolarHBondContact O-N 3.23Å; R99-K102 PolarHBondContact O-N 3.06Å; R99-M103 WeakPolarHBondContact O-CG 3.49Å; R99-M103 PolarHBondContact O-N 2.8Å; R99-M103 VanDerWaalsContact O-N 3.12Å; R99-K152 WeakPolarHBondContact CD-O 3.49Å; R99-K152 PolarHBondContact NH1-O 2.86Å; R99-E154 HydrophobicContact CG-CG 3.96Å; R99-L157 HydrophobicContact CB-CD1 4.45Å; R99-L157 HydrophobicContact CG-CD1 3.78Å
100	L	98.6	Very high	97.6	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-65.9	-43.7	178.1	-174.5	56.6	0	0	0	111.2	D84 L96 G97 K102 M103 V104 M113 V136 L157	D84-L100 HydrophobicContact CB-CD2 4.43Å; L96-L100 WeakPolarHBondContact O-CB 3.42Å; L96-L100 PolarHBondContact O-N 2.91Å; G97-L100 PolarHBondContact O-N 3.06Å; G97-L100 VanDerWaalsContact O-N 3.17Å; L100-K102 VanDerWaalsContact C-N 3.32Å; L100-K102 PolarHBondContact O-N 3.18Å; L100-M103 PolarHBondContact O-N 3.27Å; L100-V104 HydrophobicContact CD1-CG2 4.28Å; L100-V104 HydrophobicContact CG-CG2 4.44Å; L100-V104 WeakPolarHBondContact O-CG2 3.27Å; L100-V104 PolarHBondContact O-N 3.1Å; L100-M113 HydrophobicContact CB-CE 4.32Å; L100-M113 HydrophobicContact CB-SD 4.34Å; L100-M113 HydrophobicContact CD2-CE 4.02Å; L100-M113 HydrophobicContact CD2-SD 4.26Å; L100-M113 HydrophobicContact CG-CE 4.2Å; L100-M113 HydrophobicContact CG-SD 3.95Å; L100-V136 HydrophobicContact CD2-CG1 3.93Å; L100-V136 HydrophobicContact CD2-CG2 3.89Å; L100-L157 HydrophobicContact CB-CD1 4.46Å; L100-L157 HydrophobicContact CD1-CD1 4.33Å; L100-L157 HydrophobicContact CD1-CD2 3.93Å
101	E	98.3	Very high	97.6	Very high	58 Å²	58	55.5 Å²	55.5	27%	0.271	29%	0.293	S	S	.	.	H	α-helix	trans	-54.2	-47.2	174	-73.4	176.8	-169	0	0	111.6	T61 G97 M103 V104 A105 M113 K115	T61-E101 HydrophobicContact CG2-CG 3.88Å; G97-E101 WeakPolarHBondContact O-CB 3.35Å; G97-E101 VanDerWaalsContact O-CG 3.29Å; G97-E101 WeakPolarHBondContact O-CG 3.49Å; G97-E101 PolarHBondContact O-N 2.91Å; E101-M103 VanDerWaalsContact C-N 3.34Å; E101-M103 PolarHBondContact O-N 3.32Å; E101-V104 PolarHBondContact O-N 3.23Å; E101-A105 WeakPolarHBondContact O-CB 3.46Å; E101-A105 PolarHBondContact O-N 3.42Å; E101-M113 HydrophobicContact CB-SD 4.35Å; E101-M113 HydrophobicContact CG-CE 3.93Å; E101-M113 HydrophobicContact CG-SD 3.59Å; E101-M113 VanDerWaalsContact CG-SD 3.59Å; E101-K115 WeakPolarHBondContact OE1-CD 3.26Å; E101-K115 IonicContact OE1-NZ 4Å; E101-K115 PolarHBondContact OE1-NZ 3.46Å
102	K	97.3	Very high	97.6	Very high	104 Å²	104	54.5 Å²	54.5	45%	0.452	28%	0.277	S	S	.	.	H	α-helix	trans	-59.3	-43.4	175.6	178.3	-171.4	172.8	-161.6	0	112	P98 R99 L100 K106 E154	P98-K102 WeakPolarHBondContact O-CB 3.42Å; P98-K102 PolarHBondContact O-N 2.64Å; P98-K102 VanDerWaalsContact O-N 3.09Å; R99-K102 PolarHBondContact O-N 3.06Å; L100-K102 VanDerWaalsContact C-N 3.32Å; L100-K102 PolarHBondContact O-N 3.18Å; K102-K106 WeakPolarHBondContact O-CG 3.36Å; K102-K106 PolarHBondContact O-N 3.33Å; K102-E154 IonicContact NZ-OE1 2.74Å; K102-E154 PolarHBondContact NZ-OE1 3.44Å; K102-E154 IonicContact NZ-OE2 3.4Å; K102-E154 PolarHBondContact NZ-OE2 3.13Å
103	M	97.8	Very high	97.6	Very high	2 Å²	2	51.4 Å²	51.4	1%	0.01	26%	0.258	C	S	.	.	H	α-helix	trans	-70.8	-36.6	-178.4	-66.6	-55.6	-70.6	0	0	112.5	R99 L100 E101 K106 Q107 E154 L157 E158 L161	R99-M103 WeakPolarHBondContact O-CG 3.49Å; R99-M103 PolarHBondContact O-N 2.8Å; R99-M103 VanDerWaalsContact O-N 3.12Å; L100-M103 PolarHBondContact O-N 3.27Å; E101-M103 VanDerWaalsContact C-N 3.34Å; E101-M103 PolarHBondContact O-N 3.32Å; M103-K106 HydrophobicContact SD-CD 4.01Å; M103-K106 PolarHBondContact SD-NZ 3.08Å; M103-K106 VanDerWaalsContact SD-NZ 3.35Å; M103-Q107 WeakPolarHBondContact O-CG 3.37Å; M103-E154 HydrophobicContact SD-CB 4.21Å; M103-E154 HydrophobicContact SD-CG 4.27Å; M103-L157 HydrophobicContact CG-CB 4.21Å; M103-L157 HydrophobicContact CG-CD1 4.35Å; M103-E158 HydrophobicContact CE-CB 3.59Å; M103-E158 HydrophobicContact CE-CG 4.11Å; M103-L161 HydrophobicContact CB-CD1 3.8Å
104	V	98.1	Very high	97.6	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-67.2	-44.1	174.1	167.6	0	0	0	0	110.9	V82 L100 E101 K106 Q107 V111 M113 L161	V82-V104 HydrophobicContact CG2-CG2 3.64Å; L100-V104 HydrophobicContact CD1-CG2 4.28Å; L100-V104 HydrophobicContact CG-CG2 4.44Å; L100-V104 WeakPolarHBondContact O-CG2 3.27Å; L100-V104 PolarHBondContact O-N 3.1Å; E101-V104 PolarHBondContact O-N 3.23Å; V104-K106 PolarHBondContact O-N 3.08Å; V104-Q107 WeakPolarHBondContact O-CB 3.41Å; V104-Q107 PolarHBondContact O-N 3.33Å; V104-V111 HydrophobicContact CG1-CG1 4.33Å; V104-M113 HydrophobicContact CB-CB 4.46Å; V104-M113 HydrophobicContact CG1-CB 4.03Å; V104-M113 HydrophobicContact CG2-CB 4.2Å; V104-L161 HydrophobicContact CG2-CD1 4.15Å; V104-L161 HydrophobicContact CG2-CD2 4.15Å
105	A	96.4	Very high	97.6	Very high	48 Å²	48	46.7 Å²	46.7	40%	0.397	24%	0.236	S	C	.	.	H	α-helix	trans	-58.6	-35.9	178	0	0	0	0	0	112.7	E101 Q107 H108	E101-A105 WeakPolarHBondContact O-CB 3.46Å; E101-A105 PolarHBondContact O-N 3.42Å; A105-Q107 PolarHBondContact O-N 3.2Å; A105-H108 PolarHBondContact O-N 3.22Å
106	K	95.9	Very high	97.6	Very high	96 Å²	96	42.4 Å²	42.4	42%	0.417	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-17.4	174.2	-71.6	174	-178.7	176.2	0	113.8	K102 M103 V104 H108 E154	K102-K106 WeakPolarHBondContact O-CG 3.36Å; K102-K106 PolarHBondContact O-N 3.33Å; M103-K106 HydrophobicContact SD-CD 4.01Å; M103-K106 PolarHBondContact SD-NZ 3.08Å; M103-K106 VanDerWaalsContact SD-NZ 3.35Å; V104-K106 PolarHBondContact O-N 3.08Å; K106-H108 VanDerWaalsContact C-N 3.3Å; K106-H108 PolarHBondContact O-CD2 3.2Å; K106-H108 PolarHBondContact O-NE2 2.81Å; K106-E154 IonicContact NZ-OE2 3.75Å
107	Q	96.3	Very high	97.6	Very high	33 Å²	33	43 Å²	43	15%	0.154	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-0.9	-179.4	-53.8	-53.8	-32.1	0	0	113.3	M103 V104 A105 G109 K110 V111 L161 I165	M103-Q107 WeakPolarHBondContact O-CG 3.37Å; V104-Q107 WeakPolarHBondContact O-CB 3.41Å; V104-Q107 PolarHBondContact O-N 3.33Å; A105-Q107 PolarHBondContact O-N 3.2Å; Q107-G109 VanDerWaalsContact C-N 3.27Å; Q107-G109 PolarHBondContact O-N 2.95Å; Q107-K110 HydrophobicContact CB-CB 4.31Å; Q107-K110 WeakPolarHBondContact O-CB 2.87Å; Q107-K110 VanDerWaalsContact O-CG 3.31Å; Q107-K110 WeakPolarHBondContact O-CG 3.49Å; Q107-K110 PolarHBondContact O-N 3.16Å; Q107-K110 VanDerWaalsContact O-N 3.07Å; Q107-V111 HydrophobicContact CB-CG1 3.6Å; Q107-V111 HydrophobicContact CG-CG1 3.57Å; Q107-L161 HydrophobicContact CG-CD1 4.19Å; Q107-I165 HydrophobicContact CB-CD1 4.24Å; Q107-I165 HydrophobicContact CG-CD1 4.01Å
108	H	94.2	Very high	97.6	Very high	170 Å²	170	44.3 Å²	44.3	79%	0.787	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.6	42.3	172.9	-57.7	-71.8	0	0	0	113.8	A105 K106	A105-H108 PolarHBondContact O-N 3.22Å; K106-H108 VanDerWaalsContact C-N 3.3Å; K106-H108 PolarHBondContact O-CD2 3.2Å; K106-H108 PolarHBondContact O-NE2 2.81Å
109	G	94.9	Very high	97.6	Very high	30 Å²	30	44.8 Å²	44.8	31%	0.309	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	85	3.5	177.2	0	0	0	0	0	115.6	T79 Q107 V111	T79-G109 WeakPolarHBondContact CG2-O 3.48Å; Q107-G109 VanDerWaalsContact C-N 3.27Å; Q107-G109 PolarHBondContact O-N 2.95Å; G109-V111 PolarHBondContact O-N 2.83Å
110	K	96.8	Very high	97.6	Very high	133 Å²	133	47.3 Å²	47.3	58%	0.578	24%	0.24	S	C	*	.	S	Bend	trans	-69	-18.2	170.7	-65.7	178.2	180	-176.7	0	113.6	Q107 I165	Q107-K110 HydrophobicContact CB-CB 4.31Å; Q107-K110 WeakPolarHBondContact O-CB 2.87Å; Q107-K110 VanDerWaalsContact O-CG 3.31Å; Q107-K110 WeakPolarHBondContact O-CG 3.49Å; Q107-K110 PolarHBondContact O-N 3.16Å; Q107-K110 VanDerWaalsContact O-N 3.07Å; K110-I165 HydrophobicContact CB-CD1 3.98Å; K110-I165 HydrophobicContact CB-CG1 4.28Å; K110-I165 HydrophobicContact CB-CG2 4.37Å; K110-I165 HydrophobicContact CD-CG2 4.4Å
111	V	98.2	Very high	97.6	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.244	C	C	.	.	S	Bend	trans	-146.9	145.9	173.6	59.3	0	0	0	0	107.2	P80 V82 V104 Q107 G109 L161 L164 I165	P80-V111 WeakPolarHBondContact O-CA 3.41Å; P80-V111 WeakPolarHBondContact O-CG2 3.28Å; V82-V111 HydrophobicContact CG1-CG2 4.07Å; V82-V111 HydrophobicContact CG2-CG2 4.42Å; V104-V111 HydrophobicContact CG1-CG1 4.33Å; Q107-V111 HydrophobicContact CB-CG1 3.6Å; Q107-V111 HydrophobicContact CG-CG1 3.57Å; G109-V111 PolarHBondContact O-N 2.83Å; V111-L161 HydrophobicContact CG1-CD2 4.18Å; V111-L161 HydrophobicContact CG2-CD2 4.21Å; V111-L164 HydrophobicContact CG2-CD2 3.92Å; V111-I165 HydrophobicContact CB-CD1 4.37Å; V111-I165 HydrophobicContact CB-CG1 4.3Å; V111-I165 HydrophobicContact CG1-CD1 4.11Å
112	V	98.4	Very high	97.6	Very high	21 Å²	21	49.1 Å²	49.1	13%	0.127	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	160.7	174.4	-63.3	0	0	0	0	110.4	T60 F62 T79 P80 V81 V82	T60-V112 CarbonylContact O-C 3.55Å; T60-V112 WeakPolarHBondContact O-CA 3.41Å; F62-V112 HydrophobicContact CE1-CB 4.14Å; F62-V112 HydrophobicContact CE1-CG2 4.07Å; T79-V112 HydrophobicContact CG2-CG1 4.26Å; P80-V112 PolarHBondContact O-N 2.78Å; V81-V112 CarbonylContact C-O 3.57Å; V81-V112 WeakPolarHBondContact CA-O 3.25Å; V81-V112 HydrophobicContact CB-CG2 4.31Å; V81-V112 HydrophobicContact CG1-CG2 4.2Å; V81-V112 HydrophobicContact CG2-CG2 3.73Å; V82-V112 WeakPolarHBondContact CG2-O 3.49Å; V82-V112 PolarHBondContact N-O 2.86Å
113	M	98.6	Very high	97.7	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	121.4	-177	179	175.5	173.4	0	0	110.8	T60 T61 F62 V82 D84 L100 E101 V104 K115	T60-M113 PolarHBondContact O-N 3.35Å; T61-M113 CarbonylContact C-O 3.56Å; T61-M113 VanDerWaalsContact CA-O 3.27Å; T61-M113 WeakPolarHBondContact CA-O 3.35Å; T61-M113 HydrophobicContact CG2-CB 4.21Å; T61-M113 HydrophobicContact CG2-CG 4.13Å; T61-M113 HydrophobicContact CG2-SD 4.12Å; F62-M113 PolarHBondContact N-O 2.84Å; V82-M113 HydrophobicContact CG2-CB 3.79Å; V82-M113 HydrophobicContact CG2-CG 4.01Å; V82-M113 CarbonylContact O-C 3.59Å; V82-M113 VanDerWaalsContact O-CA 3.27Å; V82-M113 WeakPolarHBondContact O-CA 3.27Å; D84-M113 HydrophobicContact CB-CE 3.49Å; D84-M113 VanDerWaalsContact CB-CE 3.49Å; D84-M113 WeakPolarHBondContact OD2-CE 3.34Å; L100-M113 HydrophobicContact CB-CE 4.32Å; L100-M113 HydrophobicContact CB-SD 4.34Å; L100-M113 HydrophobicContact CD2-CE 4.02Å; L100-M113 HydrophobicContact CD2-SD 4.26Å; L100-M113 HydrophobicContact CG-CE 4.2Å; L100-M113 HydrophobicContact CG-SD 3.95Å; E101-M113 HydrophobicContact CB-SD 4.35Å; E101-M113 HydrophobicContact CG-CE 3.93Å; E101-M113 HydrophobicContact CG-SD 3.59Å; E101-M113 VanDerWaalsContact CG-SD 3.59Å; V104-M113 HydrophobicContact CB-CB 4.46Å; V104-M113 HydrophobicContact CG1-CB 4.03Å; V104-M113 HydrophobicContact CG2-CB 4.2Å; M113-K115 HydrophobicContact CE-CD 4.12Å; M113-K115 HydrophobicContact CE-CG 3.73Å; M113-K115 HydrophobicContact CG-CG 4.4Å
114	A	98.8	Very high	97.7	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	129.9	169	0	0	0	0	0	109.1	F62 I64 V74 V81 V82 V83 D84	F62-A114 HydrophobicContact CD2-CB 4.25Å; F62-A114 HydrophobicContact CE2-CB 3.63Å; F62-A114 HydrophobicContact CZ-CB 4Å; F62-A114 CarbonylContact O-C 3.47Å; F62-A114 WeakPolarHBondContact O-CA 3.31Å; I64-A114 HydrophobicContact CD1-CB 4.03Å; I64-A114 HydrophobicContact CG1-CB 4.07Å; V74-A114 HydrophobicContact CG2-CB 3.71Å; V81-A114 HydrophobicContact CG1-CB 3.98Å; V82-A114 PolarHBondContact O-N 2.89Å; V83-A114 CarbonylContact C-O 3.53Å; V83-A114 WeakPolarHBondContact CA-O 3.23Å; V83-A114 HydrophobicContact CG2-CB 4.41Å; D84-A114 PolarHBondContact N-O 3Å
115	K	98.8	Very high	97.8	Very high	43 Å²	43	49.2 Å²	49.2	19%	0.187	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	125.9	175.3	-66.3	175.5	66.5	172.5	0	108.9	T61 F62 N63 I64 E101 M113	T61-K115 HydrophobicContact CG2-CD 3.7Å; T61-K115 HydrophobicContact CG2-CG 4.16Å; F62-K115 PolarHBondContact O-N 3.25Å; N63-K115 WeakPolarHBondContact OD1-CB 3.41Å; I64-K115 PolarHBondContact N-O 3.41Å; E101-K115 WeakPolarHBondContact OE1-CD 3.26Å; E101-K115 IonicContact OE1-NZ 4Å; E101-K115 PolarHBondContact OE1-NZ 3.46Å; M113-K115 HydrophobicContact CE-CD 4.12Å; M113-K115 HydrophobicContact CE-CG 3.73Å; M113-K115 HydrophobicContact CG-CG 4.4Å
116	V	98.9	Very high	97.9	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	112	-178.3	-177.4	0	0	0	0	107.7	I64 F70 V83 D84 F85 H86 I118 H121 L124	I64-V116 HydrophobicContact CB-CG2 4.17Å; I64-V116 HydrophobicContact CG1-CG2 3.76Å; F70-V116 HydrophobicContact CD2-CG2 4.32Å; F70-V116 HydrophobicContact CE2-CG2 4.2Å; V83-V116 HydrophobicContact CG1-CG2 3.61Å; D84-V116 PolarHBondContact O-N 2.9Å; F85-V116 WeakPolarHBondContact CA-O 3.43Å; F85-V116 HydrophobicContact CD1-CB 3.77Å; F85-V116 HydrophobicContact CD1-CG1 3.67Å; F85-V116 HydrophobicContact CE1-CB 3.95Å; F85-V116 HydrophobicContact CE1-CG1 3.65Å; F85-V116 HydrophobicContact CE1-CG2 4.3Å; F85-V116 HydrophobicContact CG-CB 4.34Å; H86-V116 PolarHBondContact N-O 3.38Å; V116-I118 PolarHBondContact O-N 3.23Å; V116-H121 HydrophobicContact CG1-CB 3.69Å; V116-L124 HydrophobicContact CG1-CB 4.39Å; V116-L124 HydrophobicContact CG1-CD1 4.11Å
117	D	98.8	Very high	98	Very high	14 Å²	14	54.6 Å²	54.6	8%	0.075	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	119.8	169.2	-158.4	-49.2	0	0	0	108.9	H86 Q88 D119 D120 H121	H86-D117 IonicContact CE1-OD2 3.52Å; H86-D117 PolarHBondContact CE1-OD2 2.98Å; H86-D117 IonicContact ND1-OD2 2.7Å; H86-D117 WeakPolarHBondContact O-CA 3.36Å; Q88-D117 PolarHBondContact NE2-OD2 2.9Å; D117-D119 PolarHBondContact O-N 2.91Å; D117-D119 PolarHBondContact OD1-N 3.45Å; D117-D119 VanDerWaalsContact OD1-N 3.1Å; D117-D120 HydrophobicContact CB-CB 4.38Å; D117-D120 PolarHBondContact O-N 2.91Å; D117-H121 WeakPolarHBondContact O-CB 3.23Å; D117-H121 PolarHBondContact O-CD2 2.95Å; D117-H121 PolarHBondContact O-N 3.24Å
118	I	98.6	Very high	98.1	Very high	31 Å²	31	54.9 Å²	54.9	16%	0.159	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-21.2	-175.7	60.8	158	0	0	0	113	F85 H86 A87 W89 V116 T122 A125 V133	F85-I118 HydrophobicContact CB-CG2 3.99Å; F85-I118 HydrophobicContact CD1-CG2 3.98Å; F85-I118 HydrophobicContact CG-CG2 4.5Å; H86-I118 WeakPolarHBondContact O-CG1 3.45Å; H86-I118 PolarHBondContact O-N 3.17Å; A87-I118 HydrophobicContact CB-CD1 4.36Å; A87-I118 HydrophobicContact CB-CG1 3.93Å; W89-I118 HydrophobicContact CH2-CD1 4.36Å; W89-I118 HydrophobicContact CZ2-CD1 3.88Å; V116-I118 PolarHBondContact O-N 3.23Å; I118-T122 PolarHBondContact O-N 3.44Å; I118-T122 PolarHBondContact O-OG1 3.33Å; I118-A125 HydrophobicContact CB-CB 4.3Å; I118-A125 HydrophobicContact CG2-CB 4.09Å; I118-V133 HydrophobicContact CD1-CG1 3.6Å; I118-V133 HydrophobicContact CD1-CG2 4.29Å; I118-V133 HydrophobicContact CG1-CG1 4.03Å; I118-V133 HydrophobicContact CG2-CG1 3.84Å
119	D	98.3	Very high	98.3	Very high	84 Å²	84	54.3 Å²	54.3	45%	0.449	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-32.6	177.3	-65.1	-31.6	0	0	0	110.5	W89 D117	W89-D119 VanDerWaalsContact CD1-OD2 3.23Å; W89-D119 PolarHBondContact NE1-OD1 3.46Å; W89-D119 PolarHBondContact NE1-OD2 3.4Å; D117-D119 PolarHBondContact O-N 2.91Å; D117-D119 PolarHBondContact OD1-N 3.45Å; D117-D119 VanDerWaalsContact OD1-N 3.1Å
120	D	98.6	Very high	98.4	Very high	126 Å²	126	53.9 Å²	53.9	67%	0.674	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-25.9	178.5	-67.1	-28.4	0	0	0	112.6	D117	D117-D120 HydrophobicContact CB-CB 4.38Å; D117-D120 PolarHBondContact O-N 2.91Å
121	H	98.7	Very high	98.5	Very high	18 Å²	18	53.5 Å²	53.5	8%	0.083	29%	0.285	C	S	.	.			trans	-127.4	56.1	-174.6	-54.1	-62.5	0	0	0	112.5	I64 Q65 V116 D117 D123 L124 A125	I64-H121 PolarHBondContact O-NE2 3.18Å; I64-H121 VanDerWaalsContact O-NE2 3.17Å; Q65-H121 PolarHBondContact O-CE1 3.18Å; V116-H121 HydrophobicContact CG1-CB 3.69Å; D117-H121 WeakPolarHBondContact O-CB 3.23Å; D117-H121 PolarHBondContact O-CD2 2.95Å; D117-H121 PolarHBondContact O-N 3.24Å; H121-D123 PolarHBondContact O-N 2.9Å; H121-L124 HydrophobicContact CB-CB 4.23Å; H121-L124 HydrophobicContact CB-CD1 3.97Å; H121-L124 HydrophobicContact CB-CG 4.27Å; H121-L124 PolarHBondContact O-N 3.02Å; H121-A125 PolarHBondContact O-N 3.31Å; H121-A125 VanDerWaalsContact O-N 3.14Å
122	T	98.3	Very high	98.5	Very high	78 Å²	78	55.7 Å²	55.7	48%	0.479	30%	0.304	S	S	.	.	H	α-helix	trans	-62.9	-30.7	-179.1	-49.4	0	0	0	0	112.8	I118 A125 I126	I118-T122 PolarHBondContact O-N 3.44Å; I118-T122 PolarHBondContact O-OG1 3.33Å; T122-A125 PolarHBondContact O-N 2.86Å; T122-I126 HydrophobicContact CG2-CD1 4.07Å; T122-I126 WeakPolarHBondContact O-CD1 3.31Å; T122-I126 VanDerWaalsContact O-CG1 3.26Å; T122-I126 WeakPolarHBondContact O-CG1 3.42Å; T122-I126 PolarHBondContact O-N 3.32Å
123	D	98.4	Very high	98.5	Very high	93 Å²	93	56 Å²	56	50%	0.497	31%	0.305	S	S	.	.	H	α-helix	trans	-60.6	-48.2	174.1	56.7	-23.6	0	0	0	112	H121 A125 I126 E127	H121-D123 PolarHBondContact O-N 2.9Å; D123-A125 VanDerWaalsContact C-N 3.34Å; D123-A125 PolarHBondContact O-N 2.98Å; D123-I126 PolarHBondContact O-N 3.14Å; D123-E127 WeakPolarHBondContact O-CB 3.31Å; D123-E127 PolarHBondContact O-N 3.19Å
124	L	98.7	Very high	98.5	Very high	5 Å²	5	56.1 Å²	56.1	3%	0.026	31%	0.306	C	S	.	.	H	α-helix	trans	-63.7	-39.9	175.5	-65	-179.8	0	0	0	111.7	I64 F70 F85 V116 H121 I126 E127 Y128	I64-L124 HydrophobicContact CG2-CD1 4.09Å; F70-L124 HydrophobicContact CB-CD1 3.99Å; F70-L124 HydrophobicContact CB-CD2 4.28Å; F70-L124 HydrophobicContact CD1-CD2 4.01Å; F70-L124 HydrophobicContact CD2-CD1 3.61Å; F70-L124 HydrophobicContact CD2-CD2 4.3Å; F70-L124 HydrophobicContact CE1-CD2 4.46Å; F70-L124 HydrophobicContact CE2-CD1 4.28Å; F70-L124 HydrophobicContact CG-CD1 3.85Å; F70-L124 HydrophobicContact CG-CD2 3.93Å; F85-L124 HydrophobicContact CE1-CB 4.2Å; V116-L124 HydrophobicContact CG1-CB 4.39Å; V116-L124 HydrophobicContact CG1-CD1 4.11Å; H121-L124 HydrophobicContact CB-CB 4.23Å; H121-L124 HydrophobicContact CB-CD1 3.97Å; H121-L124 HydrophobicContact CB-CG 4.27Å; H121-L124 PolarHBondContact O-N 3.02Å; L124-I126 VanDerWaalsContact C-N 3.29Å; L124-I126 PolarHBondContact O-N 3.01Å; L124-E127 PolarHBondContact O-N 3.42Å; L124-Y128 WeakPolarHBondContact O-CD2 3.39Å; L124-Y128 PolarHBondContact O-N 2.7Å; L124-Y128 VanDerWaalsContact O-N 3.08Å
125	A	98.5	Very high	98.5	Very high	10 Å²	10	56.5 Å²	56.5	8%	0.083	31%	0.308	C	S	.	.	H	α-helix	trans	-61.8	-38.8	175.9	0	0	0	0	0	111.9	I118 H121 T122 D123 E129 V130	I118-A125 HydrophobicContact CB-CB 4.3Å; I118-A125 HydrophobicContact CG2-CB 4.09Å; H121-A125 PolarHBondContact O-N 3.31Å; H121-A125 VanDerWaalsContact O-N 3.14Å; T122-A125 PolarHBondContact O-N 2.86Å; D123-A125 VanDerWaalsContact C-N 3.34Å; D123-A125 PolarHBondContact O-N 2.98Å; A125-E129 PolarHBondContact O-N 3.31Å; A125-V130 HydrophobicContact CB-CB 4.21Å; A125-V130 PolarHBondContact O-N 2.85Å
126	I	98.5	Very high	98.5	Very high	125 Å²	125	54.4 Å²	54.4	64%	0.641	30%	0.3	S	S	*	.	H	α-helix	trans	-68.9	-48.8	176	-69.6	164.2	0	0	0	111	T122 D123 L124 Y128 E129	T122-I126 HydrophobicContact CG2-CD1 4.07Å; T122-I126 WeakPolarHBondContact O-CD1 3.31Å; T122-I126 VanDerWaalsContact O-CG1 3.26Å; T122-I126 WeakPolarHBondContact O-CG1 3.42Å; T122-I126 PolarHBondContact O-N 3.32Å; D123-I126 PolarHBondContact O-N 3.14Å; L124-I126 VanDerWaalsContact C-N 3.29Å; L124-I126 PolarHBondContact O-N 3.01Å; I126-Y128 VanDerWaalsContact C-N 3.28Å; I126-Y128 PolarHBondContact O-N 3.3Å; I126-E129 PolarHBondContact O-N 2.04Å; I126-E129 VanDerWaalsContact O-N 3.08Å
127	E	98.3	Very high	98.5	Very high	132 Å²	132	54.6 Å²	54.6	62%	0.617	30%	0.3	S	S	*	.	H	α-helix	trans	-57.5	-41.6	-177.6	-177.6	177.4	179.2	0	0	112.2	D123 L124 E129	D123-E127 WeakPolarHBondContact O-CB 3.31Å; D123-E127 PolarHBondContact O-N 3.19Å; L124-E127 PolarHBondContact O-N 3.42Å; E127-E129 VanDerWaalsContact C-N 3.34Å
128	Y	98.5	Very high	98.5	Very high	40 Å²	40	54 Å²	54	16%	0.157	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	13.9	-180	-70.7	-87.5	0	0	0	113.7	F70 F85 L124 I126 V130 L137 M139 V144	F70-Y128 AromaticContact CE1-CE2 3.63Å; F70-Y128 HydrophobicContact CE1-CE2 3.63Å; F70-Y128 AromaticContact CE1-CZ 3.69Å; F70-Y128 WeakPolarHBondContact CE1-OH 3.3Å; F70-Y128 HydrophobicContact CZ-CD2 4.44Å; F70-Y128 AromaticContact CZ-CE2 3.76Å; F70-Y128 HydrophobicContact CZ-CE2 3.76Å; F70-Y128 AromaticContact CZ-CZ 3.91Å; F85-Y128 HydrophobicContact CZ-CD2 4.34Å; F85-Y128 HydrophobicContact CZ-CG 4.32Å; L124-Y128 WeakPolarHBondContact O-CD2 3.39Å; L124-Y128 PolarHBondContact O-N 2.7Å; L124-Y128 VanDerWaalsContact O-N 3.08Å; I126-Y128 VanDerWaalsContact C-N 3.28Å; I126-Y128 PolarHBondContact O-N 3.3Å; Y128-V130 PolarHBondContact O-N 2.91Å; Y128-L137 HydrophobicContact CD1-CD1 3.62Å; Y128-L137 HydrophobicContact CG-CD1 3.95Å; Y128-M139 HydrophobicContact CE1-CE 3.63Å; Y128-M139 HydrophobicContact CE1-SD 4Å; Y128-V144 HydrophobicContact CD1-CG2 3.83Å; Y128-V144 HydrophobicContact CE1-CG2 3.86Å
129	E	98.2	Very high	98.5	Very high	157 Å²	157	52.6 Å²	52.6	73%	0.734	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	36.9	176.3	-55.5	-178.5	171.8	0	0	114	A125 I126 E127 S131	A125-E129 PolarHBondContact O-N 3.31Å; I126-E129 PolarHBondContact O-N 2.04Å; I126-E129 VanDerWaalsContact O-N 3.08Å; E127-E129 VanDerWaalsContact C-N 3.34Å; E129-S131 PolarHBondContact O-N 3.01Å
130	V	98.5	Very high	98.5	Very high	21 Å²	21	52.1 Å²	52.1	13%	0.127	28%	0.284	C	S	.	.			trans	-77.7	102.4	178.2	-179	0	0	0	0	109.6	F85 A125 Y128 T135	F85-V130 HydrophobicContact CB-CG1 3.94Å; F85-V130 HydrophobicContact CB-CG2 4.39Å; F85-V130 HydrophobicContact CD1-CB 4.49Å; F85-V130 HydrophobicContact CD1-CG1 4.47Å; F85-V130 HydrophobicContact CD1-CG2 3.93Å; F85-V130 HydrophobicContact CD2-CG2 3.77Å; F85-V130 HydrophobicContact CE1-CG2 4.04Å; F85-V130 HydrophobicContact CE2-CG2 3.91Å; F85-V130 HydrophobicContact CG-CB 4.48Å; F85-V130 HydrophobicContact CG-CG1 4.18Å; F85-V130 HydrophobicContact CG-CG2 3.77Å; F85-V130 HydrophobicContact CZ-CG2 4.04Å; A125-V130 HydrophobicContact CB-CB 4.21Å; A125-V130 PolarHBondContact O-N 2.85Å; Y128-V130 PolarHBondContact O-N 2.91Å; V130-T135 HydrophobicContact CG1-CG2 4.44Å; V130-T135 HydrophobicContact CG2-CG2 4.24Å
131	S	97	Very high	98.4	Very high	125 Å²	125	52.3 Å²	52.3	87%	0.874	29%	0.285	S	S	*	.			trans	-98.7	-10.3	-179.3	50.9	0	0	0	0	114.4	E129	E129-S131 PolarHBondContact O-N 3.01Å
132	A	98.3	Very high	98.2	Very high	47 Å²	47	52.3 Å²	52.3	39%	0.388	29%	0.29	S	S	.	.	S	Bend	trans	-152.1	153.2	179.3	0	0	0	0	0	111.1	T135 V149	A132-T135 PolarHBondContact O-OG1 3.35Å; A132-V149 HydrophobicContact CB-CG1 4.24Å
133	V	98.8	Very high	98.2	Very high	26 Å²	26	53.9 Å²	53.9	16%	0.158	30%	0.296	C	S	.	.	S	Bend	trans	-117.7	145.6	173.8	-67.2	0	0	0	0	111.3	F85 A87 W89 C90 I118	F85-V133 WeakPolarHBondContact O-CG1 3.36Å; A87-V133 HydrophobicContact CB-CG2 4.33Å; W89-V133 HydrophobicContact CH2-CG2 3.55Å; W89-V133 HydrophobicContact CZ2-CG2 4.28Å; W89-V133 HydrophobicContact CZ3-CG2 3.89Å; C90-V133 HydrophobicContact CB-CG2 3.91Å; I118-V133 HydrophobicContact CD1-CG1 3.6Å; I118-V133 HydrophobicContact CD1-CG2 4.29Å; I118-V133 HydrophobicContact CG1-CG1 4.03Å; I118-V133 HydrophobicContact CG2-CG1 3.84Å
134	P	98.8	Very high	98.2	Very high	4 Å²	4	52.5 Å²	52.5	3%	0.026	29%	0.29	C	S	.	.	S	Bend	cis	-76.3	140.2	-3.2	30.3	-32.9	0	0	0	112.2	F85 L96 G150	F85-P134 WeakPolarHBondContact O-CA 3.09Å; L96-P134 HydrophobicContact CB-CG 4.45Å; L96-P134 HydrophobicContact CD2-CB 3.57Å; L96-P134 HydrophobicContact CD2-CG 3.64Å; P134-G150 PolarHBondContact O-N 3.49Å
135	T	98.9	Very high	98.2	Very high	7 Å²	7	56 Å²	56	4%	0.043	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	130.2	167.1	-71.8	0	0	0	0	108.2	F85 V130 A132 L137 V149	F85-T135 WeakPolarHBondContact CB-O 3.32Å; F85-T135 PolarHBondContact N-O 3.49Å; F85-T135 PolarHBondContact O-N 3.15Å; V130-T135 HydrophobicContact CG1-CG2 4.44Å; V130-T135 HydrophobicContact CG2-CG2 4.24Å; A132-T135 PolarHBondContact O-OG1 3.35Å; T135-L137 HydrophobicContact CG2-CD2 3.9Å; T135-V149 HydrophobicContact CG2-CG2 4.36Å
136	V	98.9	Very high	98.2	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	125.5	178.1	-179.5	0	0	0	0	109.5	V82 V83 L96 L100 K147 F148 F160	V82-V136 HydrophobicContact CB-CG1 4.35Å; V83-V136 CarbonylContact O-C 3.54Å; V83-V136 VanDerWaalsContact O-CA 3.25Å; V83-V136 WeakPolarHBondContact O-CA 3.25Å; L96-V136 HydrophobicContact CD2-CG2 3.91Å; L100-V136 HydrophobicContact CD2-CG1 3.93Å; L100-V136 HydrophobicContact CD2-CG2 3.89Å; V136-K147 WeakPolarHBondContact O-CA 3.43Å; V136-F148 HydrophobicContact CB-CD1 4.17Å; V136-F148 HydrophobicContact CB-CD2 4.39Å; V136-F148 HydrophobicContact CB-CE1 3.62Å; V136-F148 HydrophobicContact CB-CE2 3.86Å; V136-F148 HydrophobicContact CB-CZ 3.45Å; V136-F148 VanDerWaalsContact CB-CZ 3.45Å; V136-F148 HydrophobicContact CG1-CE1 3.82Å; V136-F148 HydrophobicContact CG1-CZ 3.94Å; V136-F148 HydrophobicContact CG2-CE1 4.2Å; V136-F148 HydrophobicContact CG2-CE2 3.72Å; V136-F148 HydrophobicContact CG2-CZ 3.49Å; V136-F148 VanDerWaalsContact CG2-CZ 3.49Å; V136-F148 PolarHBondContact N-O 2.95Å; V136-F148 PolarHBondContact O-N 3.24Å; V136-F160 HydrophobicContact CG1-CE1 4.08Å; V136-F160 HydrophobicContact CG1-CZ 4.36Å
137	L	98.9	Very high	98.2	Very high	4 Å²	4	57.7 Å²	57.7	2%	0.021	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	141.2	173.9	-50.5	-174.9	0	0	0	109.7	V82 V83 F85 Y128 T135 M139 V144 K147	V82-L137 CarbonylContact C-O 3.51Å; V82-L137 VanDerWaalsContact CA-O 3.27Å; V82-L137 WeakPolarHBondContact CA-O 3.34Å; V83-L137 HydrophobicContact CB-CB 4.32Å; V83-L137 PolarHBondContact N-O 3.48Å; V83-L137 PolarHBondContact O-N 3.34Å; F85-L137 HydrophobicContact CD2-CD1 4.44Å; F85-L137 HydrophobicContact CD2-CG 4.32Å; F85-L137 HydrophobicContact CE2-CD1 3.6Å; F85-L137 HydrophobicContact CE2-CG 3.91Å; F85-L137 HydrophobicContact CZ-CD1 4.36Å; Y128-L137 HydrophobicContact CD1-CD1 3.62Å; Y128-L137 HydrophobicContact CG-CD1 3.95Å; T135-L137 HydrophobicContact CG2-CD2 3.9Å; L137-M139 HydrophobicContact CB-CG 4.39Å; L137-V144 HydrophobicContact CB-CG1 4.43Å; L137-V144 HydrophobicContact CD1-CG2 4.14Å; L137-V144 HydrophobicContact CD2-CG1 4.46Å; L137-K147 HydrophobicContact CD2-CB 3.6Å; L137-K147 HydrophobicContact CD2-CD 4.29Å
138	A	98.8	Very high	98.2	Very high	1 Å²	1	52.3 Å²	52.3	1%	0.008	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	122.6	164.2	0	0	0	0	0	108.5	V145 D146 F160 L164	A138-V145 HydrophobicContact CB-CG2 4.03Å; A138-V145 WeakPolarHBondContact O-CG2 3.42Å; A138-V145 PolarHBondContact O-N 3.44Å; A138-D146 HydrophobicContact CB-CB 3.96Å; A138-D146 PolarHBondContact N-O 3.34Å; A138-D146 PolarHBondContact O-N 3.1Å; A138-F160 HydrophobicContact CB-CE1 4.02Å; A138-F160 HydrophobicContact CB-CE2 4.12Å; A138-F160 HydrophobicContact CB-CZ 3.47Å; A138-F160 VanDerWaalsContact CB-CZ 3.47Å; A138-L164 HydrophobicContact CB-CB 4.5Å; A138-L164 HydrophobicContact CB-CD1 3.93Å; A138-L164 HydrophobicContact CB-CD2 3.81Å; A138-L164 HydrophobicContact CB-CG 4.28Å
139	M	98.7	Very high	98.3	Very high	2 Å²	2	54.5 Å²	54.5	1%	0.01	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	138.9	-177.9	-64.2	-172	71.5	0	0	111.4	F70 V74 V81 V83 Y128 L137 G142 D143 V144	F70-M139 HydrophobicContact CZ-SD 4.11Å; V74-M139 HydrophobicContact CG1-CB 4.43Å; V74-M139 HydrophobicContact CG1-CE 4.18Å; V74-M139 HydrophobicContact CG1-SD 3.51Å; V74-M139 VanDerWaalsContact CG1-SD 3.51Å; V81-M139 PolarHBondContact N-O 3.09Å; V81-M139 PolarHBondContact O-N 2.93Å; V83-M139 HydrophobicContact CG2-CG 4.21Å; V83-M139 HydrophobicContact CG2-SD 3.7Å; Y128-M139 HydrophobicContact CE1-CE 3.63Å; Y128-M139 HydrophobicContact CE1-SD 4Å; L137-M139 HydrophobicContact CB-CG 4.39Å; M139-G142 WeakPolarHBondContact CE-O 3.32Å; M139-D143 VanDerWaalsContact CA-O 3.23Å; M139-D143 WeakPolarHBondContact CA-O 3.45Å; M139-V144 HydrophobicContact CE-CG2 4.39Å; M139-V144 HydrophobicContact CG-CG2 4.19Å; M139-V144 HydrophobicContact SD-CG2 4.47Å
140	K	98.3	Very high	98.3	Very high	74 Å²	74	48.1 Å²	48.1	32%	0.322	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	127.3	177.9	-166.6	171.2	-171.1	165.7	0	108.8	P80 G142 D143 V145 L164	P80-K140 HydrophobicContact CG-CD 4.32Å; P80-K140 HydrophobicContact CG-CG 4.38Å; K140-G142 VanDerWaalsContact C-N 3.25Å; K140-G142 PolarHBondContact O-N 2.85Å; K140-D143 PolarHBondContact N-O 2.88Å; K140-D143 PolarHBondContact O-N 3.49Å; K140-V145 HydrophobicContact CB-CG1 4.18Å; K140-V145 HydrophobicContact CB-CG2 4.35Å; K140-L164 HydrophobicContact CB-CD1 4.28Å; K140-L164 PolarHBondContact NZ-O 2.99Å
141	N	96.4	Very high	98.3	Very high	129 Å²	129	51 Å²	51	69%	0.69	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.9	36.4	-177.1	-51	-35.1	0	0	0	113.7	D143	N141-D143 VanDerWaalsContact C-N 3.27Å; N141-D143 PolarHBondContact O-N 2.84Å
142	G	94.8	Very high	98.3	Very high	18 Å²	18	47.9 Å²	47.9	19%	0.186	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	84	-13.1	-179.1	0	0	0	0	0	115.7	V75 M139 K140	V75-G142 VanDerWaalsContact O-CA 3.31Å; V75-G142 WeakPolarHBondContact O-CA 3.3Å; V75-G142 PolarHBondContact O-N 2.73Å; M139-G142 WeakPolarHBondContact CE-O 3.32Å; K140-G142 VanDerWaalsContact C-N 3.25Å; K140-G142 PolarHBondContact O-N 2.85Å
143	D	98	Very high	98.3	Very high	112 Å²	112	49 Å²	49	60%	0.599	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.7	146.9	-177.7	-64	-46.2	0	0	0	112.5	M139 K140 N141 V145	M139-D143 VanDerWaalsContact CA-O 3.23Å; M139-D143 WeakPolarHBondContact CA-O 3.45Å; K140-D143 PolarHBondContact N-O 2.88Å; K140-D143 PolarHBondContact O-N 3.49Å; N141-D143 VanDerWaalsContact C-N 3.27Å; N141-D143 PolarHBondContact O-N 2.84Å; D143-V145 PolarHBondContact O-N 2.87Å
144	V	98.6	Very high	98.3	Very high	64 Å²	64	51 Å²	51	39%	0.388	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	116.3	168.5	-178.7	0	0	0	0	109.2	Y128 L137 M139	Y128-V144 HydrophobicContact CD1-CG2 3.83Å; Y128-V144 HydrophobicContact CE1-CG2 3.86Å; L137-V144 HydrophobicContact CB-CG1 4.43Å; L137-V144 HydrophobicContact CD1-CG2 4.14Å; L137-V144 HydrophobicContact CD2-CG1 4.46Å; M139-V144 HydrophobicContact CE-CG2 4.39Å; M139-V144 HydrophobicContact CG-CG2 4.19Å; M139-V144 HydrophobicContact SD-CG2 4.47Å
145	V	98.6	Very high	98.3	Very high	77 Å²	77	56.8 Å²	56.8	47%	0.467	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	-19.3	-177.2	-62.3	0	0	0	0	113.7	A138 K140 D143 L164	A138-V145 HydrophobicContact CB-CG2 4.03Å; A138-V145 WeakPolarHBondContact O-CG2 3.42Å; A138-V145 PolarHBondContact O-N 3.44Å; K140-V145 HydrophobicContact CB-CG1 4.18Å; K140-V145 HydrophobicContact CB-CG2 4.35Å; D143-V145 PolarHBondContact O-N 2.87Å; V145-L164 HydrophobicContact CG2-CD1 3.62Å
146	D	98.6	Very high	98.3	Very high	48 Å²	48	60.7 Å²	60.7	26%	0.257	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	160	173.5	-152.4	-13	0	0	0	110.6	A138 F160 K163	A138-D146 HydrophobicContact CB-CB 3.96Å; A138-D146 PolarHBondContact N-O 3.34Å; A138-D146 PolarHBondContact O-N 3.1Å; D146-F160 HydrophobicContact CB-CE2 3.76Å; D146-F160 HydrophobicContact CB-CZ 4.46Å; D146-K163 WeakPolarHBondContact OD2-CD 3.26Å; D146-K163 WeakPolarHBondContact OD2-CE 3.46Å; D146-K163 IonicContact OD2-NZ 3.27Å; D146-K163 PolarHBondContact OD2-NZ 2.89Å
147	K	98.7	Very high	98.3	Very high	123 Å²	123	60.7 Å²	60.7	54%	0.535	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	153.6	174.9	73.9	178.8	-175.3	-176.9	0	113.4	V136 L137	V136-K147 WeakPolarHBondContact O-CA 3.43Å; L137-K147 HydrophobicContact CD2-CB 3.6Å; L137-K147 HydrophobicContact CD2-CD 4.29Å
148	F	98.8	Very high	98.3	Very high	20 Å²	20	63.6 Å²	63.6	9%	0.088	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	159.4	163.5	69.5	-97.8	0	0	0	111.9	L96 V136 G150 K152 L157 F160	L96-F148 HydrophobicContact CD1-CE2 4.48Å; L96-F148 HydrophobicContact CD2-CE2 4.03Å; L96-F148 HydrophobicContact CD2-CZ 4.5Å; V136-F148 HydrophobicContact CB-CD1 4.17Å; V136-F148 HydrophobicContact CB-CD2 4.39Å; V136-F148 HydrophobicContact CB-CE1 3.62Å; V136-F148 HydrophobicContact CB-CE2 3.86Å; V136-F148 HydrophobicContact CB-CZ 3.45Å; V136-F148 VanDerWaalsContact CB-CZ 3.45Å; V136-F148 HydrophobicContact CG1-CE1 3.82Å; V136-F148 HydrophobicContact CG1-CZ 3.94Å; V136-F148 HydrophobicContact CG2-CE1 4.2Å; V136-F148 HydrophobicContact CG2-CE2 3.72Å; V136-F148 HydrophobicContact CG2-CZ 3.49Å; V136-F148 VanDerWaalsContact CG2-CZ 3.49Å; V136-F148 PolarHBondContact N-O 2.95Å; V136-F148 PolarHBondContact O-N 3.24Å; F148-G150 WeakPolarHBondContact CE2-O 2.96Å; F148-K152 HydrophobicContact CD1-CG 4.41Å; F148-K152 HydrophobicContact CD2-CD 4.39Å; F148-K152 HydrophobicContact CD2-CG 3.65Å; F148-K152 HydrophobicContact CE1-CG 4.3Å; F148-K152 HydrophobicContact CE2-CB 4.42Å; F148-K152 HydrophobicContact CE2-CG 3.54Å; F148-K152 HydrophobicContact CG-CG 4.1Å; F148-K152 HydrophobicContact CZ-CG 3.88Å; F148-L157 HydrophobicContact CE1-CD2 4.02Å; F148-L157 HydrophobicContact CZ-CD2 3.66Å; F148-F160 HydrophobicContact CD1-CD2 4.01Å; F148-F160 HydrophobicContact CD1-CE1 4.34Å; F148-F160 AromaticContact CD1-CE2 3.83Å; F148-F160 HydrophobicContact CD1-CE2 3.83Å; F148-F160 HydrophobicContact CD1-CG 4.33Å; F148-F160 AromaticContact CD1-CZ 3.99Å; F148-F160 HydrophobicContact CD1-CZ 3.99Å; F148-F160 HydrophobicContact CE1-CD1 4Å; F148-F160 HydrophobicContact CE1-CD2 4.31Å; F148-F160 AromaticContact CE1-CE1 3.93Å; F148-F160 HydrophobicContact CE1-CE1 3.93Å; F148-F160 HydrophobicContact CE1-CE2 4.24Å; F148-F160 HydrophobicContact CE1-CG 4.17Å; F148-F160 HydrophobicContact CE1-CZ 4.04Å
149	V	98.8	Very high	98.2	Very high	86 Å²	86	66.4 Å²	66.4	52%	0.521	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	141.1	174.8	-174.9	0	0	0	0	108.9	A132 T135	A132-V149 HydrophobicContact CB-CG1 4.24Å; T135-V149 HydrophobicContact CG2-CG2 4.36Å
150	G	98.5	Very high	98.2	Very high	23 Å²	23	67.2 Å²	67.2	24%	0.237	36%	0.363	C	S	.	.	S	Bend	trans	88	-171.6	178.5	0	0	0	0	0	114.4	P134 F148	P134-G150 PolarHBondContact O-N 3.49Å; F148-G150 WeakPolarHBondContact CE2-O 2.96Å
151	I	98.4	Very high	98.3	Very high	80 Å²	80	63.7 Å²	63.7	41%	0.41	35%	0.348	S	S	.	.			trans	-78.8	142.9	-176.4	-58.4	173.6	0	0	0	110.6	P92 I95	P92-I151 HydrophobicContact CB-CD1 3.83Å; P92-I151 HydrophobicContact CB-CG1 3.96Å; I95-I151 HydrophobicContact CB-CD1 4.4Å
152	K	98.4	Very high	98.3	Very high	61 Å²	61	63 Å²	63	27%	0.265	34%	0.339	S	S	.	.			trans	-123.8	148.5	169.3	-63.2	-64.8	179.6	-177.4	0	110.7	R99 F148 Q156 L157	R99-K152 WeakPolarHBondContact CD-O 3.49Å; R99-K152 PolarHBondContact NH1-O 2.86Å; F148-K152 HydrophobicContact CD1-CG 4.41Å; F148-K152 HydrophobicContact CD2-CD 4.39Å; F148-K152 HydrophobicContact CD2-CG 3.65Å; F148-K152 HydrophobicContact CE1-CG 4.3Å; F148-K152 HydrophobicContact CE2-CB 4.42Å; F148-K152 HydrophobicContact CE2-CG 3.54Å; F148-K152 HydrophobicContact CG-CG 4.1Å; F148-K152 HydrophobicContact CZ-CG 3.88Å; K152-Q156 HydrophobicContact CB-CB 4Å; K152-Q156 HydrophobicContact CD-CB 4.17Å; K152-Q156 HydrophobicContact CG-CB 4.48Å; K152-L157 HydrophobicContact CB-CD2 3.67Å; K152-L157 HydrophobicContact CB-CG 3.83Å; K152-L157 HydrophobicContact CG-CD2 4.27Å
153	D	98.6	Very high	98.5	Very high	70 Å²	70	68.8 Å²	68.8	37%	0.374	36%	0.359	S	S	.	.			trans	-75.8	173.5	170.3	60.5	53.3	0	0	0	111.8	D155 Q156 L157	D153-D155 VanDerWaalsContact C-N 3.32Å; D153-D155 PolarHBondContact O-N 3.2Å; D153-D155 PolarHBondContact OD1-N 3.34Å; D153-D155 VanDerWaalsContact OD1-N 3.11Å; D153-Q156 WeakPolarHBondContact OD1-CB 3.48Å; D153-Q156 VanDerWaalsContact OD1-CG 3.3Å; D153-Q156 WeakPolarHBondContact OD1-CG 3.37Å; D153-Q156 PolarHBondContact OD1-N 3.34Å; D153-Q156 PolarHBondContact OD2-OE1 2.88Å; D153-L157 VanDerWaalsContact O-CG 3.25Å; D153-L157 WeakPolarHBondContact O-CG 3.46Å; D153-L157 PolarHBondContact O-N 2.63Å; D153-L157 VanDerWaalsContact O-N 3.09Å
154	E	98.3	Very high	98.5	Very high	67 Å²	67	63.9 Å²	63.9	31%	0.313	33%	0.333	S	S	.	.	H	α-helix	trans	-64.2	-34.9	-176.8	-67.9	-165.6	-177.3	0	0	112.6	R99 K102 M103 K106 L157 E158	R99-E154 HydrophobicContact CG-CG 3.96Å; K102-E154 IonicContact NZ-OE1 2.74Å; K102-E154 PolarHBondContact NZ-OE1 3.44Å; K102-E154 IonicContact NZ-OE2 3.4Å; K102-E154 PolarHBondContact NZ-OE2 3.13Å; M103-E154 HydrophobicContact SD-CB 4.21Å; M103-E154 HydrophobicContact SD-CG 4.27Å; K106-E154 IonicContact NZ-OE2 3.75Å; E154-L157 PolarHBondContact O-N 3.22Å; E154-E158 WeakPolarHBondContact O-CB 3.36Å; E154-E158 PolarHBondContact O-N 3.36Å
155	D	98.4	Very high	98.4	Very high	127 Å²	127	62.9 Å²	62.9	68%	0.679	33%	0.325	S	S	*	.	H	α-helix	trans	-69	-43.8	-178.6	-63.5	-24.8	0	0	0	110.9	D153 L157 E158 A159	D153-D155 VanDerWaalsContact C-N 3.32Å; D153-D155 PolarHBondContact O-N 3.2Å; D153-D155 PolarHBondContact OD1-N 3.34Å; D153-D155 VanDerWaalsContact OD1-N 3.11Å; D155-L157 VanDerWaalsContact C-N 3.35Å; D155-E158 PolarHBondContact O-N 2.95Å; D155-A159 WeakPolarHBondContact O-CB 3.37Å; D155-A159 PolarHBondContact O-N 3.27Å
156	Q	98.6	Very high	98.1	Very high	88 Å²	88	64.7 Å²	64.7	41%	0.411	36%	0.359	S	S	.	.	H	α-helix	trans	-62.3	-41.8	174.6	-71.4	177.7	-30.4	0	0	111.8	K152 D153 A159 F160	K152-Q156 HydrophobicContact CB-CB 4Å; K152-Q156 HydrophobicContact CD-CB 4.17Å; K152-Q156 HydrophobicContact CG-CB 4.48Å; D153-Q156 WeakPolarHBondContact OD1-CB 3.48Å; D153-Q156 VanDerWaalsContact OD1-CG 3.3Å; D153-Q156 WeakPolarHBondContact OD1-CG 3.37Å; D153-Q156 PolarHBondContact OD1-N 3.34Å; D153-Q156 PolarHBondContact OD2-OE1 2.88Å; Q156-A159 PolarHBondContact O-N 3.48Å; Q156-F160 WeakPolarHBondContact O-CB 3.47Å; Q156-F160 PolarHBondContact O-N 3.27Å
157	L	98.8	Very high	98.1	Very high	0 Å²	0	65.5 Å²	65.5	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-67	-40	176.3	-69.6	179.4	0	0	0	111.8	L96 R99 L100 M103 F148 K152 D153 E154 D155 F160 L161	L96-L157 HydrophobicContact CD1-CD1 4.29Å; L96-L157 HydrophobicContact CD1-CD2 4.41Å; R99-L157 HydrophobicContact CB-CD1 4.45Å; R99-L157 HydrophobicContact CG-CD1 3.78Å; L100-L157 HydrophobicContact CB-CD1 4.46Å; L100-L157 HydrophobicContact CD1-CD1 4.33Å; L100-L157 HydrophobicContact CD1-CD2 3.93Å; M103-L157 HydrophobicContact CG-CB 4.21Å; M103-L157 HydrophobicContact CG-CD1 4.35Å; F148-L157 HydrophobicContact CE1-CD2 4.02Å; F148-L157 HydrophobicContact CZ-CD2 3.66Å; K152-L157 HydrophobicContact CB-CD2 3.67Å; K152-L157 HydrophobicContact CB-CG 3.83Å; K152-L157 HydrophobicContact CG-CD2 4.27Å; D153-L157 VanDerWaalsContact O-CG 3.25Å; D153-L157 WeakPolarHBondContact O-CG 3.46Å; D153-L157 PolarHBondContact O-N 2.63Å; D153-L157 VanDerWaalsContact O-N 3.09Å; E154-L157 PolarHBondContact O-N 3.22Å; D155-L157 VanDerWaalsContact C-N 3.35Å; L157-F160 PolarHBondContact O-N 3.42Å; L157-L161 VanDerWaalsContact O-CG 3.32Å; L157-L161 WeakPolarHBondContact O-CG 3.39Å; L157-L161 PolarHBondContact O-N 2.79Å
158	E	98.3	Very high	98	Very high	65 Å²	65	62.5 Å²	62.5	30%	0.304	36%	0.355	S	S	.	.	H	α-helix	trans	-61.8	-45.5	175.9	-168.5	173.8	155	0	0	111.5	M103 E154 D155 F160 L161 K162	M103-E158 HydrophobicContact CE-CB 3.59Å; M103-E158 HydrophobicContact CE-CG 4.11Å; E154-E158 WeakPolarHBondContact O-CB 3.36Å; E154-E158 PolarHBondContact O-N 3.36Å; D155-E158 PolarHBondContact O-N 2.95Å; E158-F160 VanDerWaalsContact C-N 3.33Å; E158-F160 PolarHBondContact O-N 3.42Å; E158-L161 PolarHBondContact O-N 3.24Å; E158-K162 HydrophobicContact CG-CD 4.29Å; E158-K162 WeakPolarHBondContact O-CB 3.47Å; E158-K162 WeakPolarHBondContact O-CG 3.5Å; E158-K162 PolarHBondContact O-N 3.38Å; E158-K162 WeakPolarHBondContact OE1-CE 3.45Å; E158-K162 IonicContact OE1-NZ 3.83Å; E158-K162 PolarHBondContact OE1-NZ 3.14Å
159	A	98.6	Very high	98	Very high	61 Å²	61	64.8 Å²	64.8	50%	0.504	37%	0.37	S	S	.	.	H	α-helix	trans	-61.1	-43.2	176.6	0	0	0	0	0	111.8	D155 Q156 K162 K163	D155-A159 WeakPolarHBondContact O-CB 3.37Å; D155-A159 PolarHBondContact O-N 3.27Å; Q156-A159 PolarHBondContact O-N 3.48Å; A159-K162 PolarHBondContact O-N 3.08Å; A159-K163 WeakPolarHBondContact O-CB 3.4Å; A159-K163 PolarHBondContact O-N 3.34Å
160	F	98.8	Very high	97.9	Very high	18 Å²	18	63.6 Å²	63.6	8%	0.079	36%	0.361	C	S	.	.	H	α-helix	trans	-60.1	-48.2	176.3	-179.3	-102.1	0	0	0	112	V82 V136 A138 D146 F148 Q156 L157 E158 K163 L164	V82-F160 HydrophobicContact CG1-CE1 3.86Å; V136-F160 HydrophobicContact CG1-CE1 4.08Å; V136-F160 HydrophobicContact CG1-CZ 4.36Å; A138-F160 HydrophobicContact CB-CE1 4.02Å; A138-F160 HydrophobicContact CB-CE2 4.12Å; A138-F160 HydrophobicContact CB-CZ 3.47Å; A138-F160 VanDerWaalsContact CB-CZ 3.47Å; D146-F160 HydrophobicContact CB-CE2 3.76Å; D146-F160 HydrophobicContact CB-CZ 4.46Å; F148-F160 HydrophobicContact CD1-CD2 4.01Å; F148-F160 HydrophobicContact CD1-CE1 4.34Å; F148-F160 AromaticContact CD1-CE2 3.83Å; F148-F160 HydrophobicContact CD1-CE2 3.83Å; F148-F160 HydrophobicContact CD1-CG 4.33Å; F148-F160 AromaticContact CD1-CZ 3.99Å; F148-F160 HydrophobicContact CD1-CZ 3.99Å; F148-F160 HydrophobicContact CE1-CD1 4Å; F148-F160 HydrophobicContact CE1-CD2 4.31Å; F148-F160 AromaticContact CE1-CE1 3.93Å; F148-F160 HydrophobicContact CE1-CE1 3.93Å; F148-F160 HydrophobicContact CE1-CE2 4.24Å; F148-F160 HydrophobicContact CE1-CG 4.17Å; F148-F160 HydrophobicContact CE1-CZ 4.04Å; Q156-F160 WeakPolarHBondContact O-CB 3.47Å; Q156-F160 PolarHBondContact O-N 3.27Å; L157-F160 PolarHBondContact O-N 3.42Å; E158-F160 VanDerWaalsContact C-N 3.33Å; E158-F160 PolarHBondContact O-N 3.42Å; F160-K163 PolarHBondContact O-N 3.33Å; F160-L164 PolarHBondContact O-N 3.19Å; F160-L164 VanDerWaalsContact O-N 3.16Å
161	L	98.5	Very high	97.9	Very high	0 Å²	0	66.1 Å²	66.1	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-66.2	-40.4	178.3	-66	178.7	0	0	0	112.3	V82 M103 V104 Q107 V111 L157 E158 L164 I165	V82-L161 HydrophobicContact CG1-CD2 3.65Å; M103-L161 HydrophobicContact CB-CD1 3.8Å; V104-L161 HydrophobicContact CG2-CD1 4.15Å; V104-L161 HydrophobicContact CG2-CD2 4.15Å; Q107-L161 HydrophobicContact CG-CD1 4.19Å; V111-L161 HydrophobicContact CG1-CD2 4.18Å; V111-L161 HydrophobicContact CG2-CD2 4.21Å; L157-L161 VanDerWaalsContact O-CG 3.32Å; L157-L161 WeakPolarHBondContact O-CG 3.39Å; L157-L161 PolarHBondContact O-N 2.79Å; E158-L161 PolarHBondContact O-N 3.24Å; L161-L164 PolarHBondContact O-N 3.21Å; L161-I165 VanDerWaalsContact O-CG1 3.27Å; L161-I165 WeakPolarHBondContact O-CG1 3.38Å; L161-I165 PolarHBondContact O-N 3.22Å
162	K	98.1	Very high	97.9	Very high	114 Å²	114	65.2 Å²	65.2	50%	0.496	37%	0.366	S	S	.	.	H	α-helix	trans	-60.1	-46.5	176	-79.1	179	-178.8	167.8	0	111.5	E158 A159 L164 I165 G166	E158-K162 HydrophobicContact CG-CD 4.29Å; E158-K162 WeakPolarHBondContact O-CB 3.47Å; E158-K162 WeakPolarHBondContact O-CG 3.5Å; E158-K162 PolarHBondContact O-N 3.38Å; E158-K162 WeakPolarHBondContact OE1-CE 3.45Å; E158-K162 IonicContact OE1-NZ 3.83Å; E158-K162 PolarHBondContact OE1-NZ 3.14Å; A159-K162 PolarHBondContact O-N 3.08Å; K162-L164 VanDerWaalsContact C-N 3.27Å; K162-L164 PolarHBondContact O-N 3.39Å; K162-I165 PolarHBondContact O-N 3.08Å; K162-G166 PolarHBondContact O-N 3.27Å
163	K	98.3	Very high	97.8	Very high	141 Å²	141	65.5 Å²	65.5	61%	0.613	37%	0.373	S	S	*	.	H	α-helix	trans	-58.6	-38.9	177	-177.6	-175.9	170.8	-165.8	0	112.1	D146 A159 F160	D146-K163 WeakPolarHBondContact OD2-CD 3.26Å; D146-K163 WeakPolarHBondContact OD2-CE 3.46Å; D146-K163 IonicContact OD2-NZ 3.27Å; D146-K163 PolarHBondContact OD2-NZ 2.89Å; A159-K163 WeakPolarHBondContact O-CB 3.4Å; A159-K163 PolarHBondContact O-N 3.34Å; F160-K163 PolarHBondContact O-N 3.33Å
164	L	98.2	Very high	97.8	Very high	8 Å²	8	65.2 Å²	65.2	4%	0.042	37%	0.373	C	S	.	.	H	α-helix	trans	-69.5	-43.8	178.6	176.4	56.2	0	0	0	112.7	P80 V82 V111 A138 K140 V145 F160 L161 K162	P80-L164 HydrophobicContact CB-CD1 3.86Å; P80-L164 HydrophobicContact CB-CD2 3.97Å; P80-L164 HydrophobicContact CB-CG 3.67Å; V82-L164 HydrophobicContact CG1-CD2 3.7Å; V111-L164 HydrophobicContact CG2-CD2 3.92Å; A138-L164 HydrophobicContact CB-CB 4.5Å; A138-L164 HydrophobicContact CB-CD1 3.93Å; A138-L164 HydrophobicContact CB-CD2 3.81Å; A138-L164 HydrophobicContact CB-CG 4.28Å; K140-L164 HydrophobicContact CB-CD1 4.28Å; K140-L164 PolarHBondContact NZ-O 2.99Å; V145-L164 HydrophobicContact CG2-CD1 3.62Å; F160-L164 PolarHBondContact O-N 3.19Å; F160-L164 VanDerWaalsContact O-N 3.16Å; L161-L164 PolarHBondContact O-N 3.21Å; K162-L164 VanDerWaalsContact C-N 3.27Å; K162-L164 PolarHBondContact O-N 3.39Å
165	I	97	Very high	97.7	Very high	43 Å²	43	65 Å²	65	22%	0.221	38%	0.378	C	S	.	.	H	α-helix	trans	-66.3	-41.7	-179.2	-68	165.4	0	0	0	110.2	Q107 K110 V111 L161 K162	Q107-I165 HydrophobicContact CB-CD1 4.24Å; Q107-I165 HydrophobicContact CG-CD1 4.01Å; K110-I165 HydrophobicContact CB-CD1 3.98Å; K110-I165 HydrophobicContact CB-CG1 4.28Å; K110-I165 HydrophobicContact CB-CG2 4.37Å; K110-I165 HydrophobicContact CD-CG2 4.4Å; V111-I165 HydrophobicContact CB-CD1 4.37Å; V111-I165 HydrophobicContact CB-CG1 4.3Å; V111-I165 HydrophobicContact CG1-CD1 4.11Å; L161-I165 VanDerWaalsContact O-CG1 3.27Å; L161-I165 WeakPolarHBondContact O-CG1 3.38Å; L161-I165 PolarHBondContact O-N 3.22Å; K162-I165 PolarHBondContact O-N 3.08Å
166	G	91.3	Very high	97.7	Very high	115 Å²	115	59.4 Å²	59.4	100%	1.186	35%	0.35	S	S	*	.			trans	102.9	0	-173	0	0	0	0	0	110.9	K162	K162-G166 PolarHBondContact O-N 3.27Å

Retrieved 166 of 166 residues in 344.1 ms (Link to these results)

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