A0A093HSC6_STRCA Loading...

GTP-binding protein

AlphaFold DB , UniProt , Accession A0A093HSC6, Species STRCA (Struthio camelus australis), Gene n/a, Length 296 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	38.6	Very low	34.4	Very low	237 Å²	237	170.7 Å²	170.7	100%	1.167	87%	0.865	S	S	*	*				0	112.6	0	-75.5	169.3	169.9	0	0	107.5
2	T	38.5	Very low	34	Very low	131 Å²	131	169.7 Å²	169.7	80%	0.804	86%	0.863	S	S	*	*			trans	39.3	110.4	157.4	54	0	0	0	0	118.1
3	L	32.2	Very low	33.8	Very low	150 Å²	150	168.7 Å²	168.7	79%	0.785	86%	0.862	S	S	*	*			cis	56.3	105.5	35.6	-76	172.7	0	0	0	116.3
4	N	39	Very low	33.8	Very low	160 Å²	160	163.4 Å²	163.4	86%	0.856	85%	0.847	S	S	*	*			trans	-132.4	105.3	152.3	-74.7	-21.9	0	0	0	105.1
5	N	36.3	Very low	33.5	Very low	132 Å²	132	157.1 Å²	157.1	71%	0.706	84%	0.838	S	S	*	*				46.2	120.2	72.2	-65.4	-14.8	0	0	0	112
6	V	35.6	Very low	33.4	Very low	145 Å²	145	158.6 Å²	158.6	88%	0.879	85%	0.845	S	S	*	*				-156	147.4	78.5	163.6	0	0	0	0	113.4
7	T	34.8	Very low	33.4	Very low	125 Å²	125	159.7 Å²	159.7	77%	0.767	84%	0.844	S	S	*	*			trans	-84.8	158.3	-173.8	-47.6	0	0	0	0	115.3
8	M	30.3	Very low	33.5	Very low	171 Å²	171	161.8 Å²	161.8	84%	0.842	85%	0.848	S	S	*	*			trans	-46.1	152.7	164.9	-77.1	-140.3	-105.2	0	0	116.8
9	R	30.6	Very low	33.4	Very low	251 Å²	251	162.7 Å²	162.7	95%	0.947	85%	0.848	S	S	*	*			trans	-139.2	126.7	144.6	-79.4	-168.9	176.1	168.9	-0.7	112.7
10	R	29.5	Very low	33.1	Very low	230 Å²	230	163.8 Å²	163.8	87%	0.868	85%	0.849	S	S	*	*			trans	-69.1	151.1	162.7	-80.3	173	162.3	172.9	-5.8	111.2
11	T	33.1	Very low	32.7	Very low	146 Å²	146	166.8 Å²	166.8	90%	0.896	85%	0.849	S	S	*	*			trans	-142.3	132.7	142.3	43.1	0	0	0	0	110.5
12	N	29.7	Very low	32.1	Very low	158 Å²	158	167.2 Å²	167.2	85%	0.845	84%	0.838	S	S	*	*			trans	-98.4	144.5	171.8	-101.9	-2.3	0	0	0	109.3
13	N	30.7	Very low	31.8	Very low	157 Å²	157	165.9 Å²	165.9	84%	0.84	83%	0.833	S	S	*	*			trans	161.6	151.3	142.7	-111.1	6.3	0	0	0	108.7
14	S	34.1	Very low	32.1	Very low	94 Å²	94	166.3 Å²	166.3	66%	0.657	84%	0.835	S	S	*	*			cis	179	134.8	-20.7	45	0	0	0	0	105.3
15	G	29.4	Very low	31.9	Very low	69 Å²	69	164.7 Å²	164.7	71%	0.711	83%	0.833	S	S	*	*			trans	68.8	117	150.2	0	0	0	0	0	120.4
16	L	32.6	Very low	31.7	Very low	181 Å²	181	162.4 Å²	162.4	95%	0.948	83%	0.832	S	S	*	*				171.7	125.4	102.1	-94.9	146.6	0	0	0	111.5
17	Q	33.3	Very low	31.6	Very low	178 Å²	178	163.2 Å²	163.2	83%	0.832	83%	0.832	S	S	*	*			trans	-69.4	142.2	165.3	-81.3	169	-31.9	0	0	110.3
18	Q	33.9	Very low	31.3	Very low	197 Å²	197	160.7 Å²	160.7	92%	0.921	83%	0.831	S	S	*	*			trans	-134.3	115.8	156.5	-112.5	175.2	21	0	0	111
19	Q	31.8	Very low	31.4	Very low	180 Å²	180	163 Å²	163	84%	0.841	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-73.5	138.2	172.9	-68.8	170.8	-20.2	0	0	110
20	Q	28.8	Very low	31.3	Very low	184 Å²	184	159.1 Å²	159.1	86%	0.86	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-87	120.2	171.1	-75.3	-81.6	-24.3	0	0	109.4
21	R	25	Very low	31.5	Very low	227 Å²	227	153.9 Å²	153.9	86%	0.857	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-103.5	122	-178.9	-174.6	178.9	-177.2	-158	1	108.9
22	W	25.7	Very low	31.2	Very low	246 Å²	246	153.5 Å²	153.5	93%	0.932	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-78.3	138.4	173.5	-72	85.1	0	0	0	111.2
23	S	31.2	Very low	31.1	Very low	102 Å²	102	153.1 Å²	153.1	71%	0.713	82%	0.819	S	S	*	*			trans	-139.5	120.2	170.3	-57	0	0	0	0	110.3
24	I	38.5	Very low	30.8	Very low	160 Å²	160	153.2 Å²	153.2	82%	0.821	81%	0.814	S	S	*	*			trans	-89.1	149.7	166.9	-61.9	165.9	0	0	0	108
25	P	34.8	Very low	30.4	Very low	126 Å²	126	157.4 Å²	157.4	82%	0.818	82%	0.821	S	S	*	*			trans	-132.4	153.6	141.8	20	0.5	0	0	0	114.5
26	A	31.4	Very low	30.2	Very low	83 Å²	83	161.5 Å²	161.5	69%	0.686	83%	0.827	S	S	*	*			trans	-96.9	167.7	-175.4	0	0	0	0	0	113.6
27	D	33.9	Very low	29.9	Very low	163 Å²	163	157.1 Å²	157.1	87%	0.872	81%	0.811	S	S	*	*			trans	72.1	113.1	154	-67.9	-13.7	0	0	0	122.2
28	G	29.6	Very low	29.6	Very low	72 Å²	72	155.7 Å²	155.7	74%	0.742	81%	0.809	S	S	*	*				100.6	109.3	97.4	0	0	0	0	0	120.1
29	K	31.2	Very low	29.3	Very low	219 Å²	219	154.7 Å²	154.7	95%	0.952	80%	0.804	S	S	*	*			trans	120.3	131.3	138.7	-64	-177.1	-178.9	178.7	0	118.6
30	H	30.1	Very low	29.1	Very low	169 Å²	169	156.8 Å²	156.8	78%	0.782	81%	0.806	S	S	*	*			trans	-65.6	163	180	-121.9	-83.2	0	0	0	114.2
31	P	33.2	Very low	29.1	Very low	121 Å²	121	155.1 Å²	155.1	79%	0.786	80%	0.803	S	S	*	*				-146.8	169.9	87.1	33.1	-11.9	0	0	0	117.4
32	L	26.7	Very low	29.3	Very low	138 Å²	138	149 Å²	149	72%	0.723	80%	0.802	S	S	*	*			trans	-56	149.4	-171.4	-66.9	115.4	0	0	0	118.7
33	V	26.9	Very low	29.4	Very low	150 Å²	150	145.6 Å²	145.6	91%	0.909	80%	0.796	S	S	*	*			trans	-144.8	140.5	132.1	177.2	0	0	0	0	109.8
34	Q	25.4	Very low	29.4	Very low	158 Å²	158	148.7 Å²	148.7	74%	0.738	80%	0.797	S	S	*	*			trans	-85.8	156.6	-172.4	-70.1	170.4	-27.9	0	0	114.8
35	K	25.5	Very low	28.8	Very low	182 Å²	182	152.3 Å²	152.3	79%	0.791	80%	0.8	S	S	*	*			trans	57.5	129.1	146.3	-82.6	-176.8	172.9	-178.6	0	118
36	D	25.2	Very low	28.6	Very low	156 Å²	156	155.3 Å²	155.3	83%	0.834	80%	0.796	S	S	*	*				-149.3	161.2	69.5	-87.9	-39.9	0	0	0	115.8
37	S	25.4	Very low	28.6	Very low	89 Å²	89	158 Å²	158	62%	0.622	80%	0.804	S	S	*	*			trans	-88.2	162.6	-179.2	43.7	0	0	0	0	114.4
38	N	27.3	Very low	28.6	Very low	147 Å²	147	156.4 Å²	156.4	79%	0.786	79%	0.794	S	S	*	*			trans	101.4	130	176.4	-57.4	-14.1	0	0	0	111.2
39	E	28.7	Very low	28.9	Very low	177 Å²	177	155.8 Å²	155.8	83%	0.827	78%	0.779	S	S	*	*			cis	-165.1	161.3	30.4	-139.7	165.1	-164.7	0	0	109.7
40	Y	27.6	Very low	29.3	Very low	223 Å²	223	149.3 Å²	149.3	88%	0.875	76%	0.759	S	S	*	*			trans	-55.3	133.1	-175.5	-69.7	-100.6	0	0	0	114.8
41	N	27.9	Very low	30	Very low	149 Å²	149	146.5 Å²	146.5	80%	0.797	75%	0.749	S	S	*	*			trans	-159.1	104.5	139.4	-117.9	-36.7	0	0	0	112.2	Q43	N41-Q43 PolarHBondContact O-N 3.07Å
42	A	30.1	Very low	30.2	Very low	100 Å²	100	144.6 Å²	144.6	83%	0.826	73%	0.733	S	S	*	*			trans	-74.5	89.7	170.1	0	0	0	0	0	109.4	K44	A42-K44 PolarHBondContact O-N 3.12Å; A42-K44 VanDerWaalsContact O-N 3.15Å
43	Q	27.7	Very low	30.7	Very low	174 Å²	174	147.7 Å²	147.7	81%	0.813	74%	0.736	S	S	*	*			trans	-77.2	97.6	165	-87.2	163	-30.4	0	0	109.1	N41 R45	N41-Q43 PolarHBondContact O-N 3.07Å; Q43-R45 PolarHBondContact O-N 3.32Å
44	K	29.7	Very low	31.4	Very low	167 Å²	167	146.5 Å²	146.5	73%	0.726	72%	0.716	S	S	*	*			trans	-48.1	108.6	161.5	-77.1	177.7	176.7	176.8	0	108.4	A42 Y46	A42-K44 PolarHBondContact O-N 3.12Å; A42-K44 VanDerWaalsContact O-N 3.15Å; K44-Y46 HydrophobicContact CB-CE2 4.41Å; K44-Y46 PolarHBondContact O-N 3.42Å; K44-Y46 VanDerWaalsContact O-N 3.08Å
45	R	26	Very low	31.9	Very low	235 Å²	235	148.4 Å²	148.4	89%	0.887	72%	0.717	S	S	*	*			trans	-64.9	104.1	161.8	-73.2	-179.7	172.3	176.6	-2.9	106.7	Q43 T47	Q43-R45 PolarHBondContact O-N 3.32Å; R45-T47 PolarHBondContact O-N 3.1Å; R45-T47 VanDerWaalsContact O-N 3.13Å
46	Y	32.3	Very low	32.2	Very low	190 Å²	190	149.5 Å²	149.5	75%	0.745	72%	0.716	S	S	*	*			trans	-70.5	101.4	165.8	-69.1	-81.3	0	0	0	107.3	K44 I48	K44-Y46 HydrophobicContact CB-CE2 4.41Å; K44-Y46 PolarHBondContact O-N 3.42Å; K44-Y46 VanDerWaalsContact O-N 3.08Å; Y46-I48 PolarHBondContact O-N 3.29Å; Y46-I48 VanDerWaalsContact O-N 3.15Å
47	T	30.8	Very low	32.7	Very low	138 Å²	138	146.1 Å²	146.1	85%	0.847	71%	0.705	S	S	*	*			trans	-70.5	99.3	161.2	-32	0	0	0	0	105.9	R45 S49	R45-T47 PolarHBondContact O-N 3.1Å; R45-T47 VanDerWaalsContact O-N 3.13Å; T47-S49 PolarHBondContact O-N 3.15Å
48	I	34.3	Very low	33.7	Very low	131 Å²	131	150.1 Å²	150.1	67%	0.672	71%	0.706	S	S	*	*			trans	-71.8	117.3	176	-62.4	172.8	0	0	0	106.9	Y46 D52	Y46-I48 PolarHBondContact O-N 3.29Å; Y46-I48 VanDerWaalsContact O-N 3.15Å; I48-D52 HydrophobicContact CG2-CB 4.3Å
49	S	35.1	Very low	33.9	Very low	59 Å²	59	147.5 Å²	147.5	41%	0.413	70%	0.699	S	S	.	*			trans	-74	142.3	172.6	-177.9	0	0	0	0	109.4	T47 D51 D52	T47-S49 PolarHBondContact O-N 3.15Å; S49-D51 PolarHBondContact O-N 3.28Å; S49-D52 PolarHBondContact O-N 2.96Å
50	P	40.4	Very low	34.2	Very low	82 Å²	82	144.8 Å²	144.8	53%	0.532	70%	0.7	S	S	.	*	T	Hydrogen-bonded Turn	trans	-52.4	-22.1	173.5	-26.8	34.8	0	0	0	114.8	D52 Y53	P50-D52 PolarHBondContact O-N 3.42Å; P50-Y53 PolarHBondContact O-N 3.32Å
51	D	43.9	Very low	34.8	Very low	110 Å²	110	143.1 Å²	143.1	59%	0.588	70%	0.7	S	S	*	*	H	α-helix	trans	-56.7	-31.5	173.7	-88.2	-23.8	0	0	0	113.9	S49 Y53 R55	S49-D51 PolarHBondContact O-N 3.28Å; D51-Y53 VanDerWaalsContact C-N 3.3Å; D51-Y53 PolarHBondContact O-N 3.06Å; D51-R55 PolarHBondContact O-N 3.22Å
52	D	37.3	Very low	35.1	Very low	81 Å²	81	141.6 Å²	141.6	43%	0.433	70%	0.701	S	S	.	*	H	α-helix	trans	-75.5	-18.8	-176.5	-84.5	-26.7	0	0	0	113.1	I48 S49 P50 R56	I48-D52 HydrophobicContact CG2-CB 4.3Å; S49-D52 PolarHBondContact O-N 2.96Å; P50-D52 PolarHBondContact O-N 3.42Å; D52-R56 WeakPolarHBondContact O-CB 3.34Å; D52-R56 PolarHBondContact O-N 3.13Å
53	Y	37.1	Very low	35.6	Very low	203 Å²	203	141.6 Å²	141.6	80%	0.796	70%	0.695	S	S	*	*	H	α-helix	trans	-76.2	-42.9	178.2	-151.4	-97	0	0	0	111.2	P50 D51	P50-Y53 PolarHBondContact O-N 3.32Å; D51-Y53 VanDerWaalsContact C-N 3.3Å; D51-Y53 PolarHBondContact O-N 3.06Å
54	Y	41.3	Very low	36.2	Very low	126 Å²	126	141 Å²	141	49%	0.494	70%	0.697	S	S	.	*	H	α-helix	trans	-73.7	-30.4	178.7	-72.1	-76.1	0	0	0	113.3
55	R	36.7	Very low	36.6	Very low	198 Å²	198	138.7 Å²	138.7	75%	0.747	70%	0.703	S	S	*	*	H	α-helix	trans	-77.8	-29.5	-178	-158.1	175.6	-154.5	-163.2	5.1	113.8	D51	D51-R55 PolarHBondContact O-N 3.22Å
56	R	31.1	Very low	37.6	Very low	205 Å²	205	134.3 Å²	134.3	77%	0.774	70%	0.702	S	S	*	*	H	α-helix	trans	-79.3	-19.6	-175.8	-89	177	142.3	168.5	-5.2	114.6	D52 W58	D52-R56 WeakPolarHBondContact O-CB 3.34Å; D52-R56 PolarHBondContact O-N 3.13Å; R56-W58 PolarHBondContact O-N 3.19Å
57	S	36.1	Very low	38.2	Very low	85 Å²	85	132.9 Å²	132.9	59%	0.594	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	-3.8	177.3	-155	0	0	0	0	113.3
58	W	47.4	Very low	38.4	Very low	172 Å²	172	131.7 Å²	131.7	65%	0.652	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.3	18.1	-171.2	-67.2	-7.3	0	0	0	115.1	R56	R56-W58 PolarHBondContact O-N 3.19Å
59	S	30.1	Very low	38.9	Very low	92 Å²	92	130.8 Å²	130.8	64%	0.643	71%	0.708	S	S	*	*			trans	-107.2	80	171.3	-62.4	0	0	0	0	110.3	E61	S59-E61 VanDerWaalsContact C-N 3.32Å; S59-E61 PolarHBondContact O-N 3.36Å
60	S	36.1	Very low	39.3	Very low	120 Å²	120	136 Å²	136	84%	0.839	73%	0.725	S	S	*	*			trans	-76.9	90.5	156.2	-67.4	0	0	0	0	108	S62	S60-S62 PolarHBondContact O-N 3.36Å
61	E	39.2	Very low	39.4	Very low	188 Å²	188	137.5 Å²	137.5	88%	0.879	74%	0.738	S	S	*	*			trans	-70.9	100.9	158.3	-81.7	175.5	105.3	0	0	107.6	S59	S59-E61 VanDerWaalsContact C-N 3.32Å; S59-E61 PolarHBondContact O-N 3.36Å
62	S	35.4	Very low	39.9	Very low	117 Å²	117	136.4 Å²	136.4	82%	0.818	74%	0.739	S	S	*	*			trans	-124.3	105.4	161.2	-159.2	0	0	0	0	107.9	S60	S60-S62 PolarHBondContact O-N 3.36Å
63	S	40.3	Very low	41.2	Very low	101 Å²	101	136.6 Å²	136.6	71%	0.706	75%	0.747	S	S	*	*			trans	-81.9	143.8	173.3	-65.4	0	0	0	0	110.2
64	D	40.6	Very low	43.6	Very low	160 Å²	160	129.1 Å²	129.1	86%	0.856	72%	0.72	S	S	*	*			trans	80.4	93.5	164.7	-60.2	-21.5	0	0	0	118.9
65	S	38	Very low	46	Very low	120 Å²	120	124.8 Å²	124.8	84%	0.839	71%	0.708	S	S	*	*				-161.8	139.4	114.9	48.7	0	0	0	0	112
66	V	46.1	Very low	48.7	Very low	143 Å²	143	115.6 Å²	115.6	87%	0.867	67%	0.673	S	S	*	*			trans	-80.2	134.7	-177.2	-119	0	0	0	0	109.9
67	I	44.9	Very low	51.8	Low	159 Å²	159	109.9 Å²	109.9	82%	0.815	65%	0.652	S	S	*	*			trans	84.9	84.8	176.5	-43.2	175.2	0	0	0	115.1
68	S	35.4	Very low	54.7	Low	113 Å²	113	105.9 Å²	105.9	79%	0.79	62%	0.624	S	S	*	*			trans	-154.7	114.2	132.1	-76.6	0	0	0	0	108
69	S	44.1	Very low	57	Low	112 Å²	112	97.7 Å²	97.7	78%	0.783	59%	0.593	S	S	*	*			trans	-74.9	137.4	167.6	-51.5	0	0	0	0	106.7
70	E	43.4	Very low	60.2	Low	168 Å²	168	93.3 Å²	93.3	79%	0.785	56%	0.562	S	S	*	*			trans	81.6	75.5	179.6	-60.2	166.9	154.2	0	0	116.7
71	S	43.8	Very low	63.1	Low	115 Å²	115	87.6 Å²	87.6	80%	0.804	52%	0.522	S	S	*	.			trans	-111	67.4	144	57.2	0	0	0	0	109	S73	S71-S73 VanDerWaalsContact C-N 3.35Å; S71-S73 PolarHBondContact O-N 3.3Å
72	S	54	Low	65.9	Low	87 Å²	87	78.7 Å²	78.7	61%	0.608	48%	0.481	S	S	*	.			trans	-55.8	110.8	151.6	43.9	0	0	0	0	105.4	N74	S72-N74 PolarHBondContact O-N 3.09Å; S72-N74 PolarHBondContact O-OD1 3.18Å
73	S	65.2	Low	68.8	Low	84 Å²	84	76.5 Å²	76.5	59%	0.587	46%	0.458	S	S	*	.			trans	-50.7	114.3	-176.2	41.3	0	0	0	0	108.9	S71 C75 R243	S71-S73 VanDerWaalsContact C-N 3.35Å; S71-S73 PolarHBondContact O-N 3.3Å; S73-C75 PolarHBondContact O-N 3.4Å; S73-R243 PolarHBondContact O-NH1 3.16Å
74	N	86.3	Confident	71.4	Confident	46 Å²	46	77.1 Å²	77.1	25%	0.246	45%	0.449	C	S	.	.			trans	-71.6	35.2	173.6	-77.8	-17.2	0	0	0	111	S72 Y76 E123 S124 A125 T126	S72-N74 PolarHBondContact O-N 3.09Å; S72-N74 PolarHBondContact O-OD1 3.18Å; N74-Y76 HydrophobicContact CB-CE2 4.42Å; N74-Y76 WeakPolarHBondContact O-CD2 3.48Å; N74-Y76 VanDerWaalsContact O-CE2 3.26Å; N74-Y76 WeakPolarHBondContact O-CE2 3.44Å; N74-E123 PolarHBondContact ND2-OE1 3.11Å; N74-E123 PolarHBondContact OD1-OE1 3.42Å; N74-S124 WeakPolarHBondContact CB-O 3.27Å; N74-S124 PolarHBondContact ND2-O 2.93Å; N74-S124 VanDerWaalsContact ND2-O 3.16Å; N74-A125 CarbonylContact O-C 3.41Å; N74-T126 PolarHBondContact O-N 3.44Å
75	C	91.8	Very high	74	Confident	35 Å²	35	71.5 Å²	71.5	24%	0.236	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	129.5	175.2	-177.6	0	0	0	0	108.1	S73 T126 I128 R243	S73-C75 PolarHBondContact O-N 3.4Å; C75-T126 CarbonylContact C-O 3.6Å; C75-T126 VanDerWaalsContact CA-O 3.25Å; C75-T126 WeakPolarHBondContact CA-O 3.39Å; C75-I128 WeakPolarHBondContact SG-CD1 3.43Å; C75-R243 PolarHBondContact O-NH2 3.44Å; C75-R243 VanDerWaalsContact O-NH2 3.14Å
76	Y	94	Very high	76.9	Confident	5 Å²	5	65.9 Å²	65.9	2%	0.02	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	114.8	-176.4	-53.4	-71.9	0	0	0	109.3	N74 V78 A125 T126 I127 I128 V236 V239 R240	N74-Y76 HydrophobicContact CB-CE2 4.42Å; N74-Y76 WeakPolarHBondContact O-CD2 3.48Å; N74-Y76 VanDerWaalsContact O-CE2 3.26Å; N74-Y76 WeakPolarHBondContact O-CE2 3.44Å; Y76-V78 PolarHBondContact O-N 3.07Å; Y76-A125 HydrophobicContact CD2-CB 4.03Å; Y76-A125 HydrophobicContact CE2-CB 3.57Å; Y76-T126 PolarHBondContact N-O 3.42Å; Y76-I127 WeakPolarHBondContact O-CA 3.35Å; Y76-I128 PolarHBondContact O-N 2.94Å; Y76-V236 HydrophobicContact CD2-CG1 4.35Å; Y76-V236 HydrophobicContact CD2-CG2 4.11Å; Y76-V236 HydrophobicContact CE2-CG1 3.88Å; Y76-V236 HydrophobicContact CE2-CG2 4.45Å; Y76-V239 HydrophobicContact CD1-CB 3.93Å; Y76-V239 HydrophobicContact CD1-CG1 3.47Å; Y76-V239 VanDerWaalsContact CD1-CG1 3.47Å; Y76-V239 HydrophobicContact CD1-CG2 4.42Å; Y76-V239 HydrophobicContact CE1-CB 4.18Å; Y76-V239 HydrophobicContact CE1-CG1 3.74Å; Y76-R240 HydrophobicContact CE1-CG 4.46Å; Y76-R240 WeakPolarHBondContact OH-CG 3.49Å; Y76-R240 PolarHBondContact OH-NE 2.97Å; Y76-R240 VanDerWaalsContact OH-NE 3.11Å
77	R	95.1	Very high	79.3	Confident	86 Å²	86	59.6 Å²	59.6	33%	0.325	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	114	174.6	-65.5	178.6	-62	-115.5	-12.4	110.2	I128 V149 D151 A152	R77-I128 CarbonylContact C-O 3.5Å; R77-I128 WeakPolarHBondContact CA-O 3.12Å; R77-I128 HydrophobicContact CG-CB 4.43Å; R77-V149 PolarHBondContact NE-O 2.78Å; R77-D151 HydrophobicContact CB-CB 4.5Å; R77-D151 IonicContact CZ-OD1 2.75Å; R77-D151 PolarHBondContact N-OD2 3.04Å; R77-D151 IonicContact NE-OD1 3.77Å; R77-D151 IonicContact NE-OD2 2.78Å; R77-D151 IonicContact NH2-OD1 2.82Å; R77-D151 PolarHBondContact NH2-OD1 3.25Å; R77-D151 IonicContact NH2-OD2 3.97Å; R77-D151 WeakPolarHBondContact O-CB 3.44Å; R77-D151 PolarHBondContact O-N 3.43Å; R77-A152 PolarHBondContact O-N 3Å; R77-A152 VanDerWaalsContact O-N 3.15Å
78	V	97.2	Very high	81.8	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.006	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	125.1	-179.9	-178.9	0	0	0	0	108.9	Y76 I127 I128 L129 L130 A152 L154 I235	Y76-V78 PolarHBondContact O-N 3.07Å; V78-I127 HydrophobicContact CB-CG2 4.09Å; V78-I127 HydrophobicContact CG2-CG2 3.77Å; V78-I128 PolarHBondContact N-O 3.01Å; V78-L129 HydrophobicContact CB-CD1 4Å; V78-L129 HydrophobicContact CG1-CD1 3.85Å; V78-L129 WeakPolarHBondContact O-CA 3.5Å; V78-L130 PolarHBondContact O-N 3.21Å; V78-A152 WeakPolarHBondContact CA-O 3.33Å; V78-A152 HydrophobicContact CG2-CB 4.31Å; V78-L154 HydrophobicContact CG1-CD1 3.81Å; V78-L154 HydrophobicContact CG1-CG 3.74Å; V78-I235 HydrophobicContact CG1-CG1 4.49Å; V78-I235 HydrophobicContact CG2-CG1 4.33Å; V78-I235 HydrophobicContact CG2-CG2 3.95Å
79	V	97.1	Very high	84.6	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	130.9	-179	-174.4	0	0	0	0	110.3	I81 L130 C146 V149 A152 Y153 L154	V79-I81 HydrophobicContact CG1-CG2 3.9Å; V79-L130 HydrophobicContact CG2-CB 4.32Å; V79-L130 HydrophobicContact CG2-CD1 3.9Å; V79-C146 HydrophobicContact CG1-CB 4.04Å; V79-V149 HydrophobicContact CG2-CG2 4.25Å; V79-A152 PolarHBondContact N-O 3.23Å; V79-Y153 HydrophobicContact CB-CD1 3.75Å; V79-Y153 HydrophobicContact CB-CE1 3.65Å; V79-Y153 HydrophobicContact CG1-CD1 4.2Å; V79-Y153 HydrophobicContact CG1-CE1 3.96Å; V79-Y153 HydrophobicContact CG2-CD1 4.43Å; V79-Y153 HydrophobicContact CG2-CE1 3.93Å; V79-L154 PolarHBondContact O-N 3.26Å
80	L	97.3	Very high	87	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	124.3	170.3	-60.1	-176.5	0	0	0	110.1	K88 A92 L129 L130 D131 W133 L154 V156	L80-K88 HydrophobicContact CB-CB 4.22Å; L80-K88 HydrophobicContact CB-CD 4.39Å; L80-K88 HydrophobicContact CB-CG 4.46Å; L80-K88 HydrophobicContact CD1-CB 4.1Å; L80-K88 WeakPolarHBondContact CD1-O 3.42Å; L80-A92 HydrophobicContact CD1-CB 3.97Å; L80-L129 HydrophobicContact CD1-CD1 4.22Å; L80-L129 HydrophobicContact CD1-CD2 4.25Å; L80-L129 HydrophobicContact CD1-CG 4.3Å; L80-L129 HydrophobicContact CD2-CD1 3.87Å; L80-L129 HydrophobicContact CG-CD1 3.76Å; L80-L129 HydrophobicContact CG-CG 4.3Å; L80-L130 PolarHBondContact N-O 2.83Å; L80-D131 HydrophobicContact CD1-CB 4.21Å; L80-W133 WeakPolarHBondContact O-CB 3.3Å; L80-L154 HydrophobicContact CD2-CB 3.71Å; L80-L154 HydrophobicContact CD2-CD1 3.61Å; L80-L154 HydrophobicContact CD2-CG 4.13Å; L80-V156 HydrophobicContact CD2-CG2 4.48Å
81	I	96.9	Very high	89.6	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	150.8	172.2	65.4	177	0	0	0	110.4	V79 W133 Y153 L154 I155 V156 L171	V79-I81 HydrophobicContact CG1-CG2 3.9Å; I81-W133 HydrophobicContact CB-CD2 3.96Å; I81-W133 HydrophobicContact CB-CE3 4Å; I81-W133 HydrophobicContact CB-CG 4.31Å; I81-W133 HydrophobicContact CB-CZ3 4.46Å; I81-W133 HydrophobicContact CG2-CD2 3.93Å; I81-W133 HydrophobicContact CG2-CE3 3.53Å; I81-W133 HydrophobicContact CG2-CG 4.37Å; I81-W133 HydrophobicContact CG2-CZ3 4.07Å; I81-Y153 HydrophobicContact CD1-CD1 4.23Å; I81-L154 PolarHBondContact N-O 3.46Å; I81-I155 HydrophobicContact CD1-CD1 4.25Å; I81-I155 HydrophobicContact CD1-CG1 3.93Å; I81-I155 HydrophobicContact CG1-CB 4.32Å; I81-I155 HydrophobicContact CG1-CG1 3.88Å; I81-I155 HydrophobicContact CG1-CG2 4.31Å; I81-I155 CarbonylContact O-C 3.55Å; I81-I155 WeakPolarHBondContact O-CA 3.4Å; I81-V156 PolarHBondContact O-N 3.02Å; I81-L171 HydrophobicContact CB-CD1 4.49Å; I81-L171 HydrophobicContact CD1-CB 4.19Å; I81-L171 HydrophobicContact CG1-CD1 4.47Å
82	G	97	Very high	92	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	158.2	167.6	-177	0	0	0	0	0	112.3	K88 W133 V156	G82-K88 PolarHBondContact O-NZ 3.26Å; G82-W133 PolarHBondContact O-NE1 3.34Å; G82-V156 VanDerWaalsContact CA-O 3.31Å; G82-V156 WeakPolarHBondContact CA-O 3.29Å
83	E	96.3	Very high	93.7	Very high	72 Å²	72	31.8 Å²	31.8	34%	0.336	19%	0.187	S	C	.	.	S	Bend	trans	-58.5	153.8	178.7	-169.5	53.1	-93.7	0	0	112	G85 V86 K88 K167	E83-G85 PolarHBondContact O-N 3.13Å; E83-V86 HydrophobicContact CB-CG1 3.89Å; E83-V86 VanDerWaalsContact O-CG1 3.3Å; E83-V86 WeakPolarHBondContact O-CG1 3.15Å; E83-V86 WeakPolarHBondContact O-CG2 3.32Å; E83-V86 PolarHBondContact O-N 2.96Å; E83-K88 PolarHBondContact O-NZ 3.21Å; E83-K167 HydrophobicContact CB-CB 4.34Å; E83-K167 HydrophobicContact CB-CG 4.3Å; E83-K167 WeakPolarHBondContact OE2-CG 3.26Å
84	H	94.5	Very high	95	Very high	114 Å²	114	29.2 Å²	29.2	53%	0.528	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	137.3	177.4	174.5	-86.9	0	0	0	111	V86 D134	H84-V86 VanDerWaalsContact C-N 3.33Å; H84-V86 PolarHBondContact O-N 2.93Å; H84-D134 IonicContact CD2-OD2 3.96Å
85	G	95.8	Very high	95.1	Very high	42 Å²	42	27.4 Å²	27.4	43%	0.433	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.3	3.4	175.6	0	0	0	0	0	115.9	E83 G87 K192	E83-G85 PolarHBondContact O-N 3.13Å; G85-G87 PolarHBondContact O-N 3.3Å; G85-K192 WeakPolarHBondContact O-CE 3.46Å; G85-K192 PolarHBondContact O-NZ 2.82Å
86	V	98.3	Very high	94.8	Very high	1 Å²	1	25.9 Å²	25.9	1%	0.006	15%	0.147	C	C	.	.	S	Bend	trans	-70.5	-13.4	173.8	-58.7	0	0	0	0	113.5	E83 H84 K88 V156 N191 K192	E83-V86 HydrophobicContact CB-CG1 3.89Å; E83-V86 VanDerWaalsContact O-CG1 3.3Å; E83-V86 WeakPolarHBondContact O-CG1 3.15Å; E83-V86 WeakPolarHBondContact O-CG2 3.32Å; E83-V86 PolarHBondContact O-N 2.96Å; H84-V86 VanDerWaalsContact C-N 3.33Å; H84-V86 PolarHBondContact O-N 2.93Å; V86-K88 HydrophobicContact CG2-CD 4.39Å; V86-K88 HydrophobicContact CG2-CG 3.73Å; V86-V156 HydrophobicContact CB-CG1 4.37Å; V86-V156 HydrophobicContact CG2-CB 3.95Å; V86-V156 HydrophobicContact CG2-CG1 3.82Å; V86-N191 PolarHBondContact O-ND2 3.3Å; V86-K192 WeakPolarHBondContact O-CE 3.16Å
87	G	97.2	Very high	94	Very high	12 Å²	12	26.1 Å²	26.1	12%	0.124	15%	0.151	C	C	.	.	S	Bend	trans	98.4	34.1	176.4	0	0	0	0	0	115.1	G85 S90 L91	G85-G87 PolarHBondContact O-N 3.3Å; G87-S90 PolarHBondContact O-N 3.49Å; G87-L91 PolarHBondContact O-N 3.06Å
88	K	96.8	Very high	92.3	Very high	2 Å²	2	26.4 Å²	26.4	1%	0.009	16%	0.162	C	C	.	.	H	α-helix	trans	-60.3	-55.9	174.6	-59.4	-179.2	-65.6	-82.6	0	111.3	L80 G82 E83 V86 S90 L91 A92 D131 W133 D134 V156	L80-K88 HydrophobicContact CB-CB 4.22Å; L80-K88 HydrophobicContact CB-CD 4.39Å; L80-K88 HydrophobicContact CB-CG 4.46Å; L80-K88 HydrophobicContact CD1-CB 4.1Å; L80-K88 WeakPolarHBondContact CD1-O 3.42Å; G82-K88 PolarHBondContact O-NZ 3.26Å; E83-K88 PolarHBondContact O-NZ 3.21Å; V86-K88 HydrophobicContact CG2-CD 4.39Å; V86-K88 HydrophobicContact CG2-CG 3.73Å; K88-S90 VanDerWaalsContact C-N 3.27Å; K88-S90 PolarHBondContact O-N 3.29Å; K88-L91 WeakPolarHBondContact O-CB 3.49Å; K88-L91 PolarHBondContact O-N 3.43Å; K88-A92 PolarHBondContact O-N 3.08Å; K88-D131 VanDerWaalsContact CB-OD1 3.27Å; K88-D131 WeakPolarHBondContact CB-OD1 3.44Å; K88-W133 HydrophobicContact CD-CB 4.44Å; K88-D134 VanDerWaalsContact CE-CG 3.45Å; K88-D134 WeakPolarHBondContact CE-OD1 3.45Å; K88-D134 VanDerWaalsContact CE-OD2 3.23Å; K88-D134 WeakPolarHBondContact CE-OD2 3.47Å; K88-D134 IonicContact NZ-OD1 3.33Å; K88-D134 PolarHBondContact NZ-OD1 3.4Å; K88-D134 IonicContact NZ-OD2 2.71Å; K88-D134 PolarHBondContact NZ-OD2 3.05Å; K88-V156 HydrophobicContact CG-CB 4.17Å; K88-V156 HydrophobicContact CG-CG2 4.28Å
89	S	94.6	Very high	90.2	Very high	49 Å²	49	33 Å²	33	34%	0.343	19%	0.192	S	C	.	.	H	α-helix	trans	-61.7	-33.2	176.5	-39	0	0	0	0	113.3	A92 N93 D131	S89-A92 PolarHBondContact O-N 2.92Å; S89-N93 WeakPolarHBondContact O-CB 3.37Å; S89-N93 PolarHBondContact O-N 3.39Å; S89-N93 PolarHBondContact O-ND2 3.43Å; S89-D131 WeakPolarHBondContact CA-OD2 3.43Å; S89-D131 WeakPolarHBondContact CB-OD2 3.48Å; S89-D131 PolarHBondContact N-OD2 2.98Å; S89-D131 PolarHBondContact OG-OD2 3.09Å
90	S	95.4	Very high	87.9	Confident	62 Å²	62	38.3 Å²	38.3	43%	0.434	22%	0.221	S	C	.	.	H	α-helix	trans	-64	-44	173.2	-51.9	0	0	0	0	111.7	G87 K88 A92 I94	G87-S90 PolarHBondContact O-N 3.49Å; K88-S90 VanDerWaalsContact C-N 3.27Å; K88-S90 PolarHBondContact O-N 3.29Å; S90-A92 VanDerWaalsContact C-N 3.34Å; S90-I94 WeakPolarHBondContact O-CG1 3.39Å; S90-I94 PolarHBondContact O-N 2.99Å; S90-I94 VanDerWaalsContact O-N 3.11Å
91	L	96.4	Very high	85.5	Confident	0 Å²	0	44 Å²	44	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-63.7	-40.9	173.8	-75.7	168	0	0	0	111.5	G87 K88 I94 F95 V156 V189 N191 A222 V228	G87-L91 PolarHBondContact O-N 3.06Å; K88-L91 WeakPolarHBondContact O-CB 3.49Å; K88-L91 PolarHBondContact O-N 3.43Å; L91-I94 PolarHBondContact O-N 2.96Å; L91-F95 VanDerWaalsContact O-CB 3.27Å; L91-F95 WeakPolarHBondContact O-CB 3.26Å; L91-F95 PolarHBondContact O-N 3.2Å; L91-V156 HydrophobicContact CD1-CG1 4.06Å; L91-V156 HydrophobicContact CD1-CG2 4.34Å; L91-V189 HydrophobicContact CD1-CG1 4.33Å; L91-N191 HydrophobicContact CD1-CB 4.5Å; L91-A222 HydrophobicContact CD2-CB 4.02Å; L91-A222 HydrophobicContact CG-CB 4.18Å; L91-V228 HydrophobicContact CD2-CG1 4.4Å; L91-V228 HydrophobicContact CD2-CG2 3.94Å
92	A	94.5	Very high	83.2	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-63.4	-44.2	178	0	0	0	0	0	112.6	L80 K88 S89 S90 F95 A96 Y114 L129 D131	L80-A92 HydrophobicContact CD1-CB 3.97Å; K88-A92 PolarHBondContact O-N 3.08Å; S89-A92 PolarHBondContact O-N 2.92Å; S90-A92 VanDerWaalsContact C-N 3.34Å; A92-F95 CarbonylContact O-C 3.57Å; A92-F95 WeakPolarHBondContact O-CB 3.4Å; A92-F95 PolarHBondContact O-N 3.15Å; A92-A96 WeakPolarHBondContact O-CB 3.11Å; A92-A96 PolarHBondContact O-N 3.32Å; A92-Y114 HydrophobicContact CB-CD2 3.86Å; A92-Y114 HydrophobicContact CB-CE2 3.52Å; A92-L129 HydrophobicContact CB-CD2 3.7Å; A92-D131 HydrophobicContact CB-CB 4.29Å
93	N	91.1	Very high	80.9	Confident	57 Å²	57	58.4 Å²	58.4	31%	0.305	34%	0.336	S	S	.	.	H	α-helix	trans	-67	-39.1	178.5	-71.9	-28.8	0	0	0	112.8	S89 F95 A96 G97 V98 Y114	S89-N93 WeakPolarHBondContact O-CB 3.37Å; S89-N93 PolarHBondContact O-N 3.39Å; S89-N93 PolarHBondContact O-ND2 3.43Å; N93-F95 VanDerWaalsContact C-N 3.34Å; N93-A96 PolarHBondContact O-N 3.31Å; N93-G97 PolarHBondContact O-N 3.48Å; N93-V98 HydrophobicContact CB-CG2 4.37Å; N93-V98 PolarHBondContact O-N 3.21Å; N93-Y114 WeakPolarHBondContact OD1-CE1 3.23Å; N93-Y114 PolarHBondContact OD1-OH 3.04Å
94	I	91.4	Very high	78.8	Confident	29 Å²	29	57.2 Å²	57.2	15%	0.149	34%	0.336	C	S	.	.	H	α-helix	trans	-65.7	-42.5	173.8	-64.1	-69.3	0	0	0	109.9	S90 L91 A96 G97 A222 Q225 V228	S90-I94 WeakPolarHBondContact O-CG1 3.39Å; S90-I94 PolarHBondContact O-N 2.99Å; S90-I94 VanDerWaalsContact O-N 3.11Å; L91-I94 PolarHBondContact O-N 2.96Å; I94-A96 VanDerWaalsContact C-N 3.3Å; I94-A96 PolarHBondContact O-N 2.99Å; I94-G97 PolarHBondContact O-N 3.4Å; I94-G97 VanDerWaalsContact O-N 3.12Å; I94-A222 HydrophobicContact CG1-CB 4.29Å; I94-Q225 HydrophobicContact CD1-CG 4.12Å; I94-Q225 HydrophobicContact CG2-CB 4.43Å; I94-Q225 HydrophobicContact CG2-CG 3.89Å; I94-V228 HydrophobicContact CG2-CB 4.4Å; I94-V228 HydrophobicContact CG2-CG1 3.95Å; I94-V228 HydrophobicContact CG2-CG2 4.32Å
95	F	88.7	Confident	77.2	Confident	8 Å²	8	58.3 Å²	58.3	4%	0.035	35%	0.346	C	S	.	.	H	α-helix	trans	-60.2	-40	174.4	178.8	-111	0	0	0	112.7	L91 A92 N93 G97 R116 L118 I127 L129 F232	L91-F95 VanDerWaalsContact O-CB 3.27Å; L91-F95 WeakPolarHBondContact O-CB 3.26Å; L91-F95 PolarHBondContact O-N 3.2Å; A92-F95 CarbonylContact O-C 3.57Å; A92-F95 WeakPolarHBondContact O-CB 3.4Å; A92-F95 PolarHBondContact O-N 3.15Å; N93-F95 VanDerWaalsContact C-N 3.34Å; F95-G97 PolarHBondContact O-N 3.46Å; F95-R116 HydrophobicContact CE1-CB 3.7Å; F95-R116 HydrophobicContact CZ-CB 3.71Å; F95-R116 HydrophobicContact CZ-CG 4.35Å; F95-R116 WeakPolarHBondContact O-CD 3.45Å; F95-R116 PolarHBondContact O-NH1 2.92Å; F95-L118 HydrophobicContact CE2-CD1 3.79Å; F95-L118 HydrophobicContact CE2-CD2 4.05Å; F95-L118 HydrophobicContact CE2-CG 4.24Å; F95-L118 HydrophobicContact CZ-CD1 4.2Å; F95-L118 HydrophobicContact CZ-CD2 4.46Å; F95-L118 HydrophobicContact CZ-CG 4.41Å; F95-I127 HydrophobicContact CE1-CB 4.13Å; F95-I127 HydrophobicContact CE1-CG2 4.06Å; F95-I127 HydrophobicContact CE2-CD1 4.28Å; F95-I127 HydrophobicContact CZ-CB 3.83Å; F95-I127 HydrophobicContact CZ-CD1 3.91Å; F95-I127 HydrophobicContact CZ-CG1 4.33Å; F95-I127 HydrophobicContact CZ-CG2 4.1Å; F95-L129 HydrophobicContact CB-CD2 4.24Å; F95-L129 HydrophobicContact CD1-CB 4.31Å; F95-L129 HydrophobicContact CD1-CD2 3.68Å; F95-L129 HydrophobicContact CE1-CB 4.41Å; F95-L129 HydrophobicContact CE1-CD2 4.49Å; F95-L129 HydrophobicContact CG-CD2 4.21Å; F95-F232 HydrophobicContact CB-CD2 4.13Å; F95-F232 HydrophobicContact CB-CE1 4.39Å; F95-F232 HydrophobicContact CB-CE2 3.46Å; F95-F232 VanDerWaalsContact CB-CE2 3.46Å; F95-F232 HydrophobicContact CB-CZ 3.61Å; F95-F232 HydrophobicContact CD1-CE1 4.25Å; F95-F232 HydrophobicContact CD1-CZ 4.28Å; F95-F232 HydrophobicContact CD2-CB 4.11Å; F95-F232 AromaticContact CD2-CD1 3.81Å; F95-F232 HydrophobicContact CD2-CD1 3.81Å; F95-F232 AromaticContact CD2-CD2 3.2Å; F95-F232 HydrophobicContact CD2-CD2 3.2Å; F95-F232 HydrophobicContact CD2-CE1 4Å; F95-F232 AromaticContact CD2-CE2 3.46Å; F95-F232 HydrophobicContact CD2-CE2 3.46Å; F95-F232 VanDerWaalsContact CD2-CE2 3.46Å; F95-F232 AromaticContact CD2-CG 3.42Å; F95-F232 HydrophobicContact CD2-CG 3.42Å; F95-F232 VanDerWaalsContact CD2-CG 3.42Å; F95-F232 AromaticContact CD2-CZ 3.84Å; F95-F232 HydrophobicContact CD2-CZ 3.84Å; F95-F232 HydrophobicContact CE2-CB 3.84Å; F95-F232 AromaticContact CE2-CD1 3.87Å; F95-F232 HydrophobicContact CE2-CD1 3.87Å; F95-F232 AromaticContact CE2-CD2 3.84Å; F95-F232 HydrophobicContact CE2-CD2 3.84Å; F95-F232 HydrophobicContact CE2-CE1 4.4Å; F95-F232 HydrophobicContact CE2-CE2 4.41Å; F95-F232 AromaticContact CE2-CG 3.56Å; F95-F232 HydrophobicContact CE2-CG 3.56Å; F95-F232 HydrophobicContact CG-CD1 4.19Å; F95-F232 AromaticContact CG-CD2 3.86Å; F95-F232 HydrophobicContact CG-CD2 3.86Å; F95-F232 AromaticContact CG-CE1 3.91Å; F95-F232 HydrophobicContact CG-CE1 3.91Å; F95-F232 AromaticContact CG-CE2 3.59Å; F95-F232 HydrophobicContact CG-CE2 3.59Å; F95-F232 HydrophobicContact CG-CG 4.17Å; F95-F232 AromaticContact CG-CZ 3.61Å; F95-F232 HydrophobicContact CG-CZ 3.61Å; F95-F232 HydrophobicContact CZ-CD1 4.28Å; F95-F232 HydrophobicContact CZ-CG 4.39Å
96	A	85.5	Confident	75.5	Confident	4 Å²	4	57.5 Å²	57.5	3%	0.033	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-6.9	178.3	0	0	0	0	0	113.7	A92 N93 I94 V98 C106 Y114	A92-A96 WeakPolarHBondContact O-CB 3.11Å; A92-A96 PolarHBondContact O-N 3.32Å; N93-A96 PolarHBondContact O-N 3.31Å; I94-A96 VanDerWaalsContact C-N 3.3Å; I94-A96 PolarHBondContact O-N 2.99Å; A96-V98 VanDerWaalsContact C-N 3.31Å; A96-V98 HydrophobicContact CB-CG2 4Å; A96-V98 PolarHBondContact O-N 2.84Å; A96-C106 WeakPolarHBondContact CA-SG 3.3Å; A96-C106 VanDerWaalsContact CB-SG 3.53Å; A96-C106 WeakPolarHBondContact O-CB 3.42Å; A96-C106 PolarHBondContact O-SG 3.12Å; A96-C106 VanDerWaalsContact O-SG 3.39Å; A96-Y114 HydrophobicContact CB-CD1 3.49Å; A96-Y114 VanDerWaalsContact CB-CD1 3.49Å; A96-Y114 HydrophobicContact CB-CE1 4.11Å; A96-Y114 HydrophobicContact CB-CG 4.24Å
97	G	77.5	Confident	74	Confident	10 Å²	10	63.7 Å²	63.7	10%	0.103	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.6	21.4	179.2	0	0	0	0	0	113.7	N93 I94 F95 H99 D100 S104	N93-G97 PolarHBondContact O-N 3.48Å; I94-G97 PolarHBondContact O-N 3.4Å; I94-G97 VanDerWaalsContact O-N 3.12Å; F95-G97 PolarHBondContact O-N 3.46Å; G97-H99 PolarHBondContact O-N 2.91Å; G97-D100 PolarHBondContact O-N 2.59Å; G97-S104 PolarHBondContact O-OG 3.42Å
98	V	59.9	Low	72.8	Confident	92 Å²	92	67.4 Å²	67.4	56%	0.558	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-15.6	-179.8	178.8	0	0	0	0	112.6	N93 A96	N93-V98 HydrophobicContact CB-CG2 4.37Å; N93-V98 PolarHBondContact O-N 3.21Å; A96-V98 VanDerWaalsContact C-N 3.31Å; A96-V98 HydrophobicContact CB-CG2 4Å; A96-V98 PolarHBondContact O-N 2.84Å
99	H	52.1	Low	71.1	Confident	138 Å²	138	71 Å²	71	64%	0.639	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.1	-12.9	176.1	-77.8	-63.3	0	0	0	115.8	G97	G97-H99 PolarHBondContact O-N 2.91Å
100	D	49.2	Very low	69.8	Low	112 Å²	112	70.2 Å²	70.2	60%	0.599	40%	0.401	S	S	*	.			trans	-107.8	91.5	178	-88.3	-18.7	0	0	0	109.9	G97 I102 S104	G97-D100 PolarHBondContact O-N 2.59Å; D100-I102 PolarHBondContact O-N 2.68Å; D100-S104 PolarHBondContact O-OG 2.94Å; D100-S104 VanDerWaalsContact O-OG 3.11Å
101	S	46.4	Very low	68.7	Low	121 Å²	121	74.3 Å²	74.3	85%	0.846	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	26.8	-171.1	55	0	0	0	0	115.4
102	I	48.2	Very low	68.2	Low	157 Å²	157	75.9 Å²	75.9	81%	0.805	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.5	-20.6	-172	-68.4	176.4	0	0	0	115.3	D100	D100-I102 PolarHBondContact O-N 2.68Å
103	D	48.6	Very low	68	Low	144 Å²	144	76.7 Å²	76.7	77%	0.77	43%	0.426	S	S	*	.			trans	-162.2	48	-178.3	-139.2	15.3	0	0	0	113.9	D105	D103-D105 PolarHBondContact O-N 3.03Å
104	S	53.8	Low	68	Low	48 Å²	48	74.7 Å²	74.7	34%	0.336	41%	0.414	S	S	.	.			trans	-94.8	95.1	-175	-65.3	0	0	0	0	110.9	G97 D100 C106	G97-S104 PolarHBondContact O-OG 3.42Å; D100-S104 PolarHBondContact O-OG 2.94Å; D100-S104 VanDerWaalsContact O-OG 3.11Å; S104-C106 PolarHBondContact O-N 3.19Å
105	D	59.9	Low	68	Low	137 Å²	137	76.1 Å²	76.1	73%	0.733	42%	0.42	S	S	*	.			trans	-65.1	47.8	160.7	-69	-27.9	0	0	0	111	D103	D103-D105 PolarHBondContact O-N 3.03Å
106	C	60.1	Low	68	Low	24 Å²	24	78.7 Å²	78.7	16%	0.162	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	120.6	178.4	-172.8	0	0	0	0	109.1	A96 S104 E115 R116	A96-C106 WeakPolarHBondContact CA-SG 3.3Å; A96-C106 VanDerWaalsContact CB-SG 3.53Å; A96-C106 WeakPolarHBondContact O-CB 3.42Å; A96-C106 PolarHBondContact O-SG 3.12Å; A96-C106 VanDerWaalsContact O-SG 3.39Å; S104-C106 PolarHBondContact O-N 3.19Å; C106-E115 VanDerWaalsContact CA-O 3.31Å; C106-E115 WeakPolarHBondContact CA-O 3.32Å; C106-E115 PolarHBondContact SG-O 3.48Å; C106-R116 HydrophobicContact CB-CB 4.43Å; C106-R116 HydrophobicContact CB-CG 4.37Å
107	E	66.3	Low	68.3	Low	132 Å²	132	81.3 Å²	81.3	62%	0.617	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.9	128.8	172.2	-65.3	-170.7	174.4	0	0	109.1	L109 E115	E107-L109 HydrophobicContact CB-CD2 4.26Å; E107-L109 PolarHBondContact O-N 3.37Å; E107-E115 PolarHBondContact N-O 2.82Å; E107-E115 VanDerWaalsContact N-O 3.09Å; E107-E115 PolarHBondContact O-N 3.14Å
108	V	72.9	Confident	68.9	Low	90 Å²	90	82.5 Å²	82.5	55%	0.545	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	103.6	171.5	179.2	0	0	0	0	106.8	G110 Y114	V108-G110 VanDerWaalsContact C-N 3.29Å; V108-G110 WeakPolarHBondContact CG1-O 3.36Å; V108-G110 PolarHBondContact O-N 3.45Å; V108-Y114 HydrophobicContact CG2-CD1 4.27Å
109	L	61.7	Low	70.4	Confident	77 Å²	77	84.1 Å²	84.1	40%	0.403	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	-9.7	-174.7	-60.7	179.4	0	0	0	113.2	E107 T113 E115	E107-L109 HydrophobicContact CB-CD2 4.26Å; E107-L109 PolarHBondContact O-N 3.37Å; L109-T113 HydrophobicContact CB-CG2 4.16Å; L109-T113 HydrophobicContact CD1-CG2 4.38Å; L109-T113 PolarHBondContact N-O 2.99Å; L109-T113 VanDerWaalsContact N-O 3.1Å; L109-E115 HydrophobicContact CD1-CB 3.91Å; L109-E115 WeakPolarHBondContact CD1-OE2 3.48Å; L109-E115 HydrophobicContact CG-CB 4.14Å
110	G	66.9	Low	72.4	Confident	33 Å²	33	77.5 Å²	77.5	34%	0.34	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.6	-177.8	178.6	0	0	0	0	0	111.6	V108 D112	V108-G110 VanDerWaalsContact C-N 3.29Å; V108-G110 WeakPolarHBondContact CG1-O 3.36Å; V108-G110 PolarHBondContact O-N 3.45Å; G110-D112 PolarHBondContact O-N 3.27Å
111	E	72.4	Confident	74.5	Confident	147 Å²	147	77.5 Å²	77.5	69%	0.687	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-34.1	-177	-165.7	174.5	-175.7	0	0	112.5
112	D	85.6	Confident	76.6	Confident	34 Å²	34	75.1 Å²	75.1	18%	0.182	42%	0.416	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.5	18.5	-172.2	-61	-31.2	0	0	0	113.1	G110 D131 M132 N135	G110-D112 PolarHBondContact O-N 3.27Å; D112-D131 PolarHBondContact O-N 2.78Å; D112-M132 HydrophobicContact CB-CB 4.5Å; D112-M132 HydrophobicContact CB-CG 3.71Å; D112-N135 PolarHBondContact OD2-ND2 2.77Å
113	T	90.3	Very high	78.7	Confident	16 Å²	16	71.8 Å²	71.8	10%	0.098	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	126.2	-178.4	-60.4	0	0	0	0	111.8	L109 I128 L129 L130	L109-T113 HydrophobicContact CB-CG2 4.16Å; L109-T113 HydrophobicContact CD1-CG2 4.38Å; L109-T113 PolarHBondContact N-O 2.99Å; L109-T113 VanDerWaalsContact N-O 3.1Å; T113-I128 HydrophobicContact CG2-CG2 3.86Å; T113-L129 WeakPolarHBondContact CA-O 3.4Å; T113-L130 HydrophobicContact CG2-CD2 3.82Å
114	Y	90.9	Very high	80.8	Confident	16 Å²	16	67.4 Å²	67.4	6%	0.063	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	131.4	-175.5	-50.4	-97.2	0	0	0	110	A92 N93 A96 V108 I128 L129 D131	A92-Y114 HydrophobicContact CB-CD2 3.86Å; A92-Y114 HydrophobicContact CB-CE2 3.52Å; N93-Y114 WeakPolarHBondContact OD1-CE1 3.23Å; N93-Y114 PolarHBondContact OD1-OH 3.04Å; A96-Y114 HydrophobicContact CB-CD1 3.49Å; A96-Y114 VanDerWaalsContact CB-CD1 3.49Å; A96-Y114 HydrophobicContact CB-CE1 4.11Å; A96-Y114 HydrophobicContact CB-CG 4.24Å; V108-Y114 HydrophobicContact CG2-CD1 4.27Å; Y114-I128 CarbonylContact O-C 3.59Å; Y114-I128 WeakPolarHBondContact O-CA 3.36Å; Y114-L129 PolarHBondContact N-O 3.21Å; Y114-L129 PolarHBondContact O-N 2.98Å; Y114-D131 HydrophobicContact CE2-CB 4.11Å
115	E	91.4	Very high	82.7	Confident	59 Å²	59	65.1 Å²	65.1	28%	0.276	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	127.4	172.9	-176.6	170.4	153.2	0	0	110.1	C106 E107 L109 T126 I127 I128	C106-E115 VanDerWaalsContact CA-O 3.31Å; C106-E115 WeakPolarHBondContact CA-O 3.32Å; C106-E115 PolarHBondContact SG-O 3.48Å; E107-E115 PolarHBondContact N-O 2.82Å; E107-E115 VanDerWaalsContact N-O 3.09Å; E107-E115 PolarHBondContact O-N 3.14Å; L109-E115 HydrophobicContact CD1-CB 3.91Å; L109-E115 WeakPolarHBondContact CD1-OE2 3.48Å; L109-E115 HydrophobicContact CG-CB 4.14Å; E115-T126 HydrophobicContact CG-CG2 3.67Å; E115-T126 VanDerWaalsContact OE1-CG2 3.3Å; E115-T126 WeakPolarHBondContact OE1-CG2 3.44Å; E115-I127 WeakPolarHBondContact CA-O 3.35Å; E115-I128 HydrophobicContact CG-CG1 4.39Å
116	R	89.4	Confident	84.3	Confident	61 Å²	61	59.9 Å²	59.9	23%	0.23	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	138.6	174.2	-170.3	173.7	-174	167.3	8.5	111.6	F95 C106 L118 I127	F95-R116 HydrophobicContact CE1-CB 3.7Å; F95-R116 HydrophobicContact CZ-CB 3.71Å; F95-R116 HydrophobicContact CZ-CG 4.35Å; F95-R116 WeakPolarHBondContact O-CD 3.45Å; F95-R116 PolarHBondContact O-NH1 2.92Å; C106-R116 HydrophobicContact CB-CB 4.43Å; C106-R116 HydrophobicContact CB-CG 4.37Å; R116-L118 HydrophobicContact CG-CD2 4.25Å; R116-I127 PolarHBondContact N-O 2.96Å; R116-I127 PolarHBondContact O-N 3.45Å
117	T	91.1	Very high	86	Confident	59 Å²	59	58.7 Å²	58.7	36%	0.362	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	133.2	174.8	-62.3	0	0	0	0	111.2	S124 A125 T126	T117-S124 WeakPolarHBondContact CG2-OG 3.46Å; T117-A125 CarbonylContact C-O 3.57Å; T117-A125 WeakPolarHBondContact CA-O 3.36Å; T117-T126 PolarHBondContact OG1-OG1 2.88Å
118	L	89.9	Confident	87.3	Confident	36 Å²	36	53.3 Å²	53.3	19%	0.188	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	149	-180	-52.1	176.2	0	0	0	110.4	F95 R116 V120 S124 A125 I127 F232	F95-L118 HydrophobicContact CE2-CD1 3.79Å; F95-L118 HydrophobicContact CE2-CD2 4.05Å; F95-L118 HydrophobicContact CE2-CG 4.24Å; F95-L118 HydrophobicContact CZ-CD1 4.2Å; F95-L118 HydrophobicContact CZ-CD2 4.46Å; F95-L118 HydrophobicContact CZ-CG 4.41Å; R116-L118 HydrophobicContact CG-CD2 4.25Å; L118-V120 HydrophobicContact CB-CG2 4.16Å; L118-S124 CarbonylContact O-C 3.6Å; L118-S124 WeakPolarHBondContact O-CA 3.41Å; L118-A125 PolarHBondContact N-O 2.95Å; L118-A125 PolarHBondContact O-N 3.17Å; L118-I127 HydrophobicContact CD1-CD1 3.68Å; L118-I127 HydrophobicContact CD1-CG1 4.47Å; L118-F232 HydrophobicContact CD1-CB 4.01Å
119	M	91.7	Very high	88.4	Confident	125 Å²	125	49 Å²	49	62%	0.616	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.2	111.4	166.4	-71.4	-62.4	-67	0	0	109.8	G122	M119-G122 WeakPolarHBondContact CE-O 3.39Å
120	V	93.8	Very high	90	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	119	179.3	-175.2	0	0	0	0	109	L118 G122 E123 A125 E233 V236 R237 R240	L118-V120 HydrophobicContact CB-CG2 4.16Å; V120-G122 PolarHBondContact O-N 3.09Å; V120-E123 PolarHBondContact N-O 2.79Å; V120-E123 PolarHBondContact O-N 2.88Å; V120-E123 VanDerWaalsContact O-O 3.04Å; V120-A125 HydrophobicContact CG2-CB 4.19Å; V120-E233 HydrophobicContact CG1-CB 4.26Å; V120-E233 HydrophobicContact CG2-CB 4.34Å; V120-E233 HydrophobicContact CG2-CG 4.19Å; V120-V236 HydrophobicContact CB-CG1 3.97Å; V120-V236 HydrophobicContact CG1-CB 4.33Å; V120-V236 HydrophobicContact CG1-CG1 4.01Å; V120-V236 HydrophobicContact CG2-CB 4.11Å; V120-V236 HydrophobicContact CG2-CG1 3.95Å; V120-V236 HydrophobicContact CG2-CG2 4.3Å; V120-R237 HydrophobicContact CG1-CG 3.94Å; V120-R240 PolarHBondContact O-NH1 3.47Å
121	D	93.4	Very high	91.2	Very high	112 Å²	112	44.8 Å²	44.8	60%	0.599	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.8	35.9	179	-52.8	-27.9	0	0	0	113.7	R237	D121-R237 IonicContact OD1-CZ 3.38Å; D121-R237 IonicContact OD1-NE 3.09Å; D121-R237 PolarHBondContact OD1-NE 3.11Å; D121-R237 VanDerWaalsContact OD1-NE 3.09Å; D121-R237 IonicContact OD1-NH2 2.82Å; D121-R237 PolarHBondContact OD1-NH2 2.9Å; D121-R237 WeakPolarHBondContact OD2-CD 3.4Å; D121-R237 WeakPolarHBondContact OD2-CG 3.42Å; D121-R237 IonicContact OD2-CZ 3.86Å; D121-R237 IonicContact OD2-NE 2.88Å; D121-R237 PolarHBondContact OD2-NE 2.94Å
122	G	90.8	Very high	91.9	Very high	71 Å²	71	38.4 Å²	38.4	73%	0.732	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.5	0.1	179.7	0	0	0	0	0	115.2	M119 V120	M119-G122 WeakPolarHBondContact CE-O 3.39Å; V120-G122 PolarHBondContact O-N 3.09Å
123	E	91.9	Very high	92	Very high	86 Å²	86	37.7 Å²	37.7	40%	0.402	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	133	-179.5	-175.7	-172.1	-174.3	0	0	111.2	N74 V120 R240	N74-E123 PolarHBondContact ND2-OE1 3.11Å; N74-E123 PolarHBondContact OD1-OE1 3.42Å; V120-E123 PolarHBondContact N-O 2.79Å; V120-E123 PolarHBondContact O-N 2.88Å; V120-E123 VanDerWaalsContact O-O 3.04Å; E123-R240 PolarHBondContact O-NH2 2.95Å; E123-R240 IonicContact OE2-CZ 3.21Å; E123-R240 IonicContact OE2-NE 3.42Å; E123-R240 PolarHBondContact OE2-NE 2.92Å; E123-R240 IonicContact OE2-NH1 3.54Å; E123-R240 IonicContact OE2-NH2 3.45Å; E123-R240 PolarHBondContact OE2-NH2 3.47Å
124	S	92.3	Very high	91.6	Very high	52 Å²	52	39.1 Å²	39.1	36%	0.364	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64	136.7	177	-175	0	0	0	0	111.9	N74 T117 L118 R240	N74-S124 WeakPolarHBondContact CB-O 3.27Å; N74-S124 PolarHBondContact ND2-O 2.93Å; N74-S124 VanDerWaalsContact ND2-O 3.16Å; T117-S124 WeakPolarHBondContact CG2-OG 3.46Å; L118-S124 CarbonylContact O-C 3.6Å; L118-S124 WeakPolarHBondContact O-CA 3.41Å; S124-R240 PolarHBondContact O-NH2 3.47Å
125	A	93.8	Very high	90.7	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	115.3	-178.7	0	0	0	0	0	110.2	N74 Y76 T117 L118 V120 V236	N74-A125 CarbonylContact O-C 3.41Å; Y76-A125 HydrophobicContact CD2-CB 4.03Å; Y76-A125 HydrophobicContact CE2-CB 3.57Å; T117-A125 CarbonylContact C-O 3.57Å; T117-A125 WeakPolarHBondContact CA-O 3.36Å; L118-A125 PolarHBondContact N-O 2.95Å; L118-A125 PolarHBondContact O-N 3.17Å; V120-A125 HydrophobicContact CG2-CB 4.19Å; A125-V236 HydrophobicContact CB-CG1 3.69Å; A125-V236 HydrophobicContact CB-CG2 4.03Å
126	T	94.1	Very high	89.3	Confident	27 Å²	27	45.8 Å²	45.8	17%	0.166	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	122.5	173	-53.8	0	0	0	0	109.3	N74 C75 Y76 E115 T117	N74-T126 PolarHBondContact O-N 3.44Å; C75-T126 CarbonylContact C-O 3.6Å; C75-T126 VanDerWaalsContact CA-O 3.25Å; C75-T126 WeakPolarHBondContact CA-O 3.39Å; Y76-T126 PolarHBondContact N-O 3.42Å; E115-T126 HydrophobicContact CG-CG2 3.67Å; E115-T126 VanDerWaalsContact OE1-CG2 3.3Å; E115-T126 WeakPolarHBondContact OE1-CG2 3.44Å; T117-T126 PolarHBondContact OG1-OG1 2.88Å
127	I	95.1	Very high	87.9	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	125.1	174.4	-61.1	-177.5	0	0	0	108.3	Y76 V78 F95 E115 R116 L118 L129 F232 I235 V236	Y76-I127 WeakPolarHBondContact O-CA 3.35Å; V78-I127 HydrophobicContact CB-CG2 4.09Å; V78-I127 HydrophobicContact CG2-CG2 3.77Å; F95-I127 HydrophobicContact CE1-CB 4.13Å; F95-I127 HydrophobicContact CE1-CG2 4.06Å; F95-I127 HydrophobicContact CE2-CD1 4.28Å; F95-I127 HydrophobicContact CZ-CB 3.83Å; F95-I127 HydrophobicContact CZ-CD1 3.91Å; F95-I127 HydrophobicContact CZ-CG1 4.33Å; F95-I127 HydrophobicContact CZ-CG2 4.1Å; E115-I127 WeakPolarHBondContact CA-O 3.35Å; R116-I127 PolarHBondContact N-O 2.96Å; R116-I127 PolarHBondContact O-N 3.45Å; L118-I127 HydrophobicContact CD1-CD1 3.68Å; L118-I127 HydrophobicContact CD1-CG1 4.47Å; I127-L129 HydrophobicContact CG2-CB 4.34Å; I127-F232 HydrophobicContact CD1-CB 3.97Å; I127-F232 HydrophobicContact CD1-CD1 4.04Å; I127-F232 HydrophobicContact CD1-CG 4.43Å; I127-I235 HydrophobicContact CD1-CG2 4.48Å; I127-V236 HydrophobicContact CD1-CG2 3.67Å; I127-V236 HydrophobicContact CG1-CG2 3.91Å
128	I	94.6	Very high	86.4	Confident	18 Å²	18	54.8 Å²	54.8	9%	0.092	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	106	164.1	-59.3	177.6	0	0	0	106.7	C75 Y76 R77 V78 T113 Y114 E115 L130	C75-I128 WeakPolarHBondContact SG-CD1 3.43Å; Y76-I128 PolarHBondContact O-N 2.94Å; R77-I128 CarbonylContact C-O 3.5Å; R77-I128 WeakPolarHBondContact CA-O 3.12Å; R77-I128 HydrophobicContact CG-CB 4.43Å; V78-I128 PolarHBondContact N-O 3.01Å; T113-I128 HydrophobicContact CG2-CG2 3.86Å; Y114-I128 CarbonylContact O-C 3.59Å; Y114-I128 WeakPolarHBondContact O-CA 3.36Å; E115-I128 HydrophobicContact CG-CG1 4.39Å; I128-L130 HydrophobicContact CG2-CD2 4.16Å
129	L	95.6	Very high	85.1	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	123	-178.8	-173.1	63.4	0	0	0	110.3	V78 L80 A92 F95 T113 Y114 I127 F232	V78-L129 HydrophobicContact CB-CD1 4Å; V78-L129 HydrophobicContact CG1-CD1 3.85Å; V78-L129 WeakPolarHBondContact O-CA 3.5Å; L80-L129 HydrophobicContact CD1-CD1 4.22Å; L80-L129 HydrophobicContact CD1-CD2 4.25Å; L80-L129 HydrophobicContact CD1-CG 4.3Å; L80-L129 HydrophobicContact CD2-CD1 3.87Å; L80-L129 HydrophobicContact CG-CD1 3.76Å; L80-L129 HydrophobicContact CG-CG 4.3Å; A92-L129 HydrophobicContact CB-CD2 3.7Å; F95-L129 HydrophobicContact CB-CD2 4.24Å; F95-L129 HydrophobicContact CD1-CB 4.31Å; F95-L129 HydrophobicContact CD1-CD2 3.68Å; F95-L129 HydrophobicContact CE1-CB 4.41Å; F95-L129 HydrophobicContact CE1-CD2 4.49Å; F95-L129 HydrophobicContact CG-CD2 4.21Å; T113-L129 WeakPolarHBondContact CA-O 3.4Å; Y114-L129 PolarHBondContact N-O 3.21Å; Y114-L129 PolarHBondContact O-N 2.98Å; I127-L129 HydrophobicContact CG2-CB 4.34Å; L129-F232 HydrophobicContact CD1-CE1 3.91Å; L129-F232 HydrophobicContact CD2-CE1 3.9Å; L129-F232 HydrophobicContact CD2-CZ 3.89Å
130	L	94.6	Very high	84.1	Confident	16 Å²	16	57 Å²	57	8%	0.084	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	111.5	-177.6	-59	173.3	0	0	0	109.9	V78 V79 L80 T113 I128 M132 V149	V78-L130 PolarHBondContact O-N 3.21Å; V79-L130 HydrophobicContact CG2-CB 4.32Å; V79-L130 HydrophobicContact CG2-CD1 3.9Å; L80-L130 PolarHBondContact N-O 2.83Å; T113-L130 HydrophobicContact CG2-CD2 3.82Å; I128-L130 HydrophobicContact CG2-CD2 4.16Å; L130-M132 HydrophobicContact CB-CE 4.26Å; L130-M132 HydrophobicContact CD1-CE 4.43Å; L130-M132 HydrophobicContact CD2-CE 4.2Å; L130-V149 HydrophobicContact CD1-CG2 3.68Å
131	D	93.2	Very high	83.2	Confident	5 Å²	5	63 Å²	63	3%	0.027	32%	0.321	C	S	.	.			trans	-109.3	40.9	179.3	-170.8	38.3	0	0	0	112.7	L80 K88 S89 A92 D112 Y114 W133	L80-D131 HydrophobicContact CD1-CB 4.21Å; K88-D131 VanDerWaalsContact CB-OD1 3.27Å; K88-D131 WeakPolarHBondContact CB-OD1 3.44Å; S89-D131 WeakPolarHBondContact CA-OD2 3.43Å; S89-D131 WeakPolarHBondContact CB-OD2 3.48Å; S89-D131 PolarHBondContact N-OD2 2.98Å; S89-D131 PolarHBondContact OG-OD2 3.09Å; A92-D131 HydrophobicContact CB-CB 4.29Å; D112-D131 PolarHBondContact O-N 2.78Å; Y114-D131 HydrophobicContact CE2-CB 4.11Å; D131-W133 VanDerWaalsContact C-N 3.34Å; D131-W133 PolarHBondContact O-N 3.49Å
132	M	87.3	Confident	82.5	Confident	13 Å²	13	58 Å²	58	6%	0.064	30%	0.295	C	S	.	.			trans	-87	-3.4	-174.1	-58.1	-177.4	-66.5	0	0	113.4	D112 L130 D134 N135 I142	D112-M132 HydrophobicContact CB-CB 4.5Å; D112-M132 HydrophobicContact CB-CG 3.71Å; L130-M132 HydrophobicContact CB-CE 4.26Å; L130-M132 HydrophobicContact CD1-CE 4.43Å; L130-M132 HydrophobicContact CD2-CE 4.2Å; M132-D134 VanDerWaalsContact C-N 3.33Å; M132-D134 PolarHBondContact O-N 3.16Å; M132-N135 VanDerWaalsContact O-CB 3.3Å; M132-N135 WeakPolarHBondContact O-CB 3.4Å; M132-N135 PolarHBondContact O-N 3.26Å; M132-I142 HydrophobicContact CB-CG2 3.75Å; M132-I142 VanDerWaalsContact O-CG2 3.24Å; M132-I142 WeakPolarHBondContact O-CG2 2.84Å
133	W	86.7	Confident	81.9	Confident	20 Å²	20	59.3 Å²	59.3	8%	0.076	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-33.5	-166.8	178.5	-92.9	0	0	0	114.6	L80 I81 G82 K88 D131 R143 C146 M147 L171	L80-W133 WeakPolarHBondContact O-CB 3.3Å; I81-W133 HydrophobicContact CB-CD2 3.96Å; I81-W133 HydrophobicContact CB-CE3 4Å; I81-W133 HydrophobicContact CB-CG 4.31Å; I81-W133 HydrophobicContact CB-CZ3 4.46Å; I81-W133 HydrophobicContact CG2-CD2 3.93Å; I81-W133 HydrophobicContact CG2-CE3 3.53Å; I81-W133 HydrophobicContact CG2-CG 4.37Å; I81-W133 HydrophobicContact CG2-CZ3 4.07Å; G82-W133 PolarHBondContact O-NE1 3.34Å; K88-W133 HydrophobicContact CD-CB 4.44Å; D131-W133 VanDerWaalsContact C-N 3.34Å; D131-W133 PolarHBondContact O-N 3.49Å; W133-R143 HydrophobicContact CE3-CG 4.36Å; W133-R143 HydrophobicContact CH2-CG 4.48Å; W133-R143 HydrophobicContact CZ3-CB 4.02Å; W133-R143 HydrophobicContact CZ3-CG 4.14Å; W133-C146 HydrophobicContact CE3-CB 4.41Å; W133-M147 HydrophobicContact CH2-CE 4Å; W133-M147 HydrophobicContact CZ3-CE 4.12Å; W133-L171 HydrophobicContact CH2-CD2 3.43Å; W133-L171 VanDerWaalsContact CH2-CD2 3.43Å; W133-L171 HydrophobicContact CZ2-CD1 4.09Å; W133-L171 HydrophobicContact CZ2-CD2 3.35Å; W133-L171 HydrophobicContact CZ2-CG 4.38Å
134	D	82.4	Confident	81.4	Confident	46 Å²	46	60.9 Å²	60.9	25%	0.246	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	3.4	179.3	-72.8	-14.2	0	0	0	112.9	H84 K88 M132 K136	H84-D134 IonicContact CD2-OD2 3.96Å; K88-D134 VanDerWaalsContact CE-CG 3.45Å; K88-D134 WeakPolarHBondContact CE-OD1 3.45Å; K88-D134 VanDerWaalsContact CE-OD2 3.23Å; K88-D134 WeakPolarHBondContact CE-OD2 3.47Å; K88-D134 IonicContact NZ-OD1 3.33Å; K88-D134 PolarHBondContact NZ-OD1 3.4Å; K88-D134 IonicContact NZ-OD2 2.71Å; K88-D134 PolarHBondContact NZ-OD2 3.05Å; M132-D134 VanDerWaalsContact C-N 3.33Å; M132-D134 PolarHBondContact O-N 3.16Å; D134-K136 PolarHBondContact O-N 3.33Å
135	N	72.1	Confident	81	Confident	38 Å²	38	61.6 Å²	61.6	20%	0.203	28%	0.282	C	S	.	.			trans	-71.1	101.1	-176.3	-167.8	-29.2	0	0	0	111	D112 M132 R137 I142	D112-N135 PolarHBondContact OD2-ND2 2.77Å; M132-N135 VanDerWaalsContact O-CB 3.3Å; M132-N135 WeakPolarHBondContact O-CB 3.4Å; M132-N135 PolarHBondContact O-N 3.26Å; N135-R137 PolarHBondContact O-N 3.32Å; N135-R137 WeakPolarHBondContact OD1-CB 3.46Å; N135-R137 PolarHBondContact OD1-N 3.36Å; N135-R137 VanDerWaalsContact OD1-N 3.08Å; N135-I142 HydrophobicContact CB-CD1 3.83Å
136	K	62.6	Low	80.5	Confident	176 Å²	176	61.6 Å²	61.6	77%	0.765	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-12.8	-176.9	-65.8	179.8	-177.5	173	0	113.9	D134	D134-K136 PolarHBondContact O-N 3.33Å
137	R	60	Low	80.1	Confident	207 Å²	207	61.5 Å²	61.5	78%	0.781	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-30	-169.3	-59.2	-174.5	-161.3	-107.8	7.7	113	N135	N135-R137 PolarHBondContact O-N 3.32Å; N135-R137 WeakPolarHBondContact OD1-CB 3.46Å; N135-R137 PolarHBondContact OD1-N 3.36Å; N135-R137 VanDerWaalsContact OD1-N 3.08Å
138	E	57.7	Low	79.8	Confident	102 Å²	102	66.8 Å²	66.8	48%	0.477	31%	0.305	S	S	.	.	S	Bend	trans	-118	9.6	-176	-44.4	-179.2	157.5	0	0	114	I142	E138-I142 HydrophobicContact CB-CD1 3.51Å; E138-I142 HydrophobicContact CB-CG1 3.79Å; E138-I142 HydrophobicContact CG-CD1 3.88Å; E138-I142 HydrophobicContact CG-CG1 4.49Å; E138-I142 WeakPolarHBondContact OE2-CD1 3.49Å; E138-I142 WeakPolarHBondContact OE2-CG1 3.4Å
139	G	64.5	Low	79.5	Confident	39 Å²	39	67.4 Å²	67.4	40%	0.402	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	65	-141.1	163	0	0	0	0	0	115.9	W141	G139-W141 VanDerWaalsContact C-N 3.29Å; G139-W141 PolarHBondContact O-N 2.87Å
140	E	70.4	Confident	79.4	Confident	170 Å²	170	67.4 Å²	67.4	79%	0.794	31%	0.31	S	S	*	.	H	α-helix	trans	-66.5	-25.9	-173	-65.9	-171.5	154.9	0	0	113.8	R143 E144	E140-R143 WeakPolarHBondContact O-CB 3.34Å; E140-R143 PolarHBondContact O-N 3.13Å; E140-R143 VanDerWaalsContact O-N 3.14Å; E140-E144 PolarHBondContact O-N 3.45Å; E140-E144 VanDerWaalsContact O-N 3.08Å
141	W	74.3	Confident	79.4	Confident	126 Å²	126	68.3 Å²	68.3	48%	0.477	32%	0.315	S	S	.	.	H	α-helix	trans	-64.9	-42.5	-177.5	-179.5	65.1	0	0	0	112.5	G139 R143 E144 H145	G139-W141 VanDerWaalsContact C-N 3.29Å; G139-W141 PolarHBondContact O-N 2.87Å; W141-R143 PolarHBondContact O-N 3.05Å; W141-E144 PolarHBondContact O-N 2.97Å; W141-H145 VanDerWaalsContact O-CB 3.32Å; W141-H145 WeakPolarHBondContact O-CB 3.26Å; W141-H145 PolarHBondContact O-N 3.43Å
142	I	77.8	Confident	79.5	Confident	7 Å²	7	68.1 Å²	68.1	4%	0.036	31%	0.313	C	S	.	.	H	α-helix	trans	-59	-38.8	174	-73.7	177.1	0	0	0	110.7	M132 N135 E138 H145 C146	M132-I142 HydrophobicContact CB-CG2 3.75Å; M132-I142 VanDerWaalsContact O-CG2 3.24Å; M132-I142 WeakPolarHBondContact O-CG2 2.84Å; N135-I142 HydrophobicContact CB-CD1 3.83Å; E138-I142 HydrophobicContact CB-CD1 3.51Å; E138-I142 HydrophobicContact CB-CG1 3.79Å; E138-I142 HydrophobicContact CG-CD1 3.88Å; E138-I142 HydrophobicContact CG-CG1 4.49Å; E138-I142 WeakPolarHBondContact OE2-CD1 3.49Å; E138-I142 WeakPolarHBondContact OE2-CG1 3.4Å; I142-H145 PolarHBondContact O-N 3.49Å; I142-C146 VanDerWaalsContact O-CB 3.29Å; I142-C146 WeakPolarHBondContact O-CB 3.06Å; I142-C146 PolarHBondContact O-N 3.15Å; I142-C146 PolarHBondContact O-SG 3.35Å
143	R	78.8	Confident	80.1	Confident	98 Å²	98	67.5 Å²	67.5	37%	0.37	31%	0.31	S	S	.	.	H	α-helix	trans	-68.6	-42.4	-177.8	-62.3	-178.8	75.1	-171.7	1.7	111.1	W133 E140 W141 M147	W133-R143 HydrophobicContact CE3-CG 4.36Å; W133-R143 HydrophobicContact CH2-CG 4.48Å; W133-R143 HydrophobicContact CZ3-CB 4.02Å; W133-R143 HydrophobicContact CZ3-CG 4.14Å; E140-R143 WeakPolarHBondContact O-CB 3.34Å; E140-R143 PolarHBondContact O-N 3.13Å; E140-R143 VanDerWaalsContact O-N 3.14Å; W141-R143 PolarHBondContact O-N 3.05Å; R143-M147 WeakPolarHBondContact O-CG 3.38Å; R143-M147 PolarHBondContact O-N 3.32Å
144	E	81.8	Confident	80.6	Confident	118 Å²	118	66.5 Å²	66.5	55%	0.551	31%	0.307	S	S	*	.	H	α-helix	trans	-63.8	-45.4	173.7	-176.5	167.8	-147.9	0	0	111.3	E140 W141 C146 M147 Q148	E140-E144 PolarHBondContact O-N 3.45Å; E140-E144 VanDerWaalsContact O-N 3.08Å; W141-E144 PolarHBondContact O-N 2.97Å; E144-C146 PolarHBondContact O-N 3.16Å; E144-M147 PolarHBondContact O-N 3.26Å; E144-M147 VanDerWaalsContact O-N 3.16Å; E144-Q148 WeakPolarHBondContact O-CG 3.37Å; E144-Q148 PolarHBondContact O-N 2.76Å
145	H	83.9	Confident	81.4	Confident	67 Å²	67	64.4 Å²	64.4	31%	0.31	30%	0.295	S	S	.	.	H	α-helix	trans	-59	-48.2	176.4	-174.5	77.2	0	0	0	111.9	W141 I142 M147 Q148 V149	W141-H145 VanDerWaalsContact O-CB 3.32Å; W141-H145 WeakPolarHBondContact O-CB 3.26Å; W141-H145 PolarHBondContact O-N 3.43Å; I142-H145 PolarHBondContact O-N 3.49Å; H145-M147 PolarHBondContact O-N 3.35Å; H145-Q148 PolarHBondContact O-N 2.95Å; H145-V149 WeakPolarHBondContact CE1-CG1 3.45Å; H145-V149 WeakPolarHBondContact NE2-CG1 3.39Å; H145-V149 WeakPolarHBondContact O-CG2 3.39Å; H145-V149 PolarHBondContact O-N 2.93Å; H145-V149 VanDerWaalsContact O-N 3.14Å
146	C	83.1	Confident	82.7	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-52.6	-40.6	175.5	-74.9	0	0	0	0	111.6	V79 W133 I142 E144 Q148 Y153	V79-C146 HydrophobicContact CG1-CB 4.04Å; W133-C146 HydrophobicContact CE3-CB 4.41Å; I142-C146 VanDerWaalsContact O-CB 3.29Å; I142-C146 WeakPolarHBondContact O-CB 3.06Å; I142-C146 PolarHBondContact O-N 3.15Å; I142-C146 PolarHBondContact O-SG 3.35Å; E144-C146 PolarHBondContact O-N 3.16Å; C146-Q148 PolarHBondContact O-N 3.01Å; C146-Y153 WeakPolarHBondContact O-CE1 3.18Å; C146-Y153 VanDerWaalsContact O-CZ 3.31Å; C146-Y153 PolarHBondContact O-OH 3.49Å
147	M	86.6	Confident	84.4	Confident	25 Å²	25	54.2 Å²	54.2	12%	0.123	25%	0.249	C	C	.	.	H	α-helix	trans	-71	-14.3	178.8	-69.5	-171.6	-175	0	0	114.3	W133 R143 E144 H145 Y153 Q174 A178 R179	W133-M147 HydrophobicContact CH2-CE 4Å; W133-M147 HydrophobicContact CZ3-CE 4.12Å; R143-M147 WeakPolarHBondContact O-CG 3.38Å; R143-M147 PolarHBondContact O-N 3.32Å; E144-M147 PolarHBondContact O-N 3.26Å; E144-M147 VanDerWaalsContact O-N 3.16Å; H145-M147 PolarHBondContact O-N 3.35Å; M147-Y153 WeakPolarHBondContact CA-OH 3.33Å; M147-Y153 PolarHBondContact O-OH 2.78Å; M147-Q174 HydrophobicContact CE-CB 3.95Å; M147-Q174 HydrophobicContact SD-CB 4.47Å; M147-A178 HydrophobicContact CB-CB 4.41Å; M147-A178 HydrophobicContact SD-CB 4.46Å; M147-R179 WeakPolarHBondContact O-CD 3.36Å; M147-R179 WeakPolarHBondContact O-CG 3.39Å; M147-R179 PolarHBondContact O-NH1 3.48Å
148	Q	87.8	Confident	86.2	Confident	111 Å²	111	44.4 Å²	44.4	52%	0.519	21%	0.212	S	C	.	.	H	α-helix	trans	-106.9	-26.1	-174.6	-66.5	179.9	11.9	0	0	114.2	E144 H145 C146 R179	E144-Q148 WeakPolarHBondContact O-CG 3.37Å; E144-Q148 PolarHBondContact O-N 2.76Å; H145-Q148 PolarHBondContact O-N 2.95Å; C146-Q148 PolarHBondContact O-N 3.01Å; Q148-R179 PolarHBondContact O-NH1 2.75Å
149	V	88.9	Confident	88.2	Confident	31 Å²	31	39.5 Å²	39.5	19%	0.188	19%	0.19	C	C	.	.	H	α-helix	trans	-93.1	-18	-169.5	-63.2	0	0	0	0	116.3	R77 V79 L130 H145	R77-V149 PolarHBondContact NE-O 2.78Å; V79-V149 HydrophobicContact CG2-CG2 4.25Å; L130-V149 HydrophobicContact CD1-CG2 3.68Å; H145-V149 WeakPolarHBondContact CE1-CG1 3.45Å; H145-V149 WeakPolarHBondContact NE2-CG1 3.39Å; H145-V149 WeakPolarHBondContact O-CG2 3.39Å; H145-V149 PolarHBondContact O-N 2.93Å; H145-V149 VanDerWaalsContact O-N 3.14Å
150	G	92.5	Very high	89.8	Confident	1 Å²	1	39 Å²	39	1%	0.01	18%	0.179	C	C	.	.			trans	-72.3	134.7	-174.7	0	0	0	0	0	113.1	Y153 R179	G150-Y153 PolarHBondContact N-OH 2.99Å; G150-Y153 VanDerWaalsContact N-OH 3.07Å; G150-R179 PolarHBondContact O-NH2 2.88Å
151	D	94.6	Very high	91.2	Very high	35 Å²	35	33.4 Å²	33.4	19%	0.187	15%	0.154	C	C	.	.	S	Bend	trans	-77.4	-20.4	161.4	-60	-31.1	0	0	0	110.7	R77 P185 R243	R77-D151 HydrophobicContact CB-CB 4.5Å; R77-D151 IonicContact CZ-OD1 2.75Å; R77-D151 PolarHBondContact N-OD2 3.04Å; R77-D151 IonicContact NE-OD1 3.77Å; R77-D151 IonicContact NE-OD2 2.78Å; R77-D151 IonicContact NH2-OD1 2.82Å; R77-D151 PolarHBondContact NH2-OD1 3.25Å; R77-D151 IonicContact NH2-OD2 3.97Å; R77-D151 WeakPolarHBondContact O-CB 3.44Å; R77-D151 PolarHBondContact O-N 3.43Å; D151-P185 VanDerWaalsContact O-CD 3.29Å; D151-P185 WeakPolarHBondContact O-CD 3.31Å; D151-R243 IonicContact OD2-NH2 3.16Å; D151-R243 PolarHBondContact OD2-NH2 3.48Å
152	A	97.1	Very high	92.3	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	154.7	179.7	0	0	0	0	0	111.2	R77 V78 V79 P185 I235 V239	R77-A152 PolarHBondContact O-N 3Å; R77-A152 VanDerWaalsContact O-N 3.15Å; V78-A152 WeakPolarHBondContact CA-O 3.33Å; V78-A152 HydrophobicContact CG2-CB 4.31Å; V79-A152 PolarHBondContact N-O 3.23Å; A152-P185 WeakPolarHBondContact CA-O 3.46Å; A152-P185 HydrophobicContact CB-CB 4.03Å; A152-P185 HydrophobicContact CB-CG 4.4Å; A152-I235 HydrophobicContact CB-CD1 3.73Å; A152-I235 HydrophobicContact CB-CG1 3.48Å; A152-I235 VanDerWaalsContact CB-CG1 3.48Å; A152-V239 HydrophobicContact CB-CG2 3.7Å
153	Y	98	Very high	93.3	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	136.1	-178.8	-70.6	-96.9	0	0	0	112.4	V79 I81 C146 M147 G150 L175 R179 I184 P185 I186 I187	V79-Y153 HydrophobicContact CB-CD1 3.75Å; V79-Y153 HydrophobicContact CB-CE1 3.65Å; V79-Y153 HydrophobicContact CG1-CD1 4.2Å; V79-Y153 HydrophobicContact CG1-CE1 3.96Å; V79-Y153 HydrophobicContact CG2-CD1 4.43Å; V79-Y153 HydrophobicContact CG2-CE1 3.93Å; I81-Y153 HydrophobicContact CD1-CD1 4.23Å; C146-Y153 WeakPolarHBondContact O-CE1 3.18Å; C146-Y153 VanDerWaalsContact O-CZ 3.31Å; C146-Y153 PolarHBondContact O-OH 3.49Å; M147-Y153 WeakPolarHBondContact CA-OH 3.33Å; M147-Y153 PolarHBondContact O-OH 2.78Å; G150-Y153 PolarHBondContact N-OH 2.99Å; G150-Y153 VanDerWaalsContact N-OH 3.07Å; Y153-L175 HydrophobicContact CD1-CD1 4.12Å; Y153-L175 HydrophobicContact CD1-CD2 3.88Å; Y153-L175 HydrophobicContact CD2-CD1 4.07Å; Y153-L175 HydrophobicContact CD2-CD2 3.7Å; Y153-L175 HydrophobicContact CD2-CG 4.48Å; Y153-L175 HydrophobicContact CE1-CD1 3.87Å; Y153-L175 HydrophobicContact CE1-CD2 4.47Å; Y153-L175 HydrophobicContact CE2-CD1 3.83Å; Y153-L175 HydrophobicContact CE2-CD2 4.33Å; Y153-L175 HydrophobicContact CG-CD1 4.23Å; Y153-L175 HydrophobicContact CG-CD2 3.47Å; Y153-L175 VanDerWaalsContact CG-CD2 3.47Å; Y153-R179 PolarHBondContact OH-NH1 2.82Å; Y153-R179 VanDerWaalsContact OH-NH1 3.17Å; Y153-I184 HydrophobicContact CD2-CG2 3.68Å; Y153-I184 HydrophobicContact CE2-CD1 4.4Å; Y153-I184 HydrophobicContact CE2-CG2 3.97Å; Y153-P185 PolarHBondContact N-O 3.24Å; Y153-I186 WeakPolarHBondContact O-CA 3.19Å; Y153-I187 PolarHBondContact O-N 2.75Å
154	L	98.6	Very high	94.3	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	113.6	168.1	-56.9	-177.2	0	0	0	108.1	V78 V79 L80 I81 V156 I187 V189 L231 F232 I235	V78-L154 HydrophobicContact CG1-CD1 3.81Å; V78-L154 HydrophobicContact CG1-CG 3.74Å; V79-L154 PolarHBondContact O-N 3.26Å; L80-L154 HydrophobicContact CD2-CB 3.71Å; L80-L154 HydrophobicContact CD2-CD1 3.61Å; L80-L154 HydrophobicContact CD2-CG 4.13Å; I81-L154 PolarHBondContact N-O 3.46Å; L154-V156 HydrophobicContact CB-CG2 4.47Å; L154-I187 WeakPolarHBondContact CA-O 3.48Å; L154-I187 HydrophobicContact CD2-CB 3.75Å; L154-I187 HydrophobicContact CD2-CD1 4.18Å; L154-I187 HydrophobicContact CD2-CG1 4.14Å; L154-V189 HydrophobicContact CB-CG2 4.29Å; L154-V189 HydrophobicContact CD2-CG2 4.41Å; L154-L231 HydrophobicContact CD1-CD1 4.15Å; L154-L231 HydrophobicContact CD1-CD2 4.08Å; L154-L231 HydrophobicContact CD1-CG 4.14Å; L154-L231 HydrophobicContact CD2-CD1 3.75Å; L154-F232 HydrophobicContact CD1-CE1 4.05Å; L154-F232 HydrophobicContact CD1-CZ 4.49Å; L154-I235 HydrophobicContact CD2-CB 4.42Å; L154-I235 HydrophobicContact CD2-CD1 3.87Å; L154-I235 HydrophobicContact CD2-CG1 4.23Å
155	I	98.3	Very high	95.1	Very high	1 Å²	1	24.2 Å²	24.2	1%	0.005	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	105.8	177.2	-49.1	-173.3	0	0	0	107.6	I81 A168 L171 R172 I186 I187 L188 V189	I81-I155 HydrophobicContact CD1-CD1 4.25Å; I81-I155 HydrophobicContact CD1-CG1 3.93Å; I81-I155 HydrophobicContact CG1-CB 4.32Å; I81-I155 HydrophobicContact CG1-CG1 3.88Å; I81-I155 HydrophobicContact CG1-CG2 4.31Å; I81-I155 CarbonylContact O-C 3.55Å; I81-I155 WeakPolarHBondContact O-CA 3.4Å; I155-A168 HydrophobicContact CG2-CB 3.59Å; I155-L171 HydrophobicContact CG2-CB 4.32Å; I155-R172 HydrophobicContact CD1-CB 3.73Å; I155-R172 HydrophobicContact CD1-CG 4.49Å; I155-I186 HydrophobicContact CD1-CG2 3.69Å; I155-I186 HydrophobicContact CG1-CG2 3.87Å; I155-I187 PolarHBondContact N-O 3.08Å; I155-L188 HydrophobicContact CB-CD1 4.3Å; I155-L188 HydrophobicContact CG2-CD1 4.35Å; I155-V189 PolarHBondContact O-N 3.5Å
156	V	98.8	Very high	95.8	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	132.8	-170.8	-167.8	0	0	0	0	110.4	L80 I81 G82 V86 K88 L91 L154 V189 N191	L80-V156 HydrophobicContact CD2-CG2 4.48Å; I81-V156 PolarHBondContact O-N 3.02Å; G82-V156 VanDerWaalsContact CA-O 3.31Å; G82-V156 WeakPolarHBondContact CA-O 3.29Å; V86-V156 HydrophobicContact CB-CG1 4.37Å; V86-V156 HydrophobicContact CG2-CB 3.95Å; V86-V156 HydrophobicContact CG2-CG1 3.82Å; K88-V156 HydrophobicContact CG-CB 4.17Å; K88-V156 HydrophobicContact CG-CG2 4.28Å; L91-V156 HydrophobicContact CD1-CG1 4.06Å; L91-V156 HydrophobicContact CD1-CG2 4.34Å; L154-V156 HydrophobicContact CB-CG2 4.47Å; V156-V189 WeakPolarHBondContact CA-O 3.43Å; V156-V189 HydrophobicContact CG1-CB 4.43Å; V156-V189 HydrophobicContact CG1-CG1 4.45Å; V156-V189 HydrophobicContact CG2-CB 4.24Å; V156-N191 HydrophobicContact CG1-CB 3.87Å
157	Y	98.9	Very high	96.5	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	165	167.5	74.3	-85.1	0	0	0	109.9	I159 S164 F165 L188 V189 G190 N191 V201 F217	Y157-I159 HydrophobicContact CE2-CG2 4.21Å; Y157-S164 WeakPolarHBondContact CB-O 3.13Å; Y157-F165 AromaticContact CD1-CD2 3.94Å; Y157-F165 HydrophobicContact CD1-CD2 3.94Å; Y157-F165 HydrophobicContact CD2-CB 3.7Å; Y157-F165 AromaticContact CD2-CD2 3.8Å; Y157-F165 HydrophobicContact CD2-CD2 3.8Å; Y157-F165 HydrophobicContact CD2-CG 4.2Å; Y157-F165 AromaticContact CE1-CD2 3.77Å; Y157-F165 HydrophobicContact CE1-CD2 3.77Å; Y157-F165 HydrophobicContact CE1-CE2 4.16Å; Y157-F165 HydrophobicContact CE2-CB 4.16Å; Y157-F165 AromaticContact CE2-CD2 3.63Å; Y157-F165 HydrophobicContact CE2-CD2 3.63Å; Y157-F165 HydrophobicContact CE2-CE2 4.43Å; Y157-F165 HydrophobicContact CE2-CG 4.24Å; Y157-F165 HydrophobicContact CG-CB 4.11Å; Y157-F165 AromaticContact CG-CD2 3.95Å; Y157-F165 HydrophobicContact CG-CD2 3.95Å; Y157-F165 AromaticContact CZ-CD2 3.61Å; Y157-L188 HydrophobicContact CD1-CD1 3.89Å; Y157-L188 HydrophobicContact CD1-CG 4.2Å; Y157-L188 HydrophobicContact CE1-CD1 4.12Å; Y157-L188 HydrophobicContact CE1-CD2 4.29Å; Y157-L188 HydrophobicContact CE1-CG 3.91Å; Y157-V189 WeakPolarHBondContact CD1-O 3.29Å; Y157-V189 PolarHBondContact N-O 2.97Å; Y157-G190 VanDerWaalsContact CE1-CA 3.43Å; Y157-G190 VanDerWaalsContact CZ-CA 3.46Å; Y157-N191 WeakPolarHBondContact O-CB 3.03Å; Y157-N191 PolarHBondContact O-N 2.9Å; Y157-V201 HydrophobicContact CE2-CB 4.02Å; Y157-V201 HydrophobicContact CE2-CG1 3.88Å; Y157-V201 HydrophobicContact CE2-CG2 4.28Å; Y157-F217 HydrophobicContact CE1-CE2 4.18Å; Y157-F217 WeakPolarHBondContact OH-CE2 3.45Å
158	S	98.8	Very high	97	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.007	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	131.4	173	-176.3	0	0	0	0	109.7	T160 D161 S164 K192	S158-T160 PolarHBondContact O-N 2.95Å; S158-T160 PolarHBondContact OG-N 3.2Å; S158-T160 PolarHBondContact OG-OG1 3.22Å; S158-D161 PolarHBondContact O-N 3.35Å; S158-D161 VanDerWaalsContact O-N 3.07Å; S158-S164 PolarHBondContact N-OG 3.25Å; S158-S164 PolarHBondContact O-OG 3.44Å; S158-K192 VanDerWaalsContact OG-CD 3.29Å; S158-K192 WeakPolarHBondContact OG-CD 3.39Å
159	I	98.8	Very high	97.4	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-14.8	175.8	64.8	148	0	0	0	113.1	Y157 N191 K192 R199 E200 V201	Y157-I159 HydrophobicContact CE2-CG2 4.21Å; I159-N191 PolarHBondContact N-O 3.33Å; I159-K192 WeakPolarHBondContact CD1-O 3.43Å; I159-K192 VanDerWaalsContact CG1-O 3.31Å; I159-K192 WeakPolarHBondContact CG1-O 3.47Å; I159-R199 HydrophobicContact CD1-CB 4.23Å; I159-R199 HydrophobicContact CD1-CG 4.28Å; I159-E200 PolarHBondContact O-N 3.01Å; I159-V201 PolarHBondContact O-N 2.85Å; I159-V201 VanDerWaalsContact O-N 3.08Å
160	T	98.8	Very high	97.8	Very high	28 Å²	28	25.3 Å²	25.3	17%	0.172	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.2	8.3	179	73.4	0	0	0	0	113.9	S158 L195 C198	S158-T160 PolarHBondContact O-N 2.95Å; S158-T160 PolarHBondContact OG-N 3.2Å; S158-T160 PolarHBondContact OG-OG1 3.22Å; T160-L195 HydrophobicContact CG2-CB 3.5Å; T160-L195 VanDerWaalsContact CG2-CB 3.5Å; T160-L195 HydrophobicContact CG2-CD1 3.81Å; T160-L195 HydrophobicContact CG2-CG 4.29Å; T160-C198 WeakPolarHBondContact CA-O 3.39Å; T160-C198 VanDerWaalsContact CB-O 3.26Å; T160-C198 WeakPolarHBondContact CB-O 3.36Å; T160-C198 HydrophobicContact CG2-CB 3.82Å; T160-C198 WeakPolarHBondContact CG2-O 3.19Å
161	D	98.7	Very high	98	Very high	53 Å²	53	25.2 Å²	25.2	28%	0.283	13%	0.131	S	C	.	.			trans	-143.7	102	-177.8	175	-0.1	0	0	0	109.2	S158 A163 S164 F165 E200	S158-D161 PolarHBondContact O-N 3.35Å; S158-D161 VanDerWaalsContact O-N 3.07Å; D161-A163 VanDerWaalsContact C-N 3.29Å; D161-A163 PolarHBondContact O-N 3.48Å; D161-A163 WeakPolarHBondContact OD1-CA 3.25Å; D161-A163 WeakPolarHBondContact OD1-CB 3.34Å; D161-A163 PolarHBondContact OD1-N 2.8Å; D161-S164 PolarHBondContact O-N 2.83Å; D161-S164 PolarHBondContact O-OG 3.01Å; D161-S164 PolarHBondContact OD1-N 3.1Å; D161-S164 VanDerWaalsContact OD1-N 3.14Å; D161-S164 WeakPolarHBondContact OD2-CB 3.22Å; D161-F165 PolarHBondContact O-N 3.06Å; D161-E200 WeakPolarHBondContact CA-OE2 3.49Å
162	R	98.6	Very high	98	Very high	83 Å²	83	24.5 Å²	24.5	31%	0.313	13%	0.126	S	C	.	.	H	α-helix	trans	-61.5	-35.9	179.2	-177.8	63.2	-174	-167.5	-5.1	112.6	S164 F165 E166 E200 E205	R162-S164 VanDerWaalsContact C-N 3.31Å; R162-S164 PolarHBondContact O-N 2.92Å; R162-F165 WeakPolarHBondContact O-CB 3.5Å; R162-F165 PolarHBondContact O-N 2.75Å; R162-F165 VanDerWaalsContact O-N 3.16Å; R162-E166 IonicContact NE-OE1 2.73Å; R162-E166 PolarHBondContact O-N 2.96Å; R162-E166 VanDerWaalsContact O-N 3.13Å; R162-E200 HydrophobicContact CB-CB 4.29Å; R162-E200 WeakPolarHBondContact CB-OE2 3.42Å; R162-E200 PolarHBondContact N-OE2 3.01Å; R162-E205 IonicContact CZ-OE1 2.72Å; R162-E205 IonicContact NH1-OE1 3.5Å; R162-E205 PolarHBondContact NH1-OE1 3.42Å; R162-E205 IonicContact NH1-OE2 3.75Å; R162-E205 IonicContact NH2-OE1 2.79Å
163	A	98.6	Very high	98	Very high	61 Å²	61	27.6 Å²	27.6	50%	0.504	14%	0.142	S	C	.	.	H	α-helix	trans	-65	-38.6	179.3	0	0	0	0	0	110.8	D161 F165 E166 K167	D161-A163 VanDerWaalsContact C-N 3.29Å; D161-A163 PolarHBondContact O-N 3.48Å; D161-A163 WeakPolarHBondContact OD1-CA 3.25Å; D161-A163 WeakPolarHBondContact OD1-CB 3.34Å; D161-A163 PolarHBondContact OD1-N 2.8Å; A163-F165 VanDerWaalsContact C-N 3.27Å; A163-F165 PolarHBondContact O-N 3Å; A163-E166 PolarHBondContact O-N 3.21Å; A163-K167 WeakPolarHBondContact O-CB 3.3Å; A163-K167 PolarHBondContact O-N 3.24Å
164	S	98.7	Very high	97.8	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-62.1	-32.8	174.9	78.1	0	0	0	0	113.4	Y157 S158 D161 R162 K167 A168	Y157-S164 WeakPolarHBondContact CB-O 3.13Å; S158-S164 PolarHBondContact N-OG 3.25Å; S158-S164 PolarHBondContact O-OG 3.44Å; D161-S164 PolarHBondContact O-N 2.83Å; D161-S164 PolarHBondContact O-OG 3.01Å; D161-S164 PolarHBondContact OD1-N 3.1Å; D161-S164 VanDerWaalsContact OD1-N 3.14Å; D161-S164 WeakPolarHBondContact OD2-CB 3.22Å; R162-S164 VanDerWaalsContact C-N 3.31Å; R162-S164 PolarHBondContact O-N 2.92Å; S164-K167 PolarHBondContact O-N 2.97Å; S164-A168 PolarHBondContact O-N 2.84Å
165	F	98.8	Very high	97.5	Very high	12 Å²	12	30.4 Å²	30.4	5%	0.053	16%	0.155	C	C	.	.	H	α-helix	trans	-72.1	-40.4	176.9	175.3	-109.9	0	0	0	112.5	Y157 D161 R162 A163 K167 A168 S169 L188 V201 C209	Y157-F165 AromaticContact CD1-CD2 3.94Å; Y157-F165 HydrophobicContact CD1-CD2 3.94Å; Y157-F165 HydrophobicContact CD2-CB 3.7Å; Y157-F165 AromaticContact CD2-CD2 3.8Å; Y157-F165 HydrophobicContact CD2-CD2 3.8Å; Y157-F165 HydrophobicContact CD2-CG 4.2Å; Y157-F165 AromaticContact CE1-CD2 3.77Å; Y157-F165 HydrophobicContact CE1-CD2 3.77Å; Y157-F165 HydrophobicContact CE1-CE2 4.16Å; Y157-F165 HydrophobicContact CE2-CB 4.16Å; Y157-F165 AromaticContact CE2-CD2 3.63Å; Y157-F165 HydrophobicContact CE2-CD2 3.63Å; Y157-F165 HydrophobicContact CE2-CE2 4.43Å; Y157-F165 HydrophobicContact CE2-CG 4.24Å; Y157-F165 HydrophobicContact CG-CB 4.11Å; Y157-F165 AromaticContact CG-CD2 3.95Å; Y157-F165 HydrophobicContact CG-CD2 3.95Å; Y157-F165 AromaticContact CZ-CD2 3.61Å; D161-F165 PolarHBondContact O-N 3.06Å; R162-F165 WeakPolarHBondContact O-CB 3.5Å; R162-F165 PolarHBondContact O-N 2.75Å; R162-F165 VanDerWaalsContact O-N 3.16Å; A163-F165 VanDerWaalsContact C-N 3.27Å; A163-F165 PolarHBondContact O-N 3Å; F165-K167 VanDerWaalsContact C-N 3.31Å; F165-A168 WeakPolarHBondContact O-CB 3.26Å; F165-A168 PolarHBondContact O-N 3.14Å; F165-S169 PolarHBondContact O-N 3.03Å; F165-S169 PolarHBondContact O-OG 3.33Å; F165-L188 HydrophobicContact CE2-CD2 4.24Å; F165-V201 HydrophobicContact CB-CG2 3.78Å; F165-V201 HydrophobicContact CD1-CG1 4.13Å; F165-V201 HydrophobicContact CD1-CG2 4.27Å; F165-V201 HydrophobicContact CD2-CG1 3.99Å; F165-V201 HydrophobicContact CE1-CG1 4.25Å; F165-V201 HydrophobicContact CE2-CG1 4.11Å; F165-V201 HydrophobicContact CG-CG1 3.97Å; F165-V201 HydrophobicContact CG-CG2 4.02Å; F165-V201 HydrophobicContact CZ-CG1 4.22Å; F165-C209 HydrophobicContact CE2-CB 4Å; F165-C209 HydrophobicContact CZ-CB 3.57Å
166	E	98.3	Very high	97.3	Very high	112 Å²	112	37.4 Å²	37.4	52%	0.523	18%	0.181	S	C	.	.	H	α-helix	trans	-63.7	-41	172.4	-68.6	176.1	-173.8	0	0	110.6	R162 A163 A168 S169 E170	R162-E166 IonicContact NE-OE1 2.73Å; R162-E166 PolarHBondContact O-N 2.96Å; R162-E166 VanDerWaalsContact O-N 3.13Å; A163-E166 PolarHBondContact O-N 3.21Å; E166-A168 PolarHBondContact O-N 3.02Å; E166-S169 WeakPolarHBondContact O-CB 3.42Å; E166-S169 PolarHBondContact O-N 3.49Å; E166-S169 VanDerWaalsContact O-N 3.15Å; E166-E170 PolarHBondContact O-N 2.71Å; E166-E170 VanDerWaalsContact O-N 3.08Å
167	K	98	Very high	96.9	Very high	44 Å²	44	45.8 Å²	45.8	19%	0.191	21%	0.213	C	C	.	.	H	α-helix	trans	-62.1	-41.6	174.5	-168.8	56.1	159.7	-178.9	0	112.6	E83 A163 S164 F165 S169 E170 L171	E83-K167 HydrophobicContact CB-CB 4.34Å; E83-K167 HydrophobicContact CB-CG 4.3Å; E83-K167 WeakPolarHBondContact OE2-CG 3.26Å; A163-K167 WeakPolarHBondContact O-CB 3.3Å; A163-K167 PolarHBondContact O-N 3.24Å; S164-K167 PolarHBondContact O-N 2.97Å; F165-K167 VanDerWaalsContact C-N 3.31Å; K167-S169 PolarHBondContact O-N 3.47Å; K167-E170 HydrophobicContact CD-CB 4.4Å; K167-E170 VanDerWaalsContact CD-OE2 3.26Å; K167-E170 WeakPolarHBondContact CD-OE2 3.5Å; K167-E170 IonicContact NZ-OE1 3.77Å; K167-E170 PolarHBondContact NZ-OE1 3.14Å; K167-E170 IonicContact NZ-OE2 2.81Å; K167-E170 PolarHBondContact NZ-OE2 2.94Å; K167-E170 WeakPolarHBondContact O-CB 3.46Å; K167-E170 PolarHBondContact O-N 3.5Å; K167-E170 VanDerWaalsContact O-N 3.14Å; K167-L171 HydrophobicContact CG-CD1 4.35Å; K167-L171 HydrophobicContact CG-CG 4.43Å; K167-L171 VanDerWaalsContact O-CG 3.31Å; K167-L171 WeakPolarHBondContact O-CG 3.46Å; K167-L171 PolarHBondContact O-N 3.33Å
168	A	98.1	Very high	96.5	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-57.9	-38.5	175	0	0	0	0	0	112.2	I155 S164 F165 E166 L171 R172 L188	I155-A168 HydrophobicContact CG2-CB 3.59Å; S164-A168 PolarHBondContact O-N 2.84Å; F165-A168 WeakPolarHBondContact O-CB 3.26Å; F165-A168 PolarHBondContact O-N 3.14Å; E166-A168 PolarHBondContact O-N 3.02Å; A168-L171 PolarHBondContact O-N 3.33Å; A168-R172 WeakPolarHBondContact O-CB 3.41Å; A168-R172 PolarHBondContact O-N 3.35Å; A168-L188 HydrophobicContact CB-CD1 3.85Å
169	S	96.8	Very high	96.1	Very high	22 Å²	22	49.9 Å²	49.9	15%	0.154	24%	0.24	C	C	.	.	H	α-helix	trans	-66	-41.7	175.5	-56.5	0	0	0	0	112.1	F165 E166 K167 R172 I173 C209	F165-S169 PolarHBondContact O-N 3.03Å; F165-S169 PolarHBondContact O-OG 3.33Å; E166-S169 WeakPolarHBondContact O-CB 3.42Å; E166-S169 PolarHBondContact O-N 3.49Å; E166-S169 VanDerWaalsContact O-N 3.15Å; K167-S169 PolarHBondContact O-N 3.47Å; S169-R172 WeakPolarHBondContact O-CB 3.37Å; S169-R172 PolarHBondContact O-N 3.15Å; S169-I173 WeakPolarHBondContact O-CG1 3.27Å; S169-I173 PolarHBondContact O-N 2.83Å; S169-C209 PolarHBondContact OG-SG 2.88Å
170	E	96.6	Very high	95.4	Very high	78 Å²	78	57.1 Å²	57.1	36%	0.364	27%	0.274	S	S	.	.	H	α-helix	trans	-61.2	-46.5	173.8	-172	-161.5	137.3	0	0	111.7	E166 K167 R172 I173 Q174	E166-E170 PolarHBondContact O-N 2.71Å; E166-E170 VanDerWaalsContact O-N 3.08Å; K167-E170 HydrophobicContact CD-CB 4.4Å; K167-E170 VanDerWaalsContact CD-OE2 3.26Å; K167-E170 WeakPolarHBondContact CD-OE2 3.5Å; K167-E170 IonicContact NZ-OE1 3.77Å; K167-E170 PolarHBondContact NZ-OE1 3.14Å; K167-E170 IonicContact NZ-OE2 2.81Å; K167-E170 PolarHBondContact NZ-OE2 2.94Å; K167-E170 WeakPolarHBondContact O-CB 3.46Å; K167-E170 PolarHBondContact O-N 3.5Å; K167-E170 VanDerWaalsContact O-N 3.14Å; E170-R172 VanDerWaalsContact C-N 3.28Å; E170-R172 PolarHBondContact O-N 3.33Å; E170-I173 WeakPolarHBondContact O-CB 3.38Å; E170-I173 PolarHBondContact O-N 2.79Å; E170-I173 VanDerWaalsContact O-N 3.09Å; E170-Q174 WeakPolarHBondContact O-CG 3.49Å; E170-Q174 PolarHBondContact O-N 2.93Å; E170-Q174 PolarHBondContact OE1-NE2 3.44Å
171	L	96.1	Very high	94.7	Very high	0 Å²	0	65.8 Å²	65.8	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-61	-38.4	178.8	-69.3	175.4	0	0	0	111.9	I81 W133 I155 K167 A168 I173 Q174 L175	I81-L171 HydrophobicContact CB-CD1 4.49Å; I81-L171 HydrophobicContact CD1-CB 4.19Å; I81-L171 HydrophobicContact CG1-CD1 4.47Å; W133-L171 HydrophobicContact CH2-CD2 3.43Å; W133-L171 VanDerWaalsContact CH2-CD2 3.43Å; W133-L171 HydrophobicContact CZ2-CD1 4.09Å; W133-L171 HydrophobicContact CZ2-CD2 3.35Å; W133-L171 HydrophobicContact CZ2-CG 4.38Å; I155-L171 HydrophobicContact CG2-CB 4.32Å; K167-L171 HydrophobicContact CG-CD1 4.35Å; K167-L171 HydrophobicContact CG-CG 4.43Å; K167-L171 VanDerWaalsContact O-CG 3.31Å; K167-L171 WeakPolarHBondContact O-CG 3.46Å; K167-L171 PolarHBondContact O-N 3.33Å; A168-L171 PolarHBondContact O-N 3.33Å; L171-I173 VanDerWaalsContact C-N 3.32Å; L171-I173 PolarHBondContact O-N 2.81Å; L171-Q174 PolarHBondContact O-N 3.14Å; L171-L175 WeakPolarHBondContact O-CB 3.06Å; L171-L175 PolarHBondContact O-N 2.96Å
172	R	95.8	Very high	94.1	Very high	20 Å²	20	68.2 Å²	68.2	8%	0.075	32%	0.319	C	S	.	.	H	α-helix	trans	-60.8	-41.3	174.4	172.2	54.9	-174.9	123.5	-10.7	112.3	I155 A168 S169 E170 R176 F213 C215	I155-R172 HydrophobicContact CD1-CB 3.73Å; I155-R172 HydrophobicContact CD1-CG 4.49Å; A168-R172 WeakPolarHBondContact O-CB 3.41Å; A168-R172 PolarHBondContact O-N 3.35Å; S169-R172 WeakPolarHBondContact O-CB 3.37Å; S169-R172 PolarHBondContact O-N 3.15Å; E170-R172 VanDerWaalsContact C-N 3.28Å; E170-R172 PolarHBondContact O-N 3.33Å; R172-R176 WeakPolarHBondContact O-CB 3.36Å; R172-R176 PolarHBondContact O-N 2.78Å; R172-F213 HydrophobicContact CG-CB 3.66Å; R172-F213 HydrophobicContact CG-CD1 3.95Å; R172-F213 HydrophobicContact CG-CG 3.81Å; R172-F213 PolarHBondContact NE-O 3.32Å; R172-F213 PolarHBondContact NH2-O 3.09Å; R172-C215 VanDerWaalsContact CD-SG 3.51Å; R172-C215 PolarHBondContact NE-SG 3.44Å
173	I	95.3	Very high	93.6	Very high	65 Å²	65	69.7 Å²	69.7	33%	0.333	33%	0.333	S	S	.	.	H	α-helix	trans	-66.3	-44.4	176.3	-64.9	165.5	0	0	0	110.1	S169 E170 L171 R176 R177 F213	S169-I173 WeakPolarHBondContact O-CG1 3.27Å; S169-I173 PolarHBondContact O-N 2.83Å; E170-I173 WeakPolarHBondContact O-CB 3.38Å; E170-I173 PolarHBondContact O-N 2.79Å; E170-I173 VanDerWaalsContact O-N 3.09Å; L171-I173 VanDerWaalsContact C-N 3.32Å; L171-I173 PolarHBondContact O-N 2.81Å; I173-R176 PolarHBondContact O-N 2.97Å; I173-R177 WeakPolarHBondContact O-CG 3.42Å; I173-R177 PolarHBondContact O-N 3.41Å; I173-F213 HydrophobicContact CD1-CE1 4.04Å; I173-F213 HydrophobicContact CD1-CZ 4.36Å; I173-F213 HydrophobicContact CG1-CE1 3.83Å
174	Q	93.9	Very high	93.3	Very high	56 Å²	56	67.6 Å²	67.6	26%	0.262	31%	0.313	S	S	.	.	H	α-helix	trans	-60.4	-47.6	177.3	-71.5	174.2	-0.6	0	0	111.7	M147 E170 L171 R176 R177 A178	M147-Q174 HydrophobicContact CE-CB 3.95Å; M147-Q174 HydrophobicContact SD-CB 4.47Å; E170-Q174 WeakPolarHBondContact O-CG 3.49Å; E170-Q174 PolarHBondContact O-N 2.93Å; E170-Q174 PolarHBondContact OE1-NE2 3.44Å; L171-Q174 PolarHBondContact O-N 3.14Å; Q174-R176 VanDerWaalsContact C-N 3.33Å; Q174-R176 PolarHBondContact O-N 3.2Å; Q174-R177 WeakPolarHBondContact O-CB 3.18Å; Q174-R177 PolarHBondContact O-N 3.22Å; Q174-R177 VanDerWaalsContact O-N 3.08Å; Q174-A178 PolarHBondContact O-N 3.19Å
175	L	94	Very high	93.2	Very high	3 Å²	3	67.8 Å²	67.8	2%	0.016	32%	0.315	C	S	.	.	H	α-helix	trans	-60.3	-42.4	177.2	-177.9	62.2	0	0	0	111.7	Y153 L171 R177 A178 R179 I186	Y153-L175 HydrophobicContact CD1-CD1 4.12Å; Y153-L175 HydrophobicContact CD1-CD2 3.88Å; Y153-L175 HydrophobicContact CD2-CD1 4.07Å; Y153-L175 HydrophobicContact CD2-CD2 3.7Å; Y153-L175 HydrophobicContact CD2-CG 4.48Å; Y153-L175 HydrophobicContact CE1-CD1 3.87Å; Y153-L175 HydrophobicContact CE1-CD2 4.47Å; Y153-L175 HydrophobicContact CE2-CD1 3.83Å; Y153-L175 HydrophobicContact CE2-CD2 4.33Å; Y153-L175 HydrophobicContact CG-CD1 4.23Å; Y153-L175 HydrophobicContact CG-CD2 3.47Å; Y153-L175 VanDerWaalsContact CG-CD2 3.47Å; L171-L175 WeakPolarHBondContact O-CB 3.06Å; L171-L175 PolarHBondContact O-N 2.96Å; L175-R177 VanDerWaalsContact C-N 3.28Å; L175-R177 PolarHBondContact O-N 2.87Å; L175-A178 PolarHBondContact O-N 3.18Å; L175-R179 HydrophobicContact CD1-CG 4.19Å; L175-R179 PolarHBondContact O-N 3.1Å; L175-I186 HydrophobicContact CD2-CD1 3.69Å; L175-I186 HydrophobicContact CD2-CG1 3.96Å; L175-I186 HydrophobicContact CG-CD1 4.46Å
176	R	92.5	Very high	93.2	Very high	148 Å²	148	67.8 Å²	67.8	56%	0.558	32%	0.315	S	S	*	.	H	α-helix	trans	-59.3	-41	174.9	-164.9	172.5	175	119	0.7	111.8	R172 I173 Q174 Q180	R172-R176 WeakPolarHBondContact O-CB 3.36Å; R172-R176 PolarHBondContact O-N 2.78Å; I173-R176 PolarHBondContact O-N 2.97Å; Q174-R176 VanDerWaalsContact C-N 3.33Å; Q174-R176 PolarHBondContact O-N 3.2Å; R176-Q180 WeakPolarHBondContact O-CA 3.5Å; R176-Q180 WeakPolarHBondContact O-CG 3.47Å; R176-Q180 PolarHBondContact O-N 3.03Å
177	R	91.9	Very high	93.2	Very high	176 Å²	176	62.8 Å²	62.8	66%	0.664	29%	0.292	S	S	*	.	H	α-helix	trans	-68.8	-38.5	179.5	-72.2	174.8	-177.3	178.8	2.6	112	I173 Q174 L175 Q180	I173-R177 WeakPolarHBondContact O-CG 3.42Å; I173-R177 PolarHBondContact O-N 3.41Å; Q174-R177 WeakPolarHBondContact O-CB 3.18Å; Q174-R177 PolarHBondContact O-N 3.22Å; Q174-R177 VanDerWaalsContact O-N 3.08Å; L175-R177 VanDerWaalsContact C-N 3.28Å; L175-R177 PolarHBondContact O-N 2.87Å; R177-Q180 WeakPolarHBondContact O-CG 3.44Å; R177-Q180 PolarHBondContact O-NE2 3.37Å; R177-Q180 VanDerWaalsContact O-NE2 3.1Å
178	A	90.1	Very high	93.2	Very high	56 Å²	56	61.1 Å²	61.1	46%	0.463	29%	0.285	S	S	.	.	H	α-helix	trans	-70.4	-36.7	178.1	0	0	0	0	0	112.4	M147 Q174 L175	M147-A178 HydrophobicContact CB-CB 4.41Å; M147-A178 HydrophobicContact SD-CB 4.46Å; Q174-A178 PolarHBondContact O-N 3.19Å; L175-A178 PolarHBondContact O-N 3.18Å
179	R	90.4	Very high	93.2	Very high	31 Å²	31	61.1 Å²	61.1	12%	0.117	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121	43.3	-171.6	-56.1	-71.1	-76.2	-75.9	-0.6	113.3	M147 Q148 G150 Y153 L175 K181 E182 I184	M147-R179 WeakPolarHBondContact O-CD 3.36Å; M147-R179 WeakPolarHBondContact O-CG 3.39Å; M147-R179 PolarHBondContact O-NH1 3.48Å; Q148-R179 PolarHBondContact O-NH1 2.75Å; G150-R179 PolarHBondContact O-NH2 2.88Å; Y153-R179 PolarHBondContact OH-NH1 2.82Å; Y153-R179 VanDerWaalsContact OH-NH1 3.17Å; L175-R179 HydrophobicContact CD1-CG 4.19Å; L175-R179 PolarHBondContact O-N 3.1Å; R179-K181 VanDerWaalsContact C-N 3.25Å; R179-K181 PolarHBondContact O-N 3.08Å; R179-K181 VanDerWaalsContact O-N 3.1Å; R179-E182 IonicContact CZ-OE1 2.83Å; R179-E182 IonicContact CZ-OE2 3.59Å; R179-E182 VanDerWaalsContact NE-CD 3.28Å; R179-E182 IonicContact NE-OE1 3.95Å; R179-E182 PolarHBondContact NE-OE1 3.39Å; R179-E182 IonicContact NE-OE2 3.39Å; R179-E182 PolarHBondContact NE-OE2 3.1Å; R179-E182 IonicContact NH2-OE1 3.64Å; R179-E182 IonicContact NH2-OE2 3.66Å; R179-E182 PolarHBondContact NH2-OE2 3.28Å; R179-E182 PolarHBondContact O-N 3.49Å; R179-E182 VanDerWaalsContact O-N 3.15Å; R179-I184 HydrophobicContact CB-CD1 3.5Å; R179-I184 HydrophobicContact CG-CD1 3.67Å
180	Q	83.8	Confident	93.3	Very high	152 Å²	152	60.1 Å²	60.1	71%	0.71	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-29.1	-170.5	-70.1	176.2	30.4	0	0	115.7	R176 R177	R176-Q180 WeakPolarHBondContact O-CA 3.5Å; R176-Q180 WeakPolarHBondContact O-CG 3.47Å; R176-Q180 PolarHBondContact O-N 3.03Å; R177-Q180 WeakPolarHBondContact O-CG 3.44Å; R177-Q180 PolarHBondContact O-NE2 3.37Å; R177-Q180 VanDerWaalsContact O-NE2 3.1Å
181	K	83.9	Confident	93.5	Very high	210 Å²	210	56.6 Å²	56.6	91%	0.913	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	-2	-174.8	-65	-179.8	-178.6	174.1	0	113.2	R179	R179-K181 VanDerWaalsContact C-N 3.25Å; R179-K181 PolarHBondContact O-N 3.08Å; R179-K181 VanDerWaalsContact O-N 3.1Å
182	E	85.8	Confident	93.6	Very high	104 Å²	104	59.4 Å²	59.4	49%	0.486	27%	0.273	S	S	.	.			trans	-114.4	130.2	-172.3	-63.9	176.5	-121.9	0	0	110.1	R179 I184	R179-E182 IonicContact CZ-OE1 2.83Å; R179-E182 IonicContact CZ-OE2 3.59Å; R179-E182 VanDerWaalsContact NE-CD 3.28Å; R179-E182 IonicContact NE-OE1 3.95Å; R179-E182 PolarHBondContact NE-OE1 3.39Å; R179-E182 IonicContact NE-OE2 3.39Å; R179-E182 PolarHBondContact NE-OE2 3.1Å; R179-E182 IonicContact NH2-OE1 3.64Å; R179-E182 IonicContact NH2-OE2 3.66Å; R179-E182 PolarHBondContact NH2-OE2 3.28Å; R179-E182 PolarHBondContact O-N 3.49Å; R179-E182 VanDerWaalsContact O-N 3.15Å; E182-I184 HydrophobicContact CB-CD1 3.86Å; E182-I184 HydrophobicContact CB-CG1 3.56Å; E182-I184 PolarHBondContact O-N 2.97Å
183	D	88.4	Confident	93.7	Very high	113 Å²	113	59.2 Å²	59.2	60%	0.604	28%	0.276	S	S	*	.			trans	-82.6	90.3	166	-178.2	15.1	0	0	0	107.2	R242	D183-R242 WeakPolarHBondContact O-CD 3.21Å; D183-R242 IonicContact OD1-CZ 3.52Å; D183-R242 IonicContact OD1-NE 2.77Å; D183-R242 PolarHBondContact OD1-NE 2.8Å; D183-R242 IonicContact OD1-NH2 3.33Å; D183-R242 PolarHBondContact OD1-NH2 3.33Å; D183-R242 IonicContact OD2-NE 3.32Å; D183-R242 PolarHBondContact OD2-NE 3.29Å
184	I	92.8	Very high	93.9	Very high	18 Å²	18	59 Å²	59	9%	0.092	28%	0.275	C	S	.	.			trans	-98.7	130	-178.9	-54.9	176.6	0	0	0	108.7	Y153 R179 E182 I186	Y153-I184 HydrophobicContact CD2-CG2 3.68Å; Y153-I184 HydrophobicContact CE2-CD1 4.4Å; Y153-I184 HydrophobicContact CE2-CG2 3.97Å; R179-I184 HydrophobicContact CB-CD1 3.5Å; R179-I184 HydrophobicContact CG-CD1 3.67Å; E182-I184 HydrophobicContact CB-CD1 3.86Å; E182-I184 HydrophobicContact CB-CG1 3.56Å; E182-I184 PolarHBondContact O-N 2.97Å; I184-I186 PolarHBondContact O-N 3.15Å
185	P	96.2	Very high	94.1	Very high	4 Å²	4	59.7 Å²	59.7	3%	0.026	28%	0.28	C	S	.	.			trans	-55.2	126.4	169.3	-24.9	35.1	0	0	0	112.4	D151 A152 Y153 I235 Q238 V239	D151-P185 VanDerWaalsContact O-CD 3.29Å; D151-P185 WeakPolarHBondContact O-CD 3.31Å; A152-P185 WeakPolarHBondContact CA-O 3.46Å; A152-P185 HydrophobicContact CB-CB 4.03Å; A152-P185 HydrophobicContact CB-CG 4.4Å; Y153-P185 PolarHBondContact N-O 3.24Å; P185-I235 HydrophobicContact CB-CD1 4.06Å; P185-Q238 HydrophobicContact CB-CB 3.8Å; P185-Q238 HydrophobicContact CG-CB 4.2Å; P185-V239 HydrophobicContact CB-CG2 4.39Å; P185-V239 HydrophobicContact CG-CB 4.34Å; P185-V239 HydrophobicContact CG-CG2 3.79Å
186	I	97.6	Very high	94.3	Very high	11 Å²	11	64.2 Å²	64.2	6%	0.056	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	130.9	173.9	-57.9	165.6	0	0	0	108.8	Y153 I155 L175 I184 C215 K216	Y153-I186 WeakPolarHBondContact O-CA 3.19Å; I155-I186 HydrophobicContact CD1-CG2 3.69Å; I155-I186 HydrophobicContact CG1-CG2 3.87Å; L175-I186 HydrophobicContact CD2-CD1 3.69Å; L175-I186 HydrophobicContact CD2-CG1 3.96Å; L175-I186 HydrophobicContact CG-CD1 4.46Å; I184-I186 PolarHBondContact O-N 3.15Å; I186-C215 HydrophobicContact CG2-CB 4.32Å; I186-C215 VanDerWaalsContact CG2-SG 3.58Å; I186-K216 PolarHBondContact O-N 3.37Å
187	I	98.6	Very high	94.5	Very high	8 Å²	8	69.1 Å²	69.1	4%	0.041	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	124.5	170.5	-50.7	-176.2	0	0	0	108.3	Y153 L154 I155 V189 K216 I218 L231 I235	Y153-I187 PolarHBondContact O-N 2.75Å; L154-I187 WeakPolarHBondContact CA-O 3.48Å; L154-I187 HydrophobicContact CD2-CB 3.75Å; L154-I187 HydrophobicContact CD2-CD1 4.18Å; L154-I187 HydrophobicContact CD2-CG1 4.14Å; I155-I187 PolarHBondContact N-O 3.08Å; I187-V189 HydrophobicContact CG2-CG2 4.11Å; I187-K216 CarbonylContact C-O 3.57Å; I187-K216 WeakPolarHBondContact CA-O 3.5Å; I187-K216 HydrophobicContact CB-CB 4.5Å; I187-K216 HydrophobicContact CG1-CB 4.07Å; I187-K216 HydrophobicContact CG2-CB 4.28Å; I187-I218 HydrophobicContact CG2-CG2 3.81Å; I187-L231 HydrophobicContact CD1-CD1 4.33Å; I187-L231 HydrophobicContact CG2-CD1 4.09Å; I187-I235 HydrophobicContact CD1-CB 3.93Å; I187-I235 HydrophobicContact CD1-CD1 3.5Å; I187-I235 HydrophobicContact CD1-CG1 4.34Å; I187-I235 HydrophobicContact CG1-CD1 3.52Å
188	L	98.8	Very high	94.8	Very high	9 Å²	9	64.5 Å²	64.5	5%	0.047	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	123.6	168.4	-177.1	67.1	0	0	0	108.6	I155 Y157 F165 A168 C209 A210 K216 F217 I218	I155-L188 HydrophobicContact CB-CD1 4.3Å; I155-L188 HydrophobicContact CG2-CD1 4.35Å; Y157-L188 HydrophobicContact CD1-CD1 3.89Å; Y157-L188 HydrophobicContact CD1-CG 4.2Å; Y157-L188 HydrophobicContact CE1-CD1 4.12Å; Y157-L188 HydrophobicContact CE1-CD2 4.29Å; Y157-L188 HydrophobicContact CE1-CG 3.91Å; F165-L188 HydrophobicContact CE2-CD2 4.24Å; A168-L188 HydrophobicContact CB-CD1 3.85Å; L188-C209 HydrophobicContact CD2-CB 4.25Å; L188-A210 HydrophobicContact CB-CB 4.5Å; L188-A210 HydrophobicContact CD2-CB 4.32Å; L188-K216 PolarHBondContact N-O 2.95Å; L188-F217 HydrophobicContact CB-CD2 4.32Å; L188-F217 HydrophobicContact CD2-CD2 4.2Å; L188-F217 HydrophobicContact CG-CD2 4.25Å; L188-F217 WeakPolarHBondContact O-CA 3.37Å; L188-F217 WeakPolarHBondContact O-CD2 3.32Å; L188-I218 PolarHBondContact O-N 3.08Å; L188-I218 VanDerWaalsContact O-N 3.14Å
189	V	98.9	Very high	95.2	Very high	0 Å²	0	66 Å²	66	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	111.8	-171.4	-174.2	0	0	0	0	110	L91 L154 I155 V156 Y157 I187 N191 I218 T220 L231	L91-V189 HydrophobicContact CD1-CG1 4.33Å; L154-V189 HydrophobicContact CB-CG2 4.29Å; L154-V189 HydrophobicContact CD2-CG2 4.41Å; I155-V189 PolarHBondContact O-N 3.5Å; V156-V189 WeakPolarHBondContact CA-O 3.43Å; V156-V189 HydrophobicContact CG1-CB 4.43Å; V156-V189 HydrophobicContact CG1-CG1 4.45Å; V156-V189 HydrophobicContact CG2-CB 4.24Å; Y157-V189 WeakPolarHBondContact CD1-O 3.29Å; Y157-V189 PolarHBondContact N-O 2.97Å; I187-V189 HydrophobicContact CG2-CG2 4.11Å; V189-N191 PolarHBondContact O-N 2.94Å; V189-I218 WeakPolarHBondContact CA-O 3.5Å; V189-I218 HydrophobicContact CG1-CG2 4.48Å; V189-I218 HydrophobicContact CG2-CG2 4.28Å; V189-T220 HydrophobicContact CG1-CG2 3.96Å; V189-T220 WeakPolarHBondContact CG1-OG1 3.4Å; V189-L231 HydrophobicContact CG1-CD2 4.26Å; V189-L231 HydrophobicContact CG2-CD1 3.66Å; V189-L231 HydrophobicContact CG2-CD2 4.33Å
190	G	98.8	Very high	95.6	Very high	0 Å²	0	69.8 Å²	69.8	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	92.9	170.8	0	0	0	0	0	110.8	Y157 I218 E219 T220	Y157-G190 VanDerWaalsContact CE1-CA 3.43Å; Y157-G190 VanDerWaalsContact CZ-CA 3.46Å; G190-I218 PolarHBondContact N-O 3.14Å; G190-E219 CarbonylContact O-C 3.6Å; G190-E219 WeakPolarHBondContact O-CA 3.48Å; G190-T220 PolarHBondContact O-N 3.31Å
191	N	98.9	Very high	96.3	Very high	4 Å²	4	62.6 Å²	62.6	2%	0.021	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	167.2	-177.9	-167.7	26.7	0	0	0	112	V86 L91 V156 Y157 I159 V189 T220 A222	V86-N191 PolarHBondContact O-ND2 3.3Å; L91-N191 HydrophobicContact CD1-CB 4.5Å; V156-N191 HydrophobicContact CG1-CB 3.87Å; Y157-N191 WeakPolarHBondContact O-CB 3.03Å; Y157-N191 PolarHBondContact O-N 2.9Å; I159-N191 PolarHBondContact N-O 3.33Å; V189-N191 PolarHBondContact O-N 2.94Å; N191-T220 CarbonylContact C-O 3.57Å; N191-T220 WeakPolarHBondContact CA-O 3.4Å; N191-T220 PolarHBondContact OD1-O 3.14Å; N191-T220 PolarHBondContact OD1-OG1 2.97Å; N191-A222 PolarHBondContact OD1-N 3.43Å
192	K	98.6	Very high	97	Very high	59 Å²	59	54.7 Å²	54.7	26%	0.257	27%	0.27	S	S	.	.			trans	66.7	34	-178.2	-42.4	-167.7	-162.9	174.4	0	113.8	G85 V86 S158 I159 D194 L195 T220	G85-K192 WeakPolarHBondContact O-CE 3.46Å; G85-K192 PolarHBondContact O-NZ 2.82Å; V86-K192 WeakPolarHBondContact O-CE 3.16Å; S158-K192 VanDerWaalsContact OG-CD 3.29Å; S158-K192 WeakPolarHBondContact OG-CD 3.39Å; I159-K192 WeakPolarHBondContact CD1-O 3.43Å; I159-K192 VanDerWaalsContact CG1-O 3.31Å; I159-K192 WeakPolarHBondContact CG1-O 3.47Å; K192-D194 VanDerWaalsContact C-OD1 3.26Å; K192-D194 VanDerWaalsContact CA-OD1 3.32Å; K192-D194 WeakPolarHBondContact CA-OD1 3.38Å; K192-D194 PolarHBondContact O-N 2.81Å; K192-D194 VanDerWaalsContact O-N 3.08Å; K192-L195 HydrophobicContact CB-CD1 4.07Å; K192-L195 HydrophobicContact CB-CG 4.34Å; K192-L195 HydrophobicContact CD-CD1 4.14Å; K192-L195 PolarHBondContact O-N 3.27Å; K192-T220 PolarHBondContact N-O 3.43Å; K192-T220 VanDerWaalsContact N-O 3.08Å
193	S	98.7	Very high	97.7	Very high	17 Å²	17	51.3 Å²	51.3	12%	0.119	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-17.5	178.1	54.2	0	0	0	0	114.6	L195 T220	S193-L195 VanDerWaalsContact C-N 3.29Å; S193-L195 PolarHBondContact O-N 2.94Å; S193-T220 WeakPolarHBondContact CB-O 3.31Å; S193-T220 PolarHBondContact N-O 3.42Å; S193-T220 PolarHBondContact OG-O 2.93Å
194	D	98.6	Very high	98.1	Very high	61 Å²	61	49.1 Å²	49.1	33%	0.326	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-26.5	171.6	56.1	-70.9	0	0	0	113.5	K192 V196 S221 V224	K192-D194 VanDerWaalsContact C-OD1 3.26Å; K192-D194 VanDerWaalsContact CA-OD1 3.32Å; K192-D194 WeakPolarHBondContact CA-OD1 3.38Å; K192-D194 PolarHBondContact O-N 2.81Å; K192-D194 VanDerWaalsContact O-N 3.08Å; D194-V196 PolarHBondContact O-N 3.12Å; D194-S221 VanDerWaalsContact CG-OG 3.24Å; D194-S221 WeakPolarHBondContact OD1-CB 3.49Å; D194-S221 PolarHBondContact OD1-OG 3.46Å; D194-V224 HydrophobicContact CB-CG1 4.27Å; D194-V224 HydrophobicContact CB-CG2 4.18Å
195	L	98.2	Very high	98.4	Very high	70 Å²	70	51.7 Å²	51.7	37%	0.366	27%	0.266	S	S	.	.			trans	-85	52.9	-177.7	-59.9	-178.1	0	0	0	112.6	T160 K192 S193 R197 C198 R199	T160-L195 HydrophobicContact CG2-CB 3.5Å; T160-L195 VanDerWaalsContact CG2-CB 3.5Å; T160-L195 HydrophobicContact CG2-CD1 3.81Å; T160-L195 HydrophobicContact CG2-CG 4.29Å; K192-L195 HydrophobicContact CB-CD1 4.07Å; K192-L195 HydrophobicContact CB-CG 4.34Å; K192-L195 HydrophobicContact CD-CD1 4.14Å; K192-L195 PolarHBondContact O-N 3.27Å; S193-L195 VanDerWaalsContact C-N 3.29Å; S193-L195 PolarHBondContact O-N 2.94Å; L195-R197 VanDerWaalsContact C-N 3.26Å; L195-R197 PolarHBondContact O-N 2.91Å; L195-R197 VanDerWaalsContact O-N 3.14Å; L195-C198 HydrophobicContact CB-CB 4.43Å; L195-C198 PolarHBondContact O-N 3.13Å; L195-R199 PolarHBondContact O-N 2.95Å
196	V	97.9	Very high	98.5	Very high	97 Å²	97	51.5 Å²	51.5	59%	0.588	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-54.2	-38.7	-172.7	-178.5	0	0	0	0	113.3	D194 C198 R199	D194-V196 PolarHBondContact O-N 3.12Å; V196-C198 VanDerWaalsContact C-N 3.28Å; V196-C198 PolarHBondContact O-N 2.94Å; V196-R199 WeakPolarHBondContact O-CB 3.37Å; V196-R199 PolarHBondContact O-N 3.36Å
197	R	98.2	Very high	98.5	Very high	252 Å²	252	58 Å²	58	95%	0.951	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-73.3	-19.2	-178.5	-67.7	-177.2	178.8	149.1	0.2	113.9	L195	L195-R197 VanDerWaalsContact C-N 3.26Å; L195-R197 PolarHBondContact O-N 2.91Å; L195-R197 VanDerWaalsContact O-N 3.14Å
198	C	98.2	Very high	98.5	Very high	78 Å²	78	60.2 Å²	60.2	53%	0.527	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-103.8	14	179.9	-56.2	0	0	0	0	111.6	T160 L195 V196 E200	T160-C198 WeakPolarHBondContact CA-O 3.39Å; T160-C198 VanDerWaalsContact CB-O 3.26Å; T160-C198 WeakPolarHBondContact CB-O 3.36Å; T160-C198 HydrophobicContact CG2-CB 3.82Å; T160-C198 WeakPolarHBondContact CG2-O 3.19Å; L195-C198 HydrophobicContact CB-CB 4.43Å; L195-C198 PolarHBondContact O-N 3.13Å; V196-C198 VanDerWaalsContact C-N 3.28Å; V196-C198 PolarHBondContact O-N 2.94Å; C198-E200 PolarHBondContact O-N 3.17Å
199	R	98.7	Very high	98.4	Very high	87 Å²	87	60.6 Å²	60.6	33%	0.328	31%	0.311	S	S	.	.			trans	-66.9	124.9	-176.7	177	175.3	-100	155.6	-1.6	110.9	I159 L195 V196 V201 E219	I159-R199 HydrophobicContact CD1-CB 4.23Å; I159-R199 HydrophobicContact CD1-CG 4.28Å; L195-R199 PolarHBondContact O-N 2.95Å; V196-R199 WeakPolarHBondContact O-CB 3.37Å; V196-R199 PolarHBondContact O-N 3.36Å; R199-V201 WeakPolarHBondContact CD-O 3.43Å; R199-V201 WeakPolarHBondContact CG-O 3.36Å; R199-V201 PolarHBondContact NE-O 3.26Å; R199-E219 IonicContact CZ-OE1 3.68Å; R199-E219 IonicContact CZ-OE2 2.81Å; R199-E219 IonicContact NH2-OE1 3.27Å; R199-E219 PolarHBondContact NH2-OE1 3.39Å; R199-E219 IonicContact NH2-OE2 3.67Å; R199-E219 PolarHBondContact NH2-OE2 3.02Å
200	E	98.8	Very high	98.4	Very high	112 Å²	112	60.8 Å²	60.8	52%	0.523	31%	0.313	S	S	.	.			trans	-109.2	-21.5	173.6	-61.2	-171.6	171.6	0	0	112.4	I159 D161 R162 C198	I159-E200 PolarHBondContact O-N 3.01Å; D161-E200 WeakPolarHBondContact CA-OE2 3.49Å; R162-E200 HydrophobicContact CB-CB 4.29Å; R162-E200 WeakPolarHBondContact CB-OE2 3.42Å; R162-E200 PolarHBondContact N-OE2 3.01Å; C198-E200 PolarHBondContact O-N 3.17Å
201	V	98.7	Very high	98.3	Very high	0 Å²	0	66.4 Å²	66.4	0%	0	35%	0.347	C	S	.	.	S	Bend	trans	-118	121.6	179.3	-175.3	0	0	0	0	109.6	Y157 I159 F165 R199 E205	Y157-V201 HydrophobicContact CE2-CB 4.02Å; Y157-V201 HydrophobicContact CE2-CG1 3.88Å; Y157-V201 HydrophobicContact CE2-CG2 4.28Å; I159-V201 PolarHBondContact O-N 2.85Å; I159-V201 VanDerWaalsContact O-N 3.08Å; F165-V201 HydrophobicContact CB-CG2 3.78Å; F165-V201 HydrophobicContact CD1-CG1 4.13Å; F165-V201 HydrophobicContact CD1-CG2 4.27Å; F165-V201 HydrophobicContact CD2-CG1 3.99Å; F165-V201 HydrophobicContact CE1-CG1 4.25Å; F165-V201 HydrophobicContact CE2-CG1 4.11Å; F165-V201 HydrophobicContact CG-CG1 3.97Å; F165-V201 HydrophobicContact CG-CG2 4.02Å; F165-V201 HydrophobicContact CZ-CG1 4.22Å; R199-V201 WeakPolarHBondContact CD-O 3.43Å; R199-V201 WeakPolarHBondContact CG-O 3.36Å; R199-V201 PolarHBondContact NE-O 3.26Å; V201-E205 HydrophobicContact CG1-CB 4.29Å
202	S	98.7	Very high	98.2	Very high	44 Å²	44	71.7 Å²	71.7	31%	0.308	38%	0.379	S	S	.	.			trans	-75	154.2	177.9	70.4	0	0	0	0	111.9	A204 E205 G206	S202-A204 PolarHBondContact O-N 3.4Å; S202-E205 WeakPolarHBondContact CB-OE2 3.48Å; S202-E205 PolarHBondContact N-OE2 2.71Å; S202-E205 PolarHBondContact O-N 2.95Å; S202-E205 WeakPolarHBondContact OG-CB 3.45Å; S202-E205 WeakPolarHBondContact OG-CG 3.48Å; S202-E205 PolarHBondContact OG-N 3.12Å; S202-E205 PolarHBondContact OG-OE2 3.25Å; S202-G206 PolarHBondContact O-N 3.26Å; S202-G206 VanDerWaalsContact O-N 3.1Å
203	V	98.6	Very high	97.9	Very high	33 Å²	33	71.4 Å²	71.4	20%	0.2	38%	0.378	C	S	.	.	H	α-helix	trans	-60.8	-33	175.7	-160.3	0	0	0	0	111.6	R207 F217 E219	V203-R207 PolarHBondContact O-N 3.07Å; V203-F217 HydrophobicContact CG1-CE1 3.82Å; V203-F217 HydrophobicContact CG1-CZ 4.38Å; V203-E219 HydrophobicContact CG1-CG 4.36Å; V203-E219 WeakPolarHBondContact CG2-OE2 3.37Å
204	A	98.6	Very high	97.7	Very high	68 Å²	68	76 Å²	76	56%	0.562	40%	0.401	S	S	*	.	H	α-helix	trans	-67	-43.2	178.5	0	0	0	0	0	111.6	S202 R207 A208	S202-A204 PolarHBondContact O-N 3.4Å; A204-R207 PolarHBondContact O-N 2.85Å; A204-A208 WeakPolarHBondContact O-CB 3.35Å; A204-A208 PolarHBondContact O-N 2.87Å
205	E	98	Very high	97.5	Very high	71 Å²	71	74.1 Å²	74.1	33%	0.332	39%	0.393	S	S	.	.	H	α-helix	trans	-63.8	-44.2	175	-72.8	168.5	107.7	0	0	112	R162 V201 S202 R207 A208 C209	R162-E205 IonicContact CZ-OE1 2.72Å; R162-E205 IonicContact NH1-OE1 3.5Å; R162-E205 PolarHBondContact NH1-OE1 3.42Å; R162-E205 IonicContact NH1-OE2 3.75Å; R162-E205 IonicContact NH2-OE1 2.79Å; V201-E205 HydrophobicContact CG1-CB 4.29Å; S202-E205 WeakPolarHBondContact CB-OE2 3.48Å; S202-E205 PolarHBondContact N-OE2 2.71Å; S202-E205 PolarHBondContact O-N 2.95Å; S202-E205 WeakPolarHBondContact OG-CB 3.45Å; S202-E205 WeakPolarHBondContact OG-CG 3.48Å; S202-E205 PolarHBondContact OG-N 3.12Å; S202-E205 PolarHBondContact OG-OE2 3.25Å; E205-R207 VanDerWaalsContact C-N 3.35Å; E205-R207 PolarHBondContact O-N 3.02Å; E205-A208 PolarHBondContact O-N 3.39Å; E205-C209 VanDerWaalsContact O-CB 3.26Å; E205-C209 WeakPolarHBondContact O-CB 3.45Å; E205-C209 PolarHBondContact O-N 2.79Å
206	G	98.3	Very high	97.5	Very high	0 Å²	0	76.1 Å²	76.1	0%	0	40%	0.398	C	S	.	.	H	α-helix	trans	-57.7	-46.2	175.9	0	0	0	0	0	112.2	S202 A210	S202-G206 PolarHBondContact O-N 3.26Å; S202-G206 VanDerWaalsContact O-N 3.1Å; G206-A210 PolarHBondContact O-N 2.74Å
207	R	98.4	Very high	97.6	Very high	147 Å²	147	73.1 Å²	73.1	56%	0.555	38%	0.377	S	S	*	.	H	α-helix	trans	-62.8	-46.5	174	-79.7	-172.2	-119	-89.6	5.6	112.8	V203 A204 E205 C209 A210 V211 F217	V203-R207 PolarHBondContact O-N 3.07Å; A204-R207 PolarHBondContact O-N 2.85Å; E205-R207 VanDerWaalsContact C-N 3.35Å; E205-R207 PolarHBondContact O-N 3.02Å; R207-C209 VanDerWaalsContact C-N 3.32Å; R207-C209 PolarHBondContact O-N 2.77Å; R207-A210 PolarHBondContact O-N 3.47Å; R207-V211 WeakPolarHBondContact O-CG2 3.4Å; R207-V211 PolarHBondContact O-N 3.11Å; R207-F217 HydrophobicContact CB-CD1 4.34Å; R207-F217 HydrophobicContact CG-CD1 3.37Å; R207-F217 HydrophobicContact CG-CE1 3.8Å; R207-F217 HydrophobicContact CG-CG 4.18Å
208	A	98.3	Very high	97.6	Very high	56 Å²	56	62.7 Å²	62.7	46%	0.463	34%	0.34	S	S	.	.	H	α-helix	trans	-61.2	-43.6	-179.5	0	0	0	0	0	111.2	A204 E205 A210 V211 V212	A204-A208 WeakPolarHBondContact O-CB 3.35Å; A204-A208 PolarHBondContact O-N 2.87Å; E205-A208 PolarHBondContact O-N 3.39Å; A208-A210 PolarHBondContact O-N 3.17Å; A208-V211 PolarHBondContact O-N 3.09Å; A208-V212 WeakPolarHBondContact O-CG2 3.44Å; A208-V212 PolarHBondContact O-N 3.03Å
209	C	97.5	Very high	97.6	Very high	16 Å²	16	60.2 Å²	60.2	11%	0.108	32%	0.321	C	S	.	.	H	α-helix	trans	-58.8	-46.8	174.7	179.7	0	0	0	0	111.7	F165 S169 L188 E205 R207 V211 V212 F213	F165-C209 HydrophobicContact CE2-CB 4Å; F165-C209 HydrophobicContact CZ-CB 3.57Å; S169-C209 PolarHBondContact OG-SG 2.88Å; L188-C209 HydrophobicContact CD2-CB 4.25Å; E205-C209 VanDerWaalsContact O-CB 3.26Å; E205-C209 WeakPolarHBondContact O-CB 3.45Å; E205-C209 PolarHBondContact O-N 2.79Å; R207-C209 VanDerWaalsContact C-N 3.32Å; R207-C209 PolarHBondContact O-N 2.77Å; C209-V211 VanDerWaalsContact C-N 3.3Å; C209-V211 PolarHBondContact O-N 3.08Å; C209-V212 PolarHBondContact O-N 3.21Å; C209-F213 VanDerWaalsContact O-CD2 3.26Å; C209-F213 WeakPolarHBondContact O-CD2 3.31Å; C209-F213 PolarHBondContact O-N 3.2Å; C209-F213 WeakPolarHBondContact SG-CD2 3.21Å; C209-F213 VanDerWaalsContact SG-CE2 3.54Å
210	A	97.6	Very high	97.6	Very high	4 Å²	4	56.1 Å²	56.1	3%	0.033	31%	0.305	C	S	.	.	H	α-helix	trans	-62	-36.1	177	0	0	0	0	0	113.1	L188 G206 R207 A208 D214 C215 F217	L188-A210 HydrophobicContact CB-CB 4.5Å; L188-A210 HydrophobicContact CD2-CB 4.32Å; G206-A210 PolarHBondContact O-N 2.74Å; R207-A210 PolarHBondContact O-N 3.47Å; A208-A210 PolarHBondContact O-N 3.17Å; A210-D214 PolarHBondContact O-N 2.83Å; A210-C215 HydrophobicContact CB-CB 4.26Å; A210-C215 PolarHBondContact O-N 3.31Å; A210-F217 HydrophobicContact CB-CB 3.65Å; A210-F217 HydrophobicContact CB-CG 4.48Å
211	V	97.5	Very high	97.6	Very high	118 Å²	118	50.8 Å²	50.8	72%	0.715	28%	0.28	S	S	*	.	H	α-helix	trans	-64.5	-48.3	173.2	172.2	0	0	0	0	111.1	R207 A208 C209 F213 D214	R207-V211 WeakPolarHBondContact O-CG2 3.4Å; R207-V211 PolarHBondContact O-N 3.11Å; A208-V211 PolarHBondContact O-N 3.09Å; C209-V211 VanDerWaalsContact C-N 3.3Å; C209-V211 PolarHBondContact O-N 3.08Å; V211-F213 VanDerWaalsContact C-N 3.26Å; V211-F213 PolarHBondContact O-N 3.15Å; V211-D214 PolarHBondContact O-N 3.33Å
212	V	95.4	Very high	97.5	Very high	115 Å²	115	51.1 Å²	51.1	70%	0.697	28%	0.283	S	S	*	.	H	α-helix	trans	-60.1	-38.7	-179.9	170.5	0	0	0	0	111.6	A208 C209	A208-V212 WeakPolarHBondContact O-CG2 3.44Å; A208-V212 PolarHBondContact O-N 3.03Å; C209-V212 PolarHBondContact O-N 3.21Å
213	F	93.1	Very high	97.4	Very high	53 Å²	53	52.9 Å²	52.9	23%	0.232	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	6.5	-178.9	-68.3	-62.9	0	0	0	115	R172 I173 C209 V211 C215	R172-F213 HydrophobicContact CG-CB 3.66Å; R172-F213 HydrophobicContact CG-CD1 3.95Å; R172-F213 HydrophobicContact CG-CG 3.81Å; R172-F213 PolarHBondContact NE-O 3.32Å; R172-F213 PolarHBondContact NH2-O 3.09Å; I173-F213 HydrophobicContact CD1-CE1 4.04Å; I173-F213 HydrophobicContact CD1-CZ 4.36Å; I173-F213 HydrophobicContact CG1-CE1 3.83Å; C209-F213 VanDerWaalsContact O-CD2 3.26Å; C209-F213 WeakPolarHBondContact O-CD2 3.31Å; C209-F213 PolarHBondContact O-N 3.2Å; C209-F213 WeakPolarHBondContact SG-CD2 3.21Å; C209-F213 VanDerWaalsContact SG-CE2 3.54Å; V211-F213 VanDerWaalsContact C-N 3.26Å; V211-F213 PolarHBondContact O-N 3.15Å; F213-C215 PolarHBondContact O-SG 3.23Å
214	D	94.1	Very high	97.2	Very high	115 Å²	115	55.9 Å²	55.9	62%	0.615	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	55	-179.2	-169.9	33	0	0	0	112.7	A210 V211	A210-D214 PolarHBondContact O-N 2.83Å; V211-D214 PolarHBondContact O-N 3.33Å
215	C	95.6	Very high	97.1	Very high	21 Å²	21	57.4 Å²	57.4	14%	0.142	31%	0.314	C	S	.	.			trans	-122.9	162.2	177.3	-60	0	0	0	0	110.2	R172 I186 A210 F213	R172-C215 VanDerWaalsContact CD-SG 3.51Å; R172-C215 PolarHBondContact NE-SG 3.44Å; I186-C215 HydrophobicContact CG2-CB 4.32Å; I186-C215 VanDerWaalsContact CG2-SG 3.58Å; A210-C215 HydrophobicContact CB-CB 4.26Å; A210-C215 PolarHBondContact O-N 3.31Å; F213-C215 PolarHBondContact O-SG 3.23Å
216	K	98.2	Very high	97.1	Very high	111 Å²	111	58.5 Å²	58.5	48%	0.483	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	163.2	160.3	-55.9	-57	-175.8	-173.3	0	110.1	I186 I187 L188 Q238	I186-K216 PolarHBondContact O-N 3.37Å; I187-K216 CarbonylContact C-O 3.57Å; I187-K216 WeakPolarHBondContact CA-O 3.5Å; I187-K216 HydrophobicContact CB-CB 4.5Å; I187-K216 HydrophobicContact CG1-CB 4.07Å; I187-K216 HydrophobicContact CG2-CB 4.28Å; L188-K216 PolarHBondContact N-O 2.95Å; K216-Q238 HydrophobicContact CG-CG 4.22Å
217	F	98.8	Very high	97.1	Very high	35 Å²	35	60.6 Å²	60.6	15%	0.154	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	138.7	-179.4	176.3	-105.4	0	0	0	111.1	Y157 L188 V203 R207 A210 E219	Y157-F217 HydrophobicContact CE1-CE2 4.18Å; Y157-F217 WeakPolarHBondContact OH-CE2 3.45Å; L188-F217 HydrophobicContact CB-CD2 4.32Å; L188-F217 HydrophobicContact CD2-CD2 4.2Å; L188-F217 HydrophobicContact CG-CD2 4.25Å; L188-F217 WeakPolarHBondContact O-CA 3.37Å; L188-F217 WeakPolarHBondContact O-CD2 3.32Å; V203-F217 HydrophobicContact CG1-CE1 3.82Å; V203-F217 HydrophobicContact CG1-CZ 4.38Å; R207-F217 HydrophobicContact CB-CD1 4.34Å; R207-F217 HydrophobicContact CG-CD1 3.37Å; R207-F217 HydrophobicContact CG-CE1 3.8Å; R207-F217 HydrophobicContact CG-CG 4.18Å; A210-F217 HydrophobicContact CB-CB 3.65Å; A210-F217 HydrophobicContact CB-CG 4.48Å; F217-E219 HydrophobicContact CE1-CG 3.95Å; F217-E219 HydrophobicContact CE2-CG 4.47Å; F217-E219 HydrophobicContact CZ-CG 3.54Å
218	I	98.8	Very high	97	Very high	33 Å²	33	54 Å²	54	17%	0.169	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	143.6	171.6	-168.5	168	0	0	0	109.7	I187 L188 V189 G190 T220 N227 E230 L231	I187-I218 HydrophobicContact CG2-CG2 3.81Å; L188-I218 PolarHBondContact O-N 3.08Å; L188-I218 VanDerWaalsContact O-N 3.14Å; V189-I218 WeakPolarHBondContact CA-O 3.5Å; V189-I218 HydrophobicContact CG1-CG2 4.48Å; V189-I218 HydrophobicContact CG2-CG2 4.28Å; G190-I218 PolarHBondContact N-O 3.14Å; I218-T220 HydrophobicContact CG1-CG2 4.37Å; I218-T220 HydrophobicContact CG2-CG2 4.22Å; I218-N227 HydrophobicContact CD1-CB 3.89Å; I218-N227 HydrophobicContact CG1-CB 4.11Å; I218-E230 HydrophobicContact CD1-CB 4.08Å; I218-L231 HydrophobicContact CD1-CB 4.36Å; I218-L231 HydrophobicContact CG2-CB 4.47Å; I218-L231 HydrophobicContact CG2-CD1 3.68Å
219	E	98.8	Very high	96.8	Very high	26 Å²	26	58 Å²	58	12%	0.121	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	135.3	167.3	-69.2	-167.4	145.8	0	0	109.6	G190 R199 V203 F217 N227	G190-E219 CarbonylContact O-C 3.6Å; G190-E219 WeakPolarHBondContact O-CA 3.48Å; R199-E219 IonicContact CZ-OE1 3.68Å; R199-E219 IonicContact CZ-OE2 2.81Å; R199-E219 IonicContact NH2-OE1 3.27Å; R199-E219 PolarHBondContact NH2-OE1 3.39Å; R199-E219 IonicContact NH2-OE2 3.67Å; R199-E219 PolarHBondContact NH2-OE2 3.02Å; V203-E219 HydrophobicContact CG1-CG 4.36Å; V203-E219 WeakPolarHBondContact CG2-OE2 3.37Å; F217-E219 HydrophobicContact CE1-CG 3.95Å; F217-E219 HydrophobicContact CE2-CG 4.47Å; F217-E219 HydrophobicContact CZ-CG 3.54Å; E219-N227 VanDerWaalsContact O-CB 3.27Å; E219-N227 WeakPolarHBondContact O-CB 3.31Å; E219-N227 PolarHBondContact O-ND2 2.81Å
220	T	98.8	Very high	96.8	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	33%	0.329	C	S	.	.			trans	-128.5	164.7	-177.7	60.6	0	0	0	0	111.4	V189 G190 N191 K192 S193 I218 H226 N227 L231	V189-T220 HydrophobicContact CG1-CG2 3.96Å; V189-T220 WeakPolarHBondContact CG1-OG1 3.4Å; G190-T220 PolarHBondContact O-N 3.31Å; N191-T220 CarbonylContact C-O 3.57Å; N191-T220 WeakPolarHBondContact CA-O 3.4Å; N191-T220 PolarHBondContact OD1-O 3.14Å; N191-T220 PolarHBondContact OD1-OG1 2.97Å; K192-T220 PolarHBondContact N-O 3.43Å; K192-T220 VanDerWaalsContact N-O 3.08Å; S193-T220 WeakPolarHBondContact CB-O 3.31Å; S193-T220 PolarHBondContact N-O 3.42Å; S193-T220 PolarHBondContact OG-O 2.93Å; I218-T220 HydrophobicContact CG1-CG2 4.37Å; I218-T220 HydrophobicContact CG2-CG2 4.22Å; T220-H226 CarbonylContact C-O 3.49Å; T220-H226 VanDerWaalsContact CA-O 3.31Å; T220-H226 WeakPolarHBondContact CA-O 3.13Å; T220-N227 HydrophobicContact CG2-CB 3.95Å; T220-L231 HydrophobicContact CG2-CB 4.28Å; T220-L231 HydrophobicContact CG2-CD2 4.14Å
221	S	98.4	Very high	96.8	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	33%	0.328	C	S	.	.	B	Isolated β-bridge	trans	-137.3	115.6	161.3	173.7	0	0	0	0	108.7	D194 A223 V224 Q225 H226	D194-S221 VanDerWaalsContact CG-OG 3.24Å; D194-S221 WeakPolarHBondContact OD1-CB 3.49Å; D194-S221 PolarHBondContact OD1-OG 3.46Å; S221-A223 VanDerWaalsContact C-N 3.26Å; S221-A223 PolarHBondContact OG-N 2.94Å; S221-V224 WeakPolarHBondContact OG-CG2 3.36Å; S221-V224 PolarHBondContact OG-N 3.01Å; S221-Q225 CarbonylContact O-C 3.44Å; S221-Q225 WeakPolarHBondContact O-CA 3.21Å; S221-Q225 PolarHBondContact O-N 2.98Å; S221-H226 PolarHBondContact N-O 3.47Å; S221-H226 PolarHBondContact O-N 2.9Å
222	A	96.6	Very high	96.8	Very high	7 Å²	7	56 Å²	56	6%	0.058	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-35.6	169.3	0	0	0	0	0	111.6	L91 I94 N191 V224 Q225	L91-A222 HydrophobicContact CD2-CB 4.02Å; L91-A222 HydrophobicContact CG-CB 4.18Å; I94-A222 HydrophobicContact CG1-CB 4.29Å; N191-A222 PolarHBondContact OD1-N 3.43Å; A222-V224 PolarHBondContact O-N 2.85Å; A222-Q225 PolarHBondContact O-N 3.27Å
223	A	95.7	Very high	96.9	Very high	81 Å²	81	52.2 Å²	52.2	67%	0.669	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-38.2	-174.7	0	0	0	0	0	113.2	S221	S221-A223 VanDerWaalsContact C-N 3.26Å; S221-A223 PolarHBondContact OG-N 2.94Å
224	V	95.7	Very high	97	Very high	96 Å²	96	50.6 Å²	50.6	58%	0.582	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.8	12.8	177.3	-55.9	0	0	0	0	113	D194 S221 A222 H226	D194-V224 HydrophobicContact CB-CG1 4.27Å; D194-V224 HydrophobicContact CB-CG2 4.18Å; S221-V224 WeakPolarHBondContact OG-CG2 3.36Å; S221-V224 PolarHBondContact OG-N 3.01Å; A222-V224 PolarHBondContact O-N 2.85Å; V224-H226 HydrophobicContact CG2-CB 3.89Å; V224-H226 PolarHBondContact O-N 2.94Å; V224-H226 VanDerWaalsContact O-N 3.12Å
225	Q	95.4	Very high	97.2	Very high	101 Å²	101	45.2 Å²	45.2	47%	0.472	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.2	27.1	-179	-51	-173.6	17.8	0	0	114.9	I94 S221 A222	I94-Q225 HydrophobicContact CD1-CG 4.12Å; I94-Q225 HydrophobicContact CG2-CB 4.43Å; I94-Q225 HydrophobicContact CG2-CG 3.89Å; S221-Q225 CarbonylContact O-C 3.44Å; S221-Q225 WeakPolarHBondContact O-CA 3.21Å; S221-Q225 PolarHBondContact O-N 2.98Å; A222-Q225 PolarHBondContact O-N 3.27Å
226	H	97.4	Very high	97.2	Very high	93 Å²	93	44.2 Å²	44.2	43%	0.431	23%	0.231	S	C	.	.	B	Isolated β-bridge	trans	-77.5	129.2	-179.6	177.3	-110.6	0	0	0	111.2	T220 S221 V224 V228	T220-H226 CarbonylContact C-O 3.49Å; T220-H226 VanDerWaalsContact CA-O 3.31Å; T220-H226 WeakPolarHBondContact CA-O 3.13Å; S221-H226 PolarHBondContact N-O 3.47Å; S221-H226 PolarHBondContact O-N 2.9Å; V224-H226 HydrophobicContact CG2-CB 3.89Å; V224-H226 PolarHBondContact O-N 2.94Å; V224-H226 VanDerWaalsContact O-N 3.12Å; H226-V228 PolarHBondContact O-N 2.98Å; H226-V228 VanDerWaalsContact O-N 3.13Å
227	N	98	Very high	97.2	Very high	45 Å²	45	42.6 Å²	42.6	24%	0.241	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	60	12	178.8	-74.8	-20.9	0	0	0	115.8	I218 E219 T220 E230 L231	I218-N227 HydrophobicContact CD1-CB 3.89Å; I218-N227 HydrophobicContact CG1-CB 4.11Å; E219-N227 VanDerWaalsContact O-CB 3.27Å; E219-N227 WeakPolarHBondContact O-CB 3.31Å; E219-N227 PolarHBondContact O-ND2 2.81Å; T220-N227 HydrophobicContact CG2-CB 3.95Å; N227-E230 WeakPolarHBondContact CA-OE2 3.46Å; N227-L231 WeakPolarHBondContact O-CB 3.43Å; N227-L231 PolarHBondContact O-N 3.08Å
228	V	96.6	Very high	97	Very high	7 Å²	7	42.5 Å²	42.5	4%	0.042	22%	0.222	C	C	.	.	H	α-helix	trans	-70.4	-45.4	-178	-177.5	0	0	0	0	110.3	L91 I94 H226 E230 L231 F232	L91-V228 HydrophobicContact CD2-CG1 4.4Å; L91-V228 HydrophobicContact CD2-CG2 3.94Å; I94-V228 HydrophobicContact CG2-CB 4.4Å; I94-V228 HydrophobicContact CG2-CG1 3.95Å; I94-V228 HydrophobicContact CG2-CG2 4.32Å; H226-V228 PolarHBondContact O-N 2.98Å; H226-V228 VanDerWaalsContact O-N 3.13Å; V228-E230 PolarHBondContact O-N 2.91Å; V228-L231 WeakPolarHBondContact O-CB 3.27Å; V228-L231 PolarHBondContact O-N 2.81Å; V228-F232 HydrophobicContact CG1-CD2 4.06Å; V228-F232 HydrophobicContact CG1-CE2 3.76Å; V228-F232 WeakPolarHBondContact O-CD2 3.21Å; V228-F232 PolarHBondContact O-N 3.4Å
229	K	94.4	Very high	96.8	Very high	141 Å²	141	41.2 Å²	41.2	61%	0.613	22%	0.216	S	C	*	.	H	α-helix	trans	-61.1	-47.4	176.3	178	176.8	171	179.4	0	111.2	L231 F232 E233	K229-L231 VanDerWaalsContact C-N 3.27Å; K229-L231 PolarHBondContact O-N 2.97Å; K229-F232 PolarHBondContact O-N 2.97Å; K229-F232 VanDerWaalsContact O-N 3.14Å; K229-E233 WeakPolarHBondContact CE-OE1 3.37Å; K229-E233 HydrophobicContact CG-CG 4.3Å; K229-E233 IonicContact NZ-OE1 3.92Å; K229-E233 WeakPolarHBondContact O-CG 3.44Å; K229-E233 PolarHBondContact O-N 2.53Å
230	E	97.5	Very high	96.6	Very high	94 Å²	94	41.2 Å²	41.2	44%	0.439	22%	0.215	S	C	.	.	H	α-helix	trans	-60.5	-36.2	-179.6	-67.5	76.1	-174	0	0	112	I218 N227 V228 G234	I218-E230 HydrophobicContact CD1-CB 4.08Å; N227-E230 WeakPolarHBondContact CA-OE2 3.46Å; V228-E230 PolarHBondContact O-N 2.91Å; E230-G234 WeakPolarHBondContact O-CA 3.35Å; E230-G234 PolarHBondContact O-N 3.23Å
231	L	98.4	Very high	96.2	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-59.9	-50.7	173.4	169.8	65.8	0	0	0	111.5	L154 I187 V189 I218 T220 N227 V228 K229 G234 I235	L154-L231 HydrophobicContact CD1-CD1 4.15Å; L154-L231 HydrophobicContact CD1-CD2 4.08Å; L154-L231 HydrophobicContact CD1-CG 4.14Å; L154-L231 HydrophobicContact CD2-CD1 3.75Å; I187-L231 HydrophobicContact CD1-CD1 4.33Å; I187-L231 HydrophobicContact CG2-CD1 4.09Å; V189-L231 HydrophobicContact CG1-CD2 4.26Å; V189-L231 HydrophobicContact CG2-CD1 3.66Å; V189-L231 HydrophobicContact CG2-CD2 4.33Å; I218-L231 HydrophobicContact CD1-CB 4.36Å; I218-L231 HydrophobicContact CG2-CB 4.47Å; I218-L231 HydrophobicContact CG2-CD1 3.68Å; T220-L231 HydrophobicContact CG2-CB 4.28Å; T220-L231 HydrophobicContact CG2-CD2 4.14Å; N227-L231 WeakPolarHBondContact O-CB 3.43Å; N227-L231 PolarHBondContact O-N 3.08Å; V228-L231 WeakPolarHBondContact O-CB 3.27Å; V228-L231 PolarHBondContact O-N 2.81Å; K229-L231 VanDerWaalsContact C-N 3.27Å; K229-L231 PolarHBondContact O-N 2.97Å; L231-G234 PolarHBondContact O-N 3.25Å; L231-I235 PolarHBondContact O-N 2.98Å
232	F	97.1	Very high	95.7	Very high	1 Å²	1	48.2 Å²	48.2	0%	0.004	25%	0.248	C	C	.	.	H	α-helix	trans	-75.3	-37	-176	-70.8	-72.7	0	0	0	113.2	F95 L118 I127 L129 L154 V228 K229 G234 I235 V236	F95-F232 HydrophobicContact CB-CD2 4.13Å; F95-F232 HydrophobicContact CB-CE1 4.39Å; F95-F232 HydrophobicContact CB-CE2 3.46Å; F95-F232 VanDerWaalsContact CB-CE2 3.46Å; F95-F232 HydrophobicContact CB-CZ 3.61Å; F95-F232 HydrophobicContact CD1-CE1 4.25Å; F95-F232 HydrophobicContact CD1-CZ 4.28Å; F95-F232 HydrophobicContact CD2-CB 4.11Å; F95-F232 AromaticContact CD2-CD1 3.81Å; F95-F232 HydrophobicContact CD2-CD1 3.81Å; F95-F232 AromaticContact CD2-CD2 3.2Å; F95-F232 HydrophobicContact CD2-CD2 3.2Å; F95-F232 HydrophobicContact CD2-CE1 4Å; F95-F232 AromaticContact CD2-CE2 3.46Å; F95-F232 HydrophobicContact CD2-CE2 3.46Å; F95-F232 VanDerWaalsContact CD2-CE2 3.46Å; F95-F232 AromaticContact CD2-CG 3.42Å; F95-F232 HydrophobicContact CD2-CG 3.42Å; F95-F232 VanDerWaalsContact CD2-CG 3.42Å; F95-F232 AromaticContact CD2-CZ 3.84Å; F95-F232 HydrophobicContact CD2-CZ 3.84Å; F95-F232 HydrophobicContact CE2-CB 3.84Å; F95-F232 AromaticContact CE2-CD1 3.87Å; F95-F232 HydrophobicContact CE2-CD1 3.87Å; F95-F232 AromaticContact CE2-CD2 3.84Å; F95-F232 HydrophobicContact CE2-CD2 3.84Å; F95-F232 HydrophobicContact CE2-CE1 4.4Å; F95-F232 HydrophobicContact CE2-CE2 4.41Å; F95-F232 AromaticContact CE2-CG 3.56Å; F95-F232 HydrophobicContact CE2-CG 3.56Å; F95-F232 HydrophobicContact CG-CD1 4.19Å; F95-F232 AromaticContact CG-CD2 3.86Å; F95-F232 HydrophobicContact CG-CD2 3.86Å; F95-F232 AromaticContact CG-CE1 3.91Å; F95-F232 HydrophobicContact CG-CE1 3.91Å; F95-F232 AromaticContact CG-CE2 3.59Å; F95-F232 HydrophobicContact CG-CE2 3.59Å; F95-F232 HydrophobicContact CG-CG 4.17Å; F95-F232 AromaticContact CG-CZ 3.61Å; F95-F232 HydrophobicContact CG-CZ 3.61Å; F95-F232 HydrophobicContact CZ-CD1 4.28Å; F95-F232 HydrophobicContact CZ-CG 4.39Å; L118-F232 HydrophobicContact CD1-CB 4.01Å; I127-F232 HydrophobicContact CD1-CB 3.97Å; I127-F232 HydrophobicContact CD1-CD1 4.04Å; I127-F232 HydrophobicContact CD1-CG 4.43Å; L129-F232 HydrophobicContact CD1-CE1 3.91Å; L129-F232 HydrophobicContact CD2-CE1 3.9Å; L129-F232 HydrophobicContact CD2-CZ 3.89Å; L154-F232 HydrophobicContact CD1-CE1 4.05Å; L154-F232 HydrophobicContact CD1-CZ 4.49Å; V228-F232 HydrophobicContact CG1-CD2 4.06Å; V228-F232 HydrophobicContact CG1-CE2 3.76Å; V228-F232 WeakPolarHBondContact O-CD2 3.21Å; V228-F232 PolarHBondContact O-N 3.4Å; K229-F232 PolarHBondContact O-N 2.97Å; K229-F232 VanDerWaalsContact O-N 3.14Å; F232-G234 VanDerWaalsContact C-N 3.3Å; F232-G234 PolarHBondContact O-N 3.33Å; F232-I235 VanDerWaalsContact O-CG2 3.29Å; F232-I235 WeakPolarHBondContact O-CG2 3.33Å; F232-I235 PolarHBondContact O-N 2.65Å; F232-V236 WeakPolarHBondContact O-CG2 3.48Å; F232-V236 PolarHBondContact O-N 3.32Å
233	E	96.4	Very high	95.2	Very high	35 Å²	35	52.2 Å²	52.2	16%	0.164	26%	0.261	C	S	.	.	H	α-helix	trans	-65.2	-39.2	169.5	-62.1	-175.1	176.8	0	0	111.2	V120 K229 I235 V236 R237	V120-E233 HydrophobicContact CG1-CB 4.26Å; V120-E233 HydrophobicContact CG2-CB 4.34Å; V120-E233 HydrophobicContact CG2-CG 4.19Å; K229-E233 WeakPolarHBondContact CE-OE1 3.37Å; K229-E233 HydrophobicContact CG-CG 4.3Å; K229-E233 IonicContact NZ-OE1 3.92Å; K229-E233 WeakPolarHBondContact O-CG 3.44Å; K229-E233 PolarHBondContact O-N 2.53Å; E233-I235 PolarHBondContact O-N 3.14Å; E233-V236 PolarHBondContact O-N 2.9Å; E233-R237 WeakPolarHBondContact O-CG 3.47Å; E233-R237 PolarHBondContact O-N 3.38Å; E233-R237 IonicContact OE2-CZ 3.48Å; E233-R237 IonicContact OE2-NH1 3.82Å; E233-R237 PolarHBondContact OE2-NH1 3.33Å; E233-R237 VanDerWaalsContact OE2-NH1 3.16Å; E233-R237 IonicContact OE2-NH2 2.88Å; E233-R237 PolarHBondContact OE2-NH2 3.5Å
234	G	97.1	Very high	94.5	Very high	20 Å²	20	51.9 Å²	51.9	21%	0.206	25%	0.248	C	C	.	.	H	α-helix	trans	-59.6	-43.2	177.5	0	0	0	0	0	112.7	E230 L231 F232 R237 Q238	E230-G234 WeakPolarHBondContact O-CA 3.35Å; E230-G234 PolarHBondContact O-N 3.23Å; L231-G234 PolarHBondContact O-N 3.25Å; F232-G234 VanDerWaalsContact C-N 3.3Å; F232-G234 PolarHBondContact O-N 3.33Å; G234-R237 PolarHBondContact O-N 2.98Å; G234-Q238 WeakPolarHBondContact O-CG 3.5Å; G234-Q238 PolarHBondContact O-N 3.05Å
235	I	97.6	Very high	93.7	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-67.6	-40.5	178.3	-160	71.5	0	0	0	111.8	V78 I127 A152 L154 P185 I187 L231 F232 E233 R237 Q238 V239	V78-I235 HydrophobicContact CG1-CG1 4.49Å; V78-I235 HydrophobicContact CG2-CG1 4.33Å; V78-I235 HydrophobicContact CG2-CG2 3.95Å; I127-I235 HydrophobicContact CD1-CG2 4.48Å; A152-I235 HydrophobicContact CB-CD1 3.73Å; A152-I235 HydrophobicContact CB-CG1 3.48Å; A152-I235 VanDerWaalsContact CB-CG1 3.48Å; L154-I235 HydrophobicContact CD2-CB 4.42Å; L154-I235 HydrophobicContact CD2-CD1 3.87Å; L154-I235 HydrophobicContact CD2-CG1 4.23Å; P185-I235 HydrophobicContact CB-CD1 4.06Å; I187-I235 HydrophobicContact CD1-CB 3.93Å; I187-I235 HydrophobicContact CD1-CD1 3.5Å; I187-I235 HydrophobicContact CD1-CG1 4.34Å; I187-I235 HydrophobicContact CG1-CD1 3.52Å; L231-I235 PolarHBondContact O-N 2.98Å; F232-I235 VanDerWaalsContact O-CG2 3.29Å; F232-I235 WeakPolarHBondContact O-CG2 3.33Å; F232-I235 PolarHBondContact O-N 2.65Å; E233-I235 PolarHBondContact O-N 3.14Å; I235-R237 PolarHBondContact O-N 3.19Å; I235-Q238 PolarHBondContact O-N 3.28Å; I235-Q238 VanDerWaalsContact O-N 3.13Å; I235-V239 WeakPolarHBondContact O-CG2 3.27Å; I235-V239 PolarHBondContact O-N 3.16Å
236	V	96.5	Very high	92.9	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-58.3	-48.5	174.9	170.2	0	0	0	0	110.6	Y76 V120 A125 I127 F232 E233 Q238 V239 R240	Y76-V236 HydrophobicContact CD2-CG1 4.35Å; Y76-V236 HydrophobicContact CD2-CG2 4.11Å; Y76-V236 HydrophobicContact CE2-CG1 3.88Å; Y76-V236 HydrophobicContact CE2-CG2 4.45Å; V120-V236 HydrophobicContact CB-CG1 3.97Å; V120-V236 HydrophobicContact CG1-CB 4.33Å; V120-V236 HydrophobicContact CG1-CG1 4.01Å; V120-V236 HydrophobicContact CG2-CB 4.11Å; V120-V236 HydrophobicContact CG2-CG1 3.95Å; V120-V236 HydrophobicContact CG2-CG2 4.3Å; A125-V236 HydrophobicContact CB-CG1 3.69Å; A125-V236 HydrophobicContact CB-CG2 4.03Å; I127-V236 HydrophobicContact CD1-CG2 3.67Å; I127-V236 HydrophobicContact CG1-CG2 3.91Å; F232-V236 WeakPolarHBondContact O-CG2 3.48Å; F232-V236 PolarHBondContact O-N 3.32Å; E233-V236 PolarHBondContact O-N 2.9Å; V236-Q238 VanDerWaalsContact C-N 3.28Å; V236-Q238 PolarHBondContact O-N 3.21Å; V236-V239 PolarHBondContact O-N 3.28Å; V236-V239 VanDerWaalsContact O-N 3.15Å; V236-R240 HydrophobicContact CG1-CG 4.42Å; V236-R240 WeakPolarHBondContact O-CG 3.26Å; V236-R240 PolarHBondContact O-N 3.35Å
237	R	96.4	Very high	91.9	Very high	78 Å²	78	51.8 Å²	51.8	29%	0.294	25%	0.248	S	C	.	.	H	α-helix	trans	-56.5	-42.8	175.9	-70.2	177.8	-172.2	108.7	3.5	111.7	V120 D121 E233 G234 I235 R240 L241	V120-R237 HydrophobicContact CG1-CG 3.94Å; D121-R237 IonicContact OD1-CZ 3.38Å; D121-R237 IonicContact OD1-NE 3.09Å; D121-R237 PolarHBondContact OD1-NE 3.11Å; D121-R237 VanDerWaalsContact OD1-NE 3.09Å; D121-R237 IonicContact OD1-NH2 2.82Å; D121-R237 PolarHBondContact OD1-NH2 2.9Å; D121-R237 WeakPolarHBondContact OD2-CD 3.4Å; D121-R237 WeakPolarHBondContact OD2-CG 3.42Å; D121-R237 IonicContact OD2-CZ 3.86Å; D121-R237 IonicContact OD2-NE 2.88Å; D121-R237 PolarHBondContact OD2-NE 2.94Å; E233-R237 WeakPolarHBondContact O-CG 3.47Å; E233-R237 PolarHBondContact O-N 3.38Å; E233-R237 IonicContact OE2-CZ 3.48Å; E233-R237 IonicContact OE2-NH1 3.82Å; E233-R237 PolarHBondContact OE2-NH1 3.33Å; E233-R237 VanDerWaalsContact OE2-NH1 3.16Å; E233-R237 IonicContact OE2-NH2 2.88Å; E233-R237 PolarHBondContact OE2-NH2 3.5Å; G234-R237 PolarHBondContact O-N 2.98Å; I235-R237 PolarHBondContact O-N 3.19Å; R237-R240 PolarHBondContact O-N 3.45Å; R237-L241 WeakPolarHBondContact O-CB 3.41Å; R237-L241 VanDerWaalsContact O-CG 3.23Å; R237-L241 WeakPolarHBondContact O-CG 3.49Å; R237-L241 PolarHBondContact O-N 3.34Å
238	Q	96.2	Very high	90.8	Very high	33 Å²	33	56 Å²	56	15%	0.154	26%	0.264	C	S	.	.	H	α-helix	trans	-66.5	-35.4	178.9	-70.5	-59.8	-62.9	0	0	113.5	P185 K216 G234 I235 V236 R242	P185-Q238 HydrophobicContact CB-CB 3.8Å; P185-Q238 HydrophobicContact CG-CB 4.2Å; K216-Q238 HydrophobicContact CG-CG 4.22Å; G234-Q238 WeakPolarHBondContact O-CG 3.5Å; G234-Q238 PolarHBondContact O-N 3.05Å; I235-Q238 PolarHBondContact O-N 3.28Å; I235-Q238 VanDerWaalsContact O-N 3.13Å; V236-Q238 VanDerWaalsContact C-N 3.28Å; V236-Q238 PolarHBondContact O-N 3.21Å; Q238-R242 PolarHBondContact O-NH1 3.13Å; Q238-R242 VanDerWaalsContact OE1-NH1 3.1Å
239	V	94.2	Very high	89.7	Confident	5 Å²	5	60.1 Å²	60.1	3%	0.03	29%	0.286	C	S	.	.	H	α-helix	trans	-69.5	-47.1	175.4	-179.2	0	0	0	0	110.6	Y76 A152 P185 I235 V236 L241 R242 R243	Y76-V239 HydrophobicContact CD1-CB 3.93Å; Y76-V239 HydrophobicContact CD1-CG1 3.47Å; Y76-V239 VanDerWaalsContact CD1-CG1 3.47Å; Y76-V239 HydrophobicContact CD1-CG2 4.42Å; Y76-V239 HydrophobicContact CE1-CB 4.18Å; Y76-V239 HydrophobicContact CE1-CG1 3.74Å; A152-V239 HydrophobicContact CB-CG2 3.7Å; P185-V239 HydrophobicContact CB-CG2 4.39Å; P185-V239 HydrophobicContact CG-CB 4.34Å; P185-V239 HydrophobicContact CG-CG2 3.79Å; I235-V239 WeakPolarHBondContact O-CG2 3.27Å; I235-V239 PolarHBondContact O-N 3.16Å; V236-V239 PolarHBondContact O-N 3.28Å; V236-V239 VanDerWaalsContact O-N 3.15Å; V239-L241 PolarHBondContact O-N 3.31Å; V239-R242 PolarHBondContact O-N 3.36Å; V239-R242 VanDerWaalsContact O-N 3.14Å; V239-R243 HydrophobicContact CG1-CG 4.22Å; V239-R243 PolarHBondContact O-N 2.91Å
240	R	93.5	Very high	89.1	Confident	27 Å²	27	58.4 Å²	58.4	10%	0.102	28%	0.28	C	S	.	.	H	α-helix	trans	-55.6	-48.7	177.5	-72.7	-179.1	178.1	168.8	-2.3	111.7	Y76 V120 E123 S124 V236 R237 R242 R243 D244	Y76-R240 HydrophobicContact CE1-CG 4.46Å; Y76-R240 WeakPolarHBondContact OH-CG 3.49Å; Y76-R240 PolarHBondContact OH-NE 2.97Å; Y76-R240 VanDerWaalsContact OH-NE 3.11Å; V120-R240 PolarHBondContact O-NH1 3.47Å; E123-R240 PolarHBondContact O-NH2 2.95Å; E123-R240 IonicContact OE2-CZ 3.21Å; E123-R240 IonicContact OE2-NE 3.42Å; E123-R240 PolarHBondContact OE2-NE 2.92Å; E123-R240 IonicContact OE2-NH1 3.54Å; E123-R240 IonicContact OE2-NH2 3.45Å; E123-R240 PolarHBondContact OE2-NH2 3.47Å; S124-R240 PolarHBondContact O-NH2 3.47Å; V236-R240 HydrophobicContact CG1-CG 4.42Å; V236-R240 WeakPolarHBondContact O-CG 3.26Å; V236-R240 PolarHBondContact O-N 3.35Å; R237-R240 PolarHBondContact O-N 3.45Å; R240-R242 PolarHBondContact O-N 2.82Å; R240-R242 VanDerWaalsContact O-N 3.12Å; R240-R243 PolarHBondContact O-N 2.96Å; R240-D244 VanDerWaalsContact O-CG 3.25Å; R240-D244 PolarHBondContact O-N 3.1Å
241	L	91.4	Very high	88.2	Confident	96 Å²	96	59.9 Å²	59.9	50%	0.503	29%	0.285	S	S	.	.	H	α-helix	trans	-53.5	-37.9	177.8	-75.9	170.2	0	0	0	113.4	R237 V239 S245	R237-L241 WeakPolarHBondContact O-CB 3.41Å; R237-L241 VanDerWaalsContact O-CG 3.23Å; R237-L241 WeakPolarHBondContact O-CG 3.49Å; R237-L241 PolarHBondContact O-N 3.34Å; V239-L241 PolarHBondContact O-N 3.31Å; L241-S245 VanDerWaalsContact O-CB 3.32Å; L241-S245 WeakPolarHBondContact O-CB 3.48Å; L241-S245 PolarHBondContact O-N 2.72Å; L241-S245 PolarHBondContact O-OG 3.43Å
242	R	87.9	Confident	87.2	Confident	51 Å²	51	68.8 Å²	68.8	19%	0.192	32%	0.318	C	S	.	.	H	α-helix	trans	-82.1	-38.1	-178.9	-68.3	-176.4	174.6	67.1	0.2	112.8	D183 Q238 V239 R240 S245 K246	D183-R242 WeakPolarHBondContact O-CD 3.21Å; D183-R242 IonicContact OD1-CZ 3.52Å; D183-R242 IonicContact OD1-NE 2.77Å; D183-R242 PolarHBondContact OD1-NE 2.8Å; D183-R242 IonicContact OD1-NH2 3.33Å; D183-R242 PolarHBondContact OD1-NH2 3.33Å; D183-R242 IonicContact OD2-NE 3.32Å; D183-R242 PolarHBondContact OD2-NE 3.29Å; Q238-R242 PolarHBondContact O-NH1 3.13Å; Q238-R242 VanDerWaalsContact OE1-NH1 3.1Å; V239-R242 PolarHBondContact O-N 3.36Å; V239-R242 VanDerWaalsContact O-N 3.14Å; R240-R242 PolarHBondContact O-N 2.82Å; R240-R242 VanDerWaalsContact O-N 3.12Å; R242-S245 PolarHBondContact O-N 2.79Å; R242-K246 WeakPolarHBondContact O-CB 3.26Å; R242-K246 PolarHBondContact O-N 2.81Å
243	R	85.5	Confident	86.4	Confident	90 Å²	90	72.9 Å²	72.9	34%	0.34	34%	0.34	S	S	.	.	H	α-helix	trans	-60.3	-49.5	173.4	-73.3	-172.5	177.1	177.2	3.5	110.6	S73 C75 D151 V239 R240 S245 K246 E247	S73-R243 PolarHBondContact O-NH1 3.16Å; C75-R243 PolarHBondContact O-NH2 3.44Å; C75-R243 VanDerWaalsContact O-NH2 3.14Å; D151-R243 IonicContact OD2-NH2 3.16Å; D151-R243 PolarHBondContact OD2-NH2 3.48Å; V239-R243 HydrophobicContact CG1-CG 4.22Å; V239-R243 PolarHBondContact O-N 2.91Å; R240-R243 PolarHBondContact O-N 2.96Å; R243-S245 VanDerWaalsContact C-N 3.33Å; R243-S245 PolarHBondContact O-N 2.8Å; R243-K246 PolarHBondContact O-N 2.93Å; R243-E247 PolarHBondContact O-N 3.4Å
244	D	81.3	Confident	85.6	Confident	74 Å²	74	73.5 Å²	73.5	40%	0.396	35%	0.351	S	S	.	.	H	α-helix	trans	-61.8	-40.5	179.3	-65.7	-0.5	0	0	0	112.5	R240 K246 K248	R240-D244 VanDerWaalsContact O-CG 3.25Å; R240-D244 PolarHBondContact O-N 3.1Å; D244-K246 VanDerWaalsContact C-N 3.35Å; D244-K248 WeakPolarHBondContact O-CB 3.44Å; D244-K248 VanDerWaalsContact O-CG 3.26Å; D244-K248 WeakPolarHBondContact O-CG 3.29Å; D244-K248 PolarHBondContact O-N 3.45Å
245	S	78.8	Confident	84.6	Confident	74 Å²	74	79.2 Å²	79.2	52%	0.517	37%	0.368	S	S	.	.	H	α-helix	trans	-65.2	-41.1	179.1	-64.9	0	0	0	0	111.4	L241 R242 R243 N249	L241-S245 VanDerWaalsContact O-CB 3.32Å; L241-S245 WeakPolarHBondContact O-CB 3.48Å; L241-S245 PolarHBondContact O-N 2.72Å; L241-S245 PolarHBondContact O-OG 3.43Å; R242-S245 PolarHBondContact O-N 2.79Å; R243-S245 VanDerWaalsContact C-N 3.33Å; R243-S245 PolarHBondContact O-N 2.8Å; S245-N249 WeakPolarHBondContact O-CB 3.14Å; S245-N249 PolarHBondContact O-N 2.89Å; S245-N249 VanDerWaalsContact O-N 3.08Å
246	K	77.8	Confident	83.5	Confident	137 Å²	137	84.5 Å²	84.5	60%	0.596	39%	0.392	S	S	*	.	H	α-helix	trans	-65.2	-47.3	177	-170.6	177.7	178.5	-176.5	0	111.2	R242 R243 D244 K248 N249 E250	R242-K246 WeakPolarHBondContact O-CB 3.26Å; R242-K246 PolarHBondContact O-N 2.81Å; R243-K246 PolarHBondContact O-N 2.93Å; D244-K246 VanDerWaalsContact C-N 3.35Å; K246-K248 PolarHBondContact O-N 2.68Å; K246-N249 WeakPolarHBondContact O-CB 3.3Å; K246-N249 PolarHBondContact O-N 3.26Å; K246-N249 VanDerWaalsContact O-N 3.15Å; K246-E250 VanDerWaalsContact CE-OE1 3.27Å; K246-E250 WeakPolarHBondContact CE-OE1 3.23Å; K246-E250 WeakPolarHBondContact O-CG 3.31Å; K246-E250 PolarHBondContact O-N 2.95Å
247	E	77.5	Confident	82.4	Confident	78 Å²	78	91.7 Å²	91.7	36%	0.364	42%	0.423	S	S	.	.	H	α-helix	trans	-62.3	-43.7	179.5	-164	-162.3	162.4	0	0	112.2	R243 N249 E250 K251	R243-E247 PolarHBondContact O-N 3.4Å; E247-N249 VanDerWaalsContact C-N 3.3Å; E247-N249 PolarHBondContact O-N 3.07Å; E247-E250 PolarHBondContact O-N 3.04Å; E247-K251 HydrophobicContact CG-CD 4.41Å; E247-K251 WeakPolarHBondContact O-CB 3.41Å; E247-K251 WeakPolarHBondContact O-CG 3.44Å; E247-K251 PolarHBondContact O-N 3.42Å; E247-K251 WeakPolarHBondContact OE1-CE 3.29Å; E247-K251 IonicContact OE1-NZ 2.59Å; E247-K251 PolarHBondContact OE1-NZ 2.87Å
248	K	74.1	Confident	81.1	Confident	134 Å²	134	97 Å²	97	58%	0.583	44%	0.444	S	S	*	.	H	α-helix	trans	-60	-40.9	174.3	-75.4	169.1	-176.4	165.1	0	111.7	D244 K246 R252	D244-K248 WeakPolarHBondContact O-CB 3.44Å; D244-K248 VanDerWaalsContact O-CG 3.26Å; D244-K248 WeakPolarHBondContact O-CG 3.29Å; D244-K248 PolarHBondContact O-N 3.45Å; K246-K248 PolarHBondContact O-N 2.68Å; K248-R252 WeakPolarHBondContact O-CG 3.32Å; K248-R252 PolarHBondContact O-N 3.49Å; K248-R252 VanDerWaalsContact O-N 3.09Å
249	N	74.8	Confident	79.5	Confident	92 Å²	92	102.3 Å²	102.3	49%	0.492	46%	0.462	S	S	.	.	H	α-helix	trans	-67	-44.1	178.1	-166.8	23.8	0	0	0	111.7	S245 K246 E247 K251 R252 L253	S245-N249 WeakPolarHBondContact O-CB 3.14Å; S245-N249 PolarHBondContact O-N 2.89Å; S245-N249 VanDerWaalsContact O-N 3.08Å; K246-N249 WeakPolarHBondContact O-CB 3.3Å; K246-N249 PolarHBondContact O-N 3.26Å; K246-N249 VanDerWaalsContact O-N 3.15Å; E247-N249 VanDerWaalsContact C-N 3.3Å; E247-N249 PolarHBondContact O-N 3.07Å; N249-K251 PolarHBondContact O-N 3.4Å; N249-R252 PolarHBondContact O-N 2.97Å; N249-L253 WeakPolarHBondContact O-CG 3.04Å; N249-L253 PolarHBondContact O-N 2.86Å
250	E	80.6	Confident	77.9	Confident	106 Å²	106	108.9 Å²	108.9	50%	0.495	49%	0.492	S	S	.	.	H	α-helix	trans	-61.4	-43.9	176.5	-72.5	175	-174.8	0	0	111.9	K246 E247 R252 L253 A254	K246-E250 VanDerWaalsContact CE-OE1 3.27Å; K246-E250 WeakPolarHBondContact CE-OE1 3.23Å; K246-E250 WeakPolarHBondContact O-CG 3.31Å; K246-E250 PolarHBondContact O-N 2.95Å; E247-E250 PolarHBondContact O-N 3.04Å; E250-R252 VanDerWaalsContact C-N 3.35Å; E250-R252 PolarHBondContact O-N 3.41Å; E250-L253 PolarHBondContact O-N 2.8Å; E250-A254 VanDerWaalsContact O-CB 3.3Å; E250-A254 WeakPolarHBondContact O-CB 3.27Å; E250-A254 PolarHBondContact O-N 3.14Å
251	K	79	Confident	76.3	Confident	124 Å²	124	111.7 Å²	111.7	54%	0.539	52%	0.516	S	S	.	.	H	α-helix	trans	-58.7	-42.8	173.8	-76.8	172.4	170.4	169.1	0	111.9	E247 N249 Y255	E247-K251 HydrophobicContact CG-CD 4.41Å; E247-K251 WeakPolarHBondContact O-CB 3.41Å; E247-K251 WeakPolarHBondContact O-CG 3.44Å; E247-K251 PolarHBondContact O-N 3.42Å; E247-K251 WeakPolarHBondContact OE1-CE 3.29Å; E247-K251 IonicContact OE1-NZ 2.59Å; E247-K251 PolarHBondContact OE1-NZ 2.87Å; N249-K251 PolarHBondContact O-N 3.4Å; K251-Y255 WeakPolarHBondContact O-CB 3.42Å; K251-Y255 PolarHBondContact O-N 2.8Å
252	R	77.3	Confident	74.9	Confident	188 Å²	188	110.5 Å²	110.5	71%	0.709	51%	0.51	S	S	*	.	H	α-helix	trans	-64.7	-46.2	176.4	-72.6	174.8	81.6	172.4	5.4	112	K248 N249 E250 Y255 Q256	K248-R252 WeakPolarHBondContact O-CG 3.32Å; K248-R252 PolarHBondContact O-N 3.49Å; K248-R252 VanDerWaalsContact O-N 3.09Å; N249-R252 PolarHBondContact O-N 2.97Å; E250-R252 VanDerWaalsContact C-N 3.35Å; E250-R252 PolarHBondContact O-N 3.41Å; R252-Y255 PolarHBondContact O-N 3.48Å; R252-Q256 PolarHBondContact O-N 2.86Å
253	L	80.6	Confident	73.8	Confident	87 Å²	87	112.3 Å²	112.3	46%	0.455	53%	0.528	S	S	.	.	H	α-helix	trans	-63.9	-40.5	177.9	-71.2	168.9	0	0	0	111.8	N249 E250 Q256 K257	N249-L253 WeakPolarHBondContact O-CG 3.04Å; N249-L253 PolarHBondContact O-N 2.86Å; E250-L253 PolarHBondContact O-N 2.8Å; L253-Q256 PolarHBondContact O-N 3.04Å; L253-K257 WeakPolarHBondContact O-CG 3.37Å; L253-K257 PolarHBondContact O-N 3.07Å
254	A	79.9	Confident	72.6	Confident	48 Å²	48	116.9 Å²	116.9	40%	0.397	55%	0.55	S	S	.	*	H	α-helix	trans	-63.5	-42.3	175.1	0	0	0	0	0	111.9	E250 Q256 R258	E250-A254 VanDerWaalsContact O-CB 3.3Å; E250-A254 WeakPolarHBondContact O-CB 3.27Å; E250-A254 PolarHBondContact O-N 3.14Å; A254-Q256 VanDerWaalsContact C-N 3.34Å; A254-Q256 PolarHBondContact O-N 2.73Å; A254-R258 WeakPolarHBondContact O-CB 2.98Å; A254-R258 WeakPolarHBondContact O-CG 3.47Å; A254-R258 PolarHBondContact O-N 3.22Å
255	Y	75.9	Confident	71.3	Confident	141 Å²	141	122 Å²	122	55%	0.553	57%	0.569	S	S	*	*	H	α-helix	trans	-62.5	-40.2	174.3	-179.9	-100.1	0	0	0	112	K251 R252 R258 R259	K251-Y255 WeakPolarHBondContact O-CB 3.42Å; K251-Y255 PolarHBondContact O-N 2.8Å; R252-Y255 PolarHBondContact O-N 3.48Å; Y255-R258 PolarHBondContact O-N 3.47Å; Y255-R259 HydrophobicContact CE1-CG 4.28Å; Y255-R259 WeakPolarHBondContact O-CG 3.35Å; Y255-R259 PolarHBondContact O-N 3.08Å; Y255-R259 VanDerWaalsContact O-N 3.13Å; Y255-R259 PolarHBondContact OH-NH1 3.39Å
256	Q	73.5	Confident	70.6	Confident	111 Å²	111	119.9 Å²	119.9	52%	0.519	56%	0.555	S	S	.	*	H	α-helix	trans	-67.6	-45.8	178.4	-166	158	-4.4	0	0	112	R252 L253 A254 R258 R259 E260	R252-Q256 PolarHBondContact O-N 2.86Å; L253-Q256 PolarHBondContact O-N 3.04Å; A254-Q256 VanDerWaalsContact C-N 3.34Å; A254-Q256 PolarHBondContact O-N 2.73Å; Q256-R258 VanDerWaalsContact C-N 3.33Å; Q256-R258 PolarHBondContact O-N 2.81Å; Q256-R259 WeakPolarHBondContact O-CB 3.46Å; Q256-R259 PolarHBondContact O-N 3.49Å; Q256-E260 PolarHBondContact O-N 2.87Å
257	K	73.6	Confident	69.8	Low	152 Å²	152	121.5 Å²	121.5	66%	0.661	56%	0.558	S	S	*	*	H	α-helix	trans	-58.9	-41.8	172.9	-75.1	-178.7	179.8	179.9	0	112.4	L253 R259 E260 S261	L253-K257 WeakPolarHBondContact O-CG 3.37Å; L253-K257 PolarHBondContact O-N 3.07Å; K257-R259 VanDerWaalsContact C-N 3.26Å; K257-R259 PolarHBondContact O-N 3.31Å; K257-E260 PolarHBondContact O-N 2.57Å; K257-S261 WeakPolarHBondContact O-CB 3.07Å; K257-S261 PolarHBondContact O-N 2.86Å; K257-S261 PolarHBondContact O-OG 2.79Å
258	R	70.6	Confident	69	Low	190 Å²	190	127.4 Å²	127.4	72%	0.717	58%	0.577	S	S	*	*	H	α-helix	trans	-62.2	-29.7	174.9	-80.6	-176.2	-176.6	-179.2	2.8	113.1	A254 Y255 Q256 S261 I262	A254-R258 WeakPolarHBondContact O-CB 2.98Å; A254-R258 WeakPolarHBondContact O-CG 3.47Å; A254-R258 PolarHBondContact O-N 3.22Å; Y255-R258 PolarHBondContact O-N 3.47Å; Q256-R258 VanDerWaalsContact C-N 3.33Å; Q256-R258 PolarHBondContact O-N 2.81Å; R258-S261 PolarHBondContact O-OG 3.48Å; R258-I262 VanDerWaalsContact O-CG1 3.3Å; R258-I262 WeakPolarHBondContact O-CG1 3.49Å
259	R	62	Low	68.4	Low	144 Å²	144	127.3 Å²	127.3	54%	0.543	58%	0.577	S	S	.	*	H	α-helix	trans	-79.5	-32.9	176.8	-75	177.5	63.6	156	-4	112.9	Y255 Q256 K257	Y255-R259 HydrophobicContact CE1-CG 4.28Å; Y255-R259 WeakPolarHBondContact O-CG 3.35Å; Y255-R259 PolarHBondContact O-N 3.08Å; Y255-R259 VanDerWaalsContact O-N 3.13Å; Y255-R259 PolarHBondContact OH-NH1 3.39Å; Q256-R259 WeakPolarHBondContact O-CB 3.46Å; Q256-R259 PolarHBondContact O-N 3.49Å; K257-R259 VanDerWaalsContact C-N 3.26Å; K257-R259 PolarHBondContact O-N 3.31Å
260	E	60.7	Low	67.8	Low	142 Å²	142	130.5 Å²	130.5	66%	0.664	58%	0.582	S	S	*	*	H	α-helix	trans	-75.7	-31	177.2	-71	175.8	-178	0	0	112.1	Q256 K257 I262	Q256-E260 PolarHBondContact O-N 2.87Å; K257-E260 PolarHBondContact O-N 2.57Å; E260-I262 VanDerWaalsContact C-N 3.28Å; E260-I262 PolarHBondContact O-N 3.19Å
261	S	58.8	Low	66.7	Low	86 Å²	86	127.6 Å²	127.6	60%	0.601	58%	0.581	S	S	*	*	S	Bend	trans	-78.1	-4.2	176.9	66.3	0	0	0	0	114.7	K257 R258 P263	K257-S261 WeakPolarHBondContact O-CB 3.07Å; K257-S261 PolarHBondContact O-N 2.86Å; K257-S261 PolarHBondContact O-OG 2.79Å; R258-S261 PolarHBondContact O-OG 3.48Å; S261-P263 WeakPolarHBondContact O-CD 3.3Å
262	I	63.2	Low	65.7	Low	72 Å²	72	129.4 Å²	129.4	37%	0.369	59%	0.588	S	S	.	*	S	Bend	trans	-73.7	111.8	172.6	-54.2	176.9	0	0	0	108.3	R258 E260 A266 R267	R258-I262 VanDerWaalsContact O-CG1 3.3Å; R258-I262 WeakPolarHBondContact O-CG1 3.49Å; E260-I262 VanDerWaalsContact C-N 3.28Å; E260-I262 PolarHBondContact O-N 3.19Å; I262-A266 HydrophobicContact CG2-CB 3.68Å; I262-R267 HydrophobicContact CB-CG 4.13Å; I262-R267 HydrophobicContact CG2-CG 3.68Å
263	P	65.6	Low	64.9	Low	88 Å²	88	123.3 Å²	123.3	57%	0.571	57%	0.569	S	S	*	*			trans	-59.6	145.6	-178.6	21	-29.6	0	0	0	110.8	S261 K265 A266 R267	S261-P263 WeakPolarHBondContact O-CD 3.3Å; P263-K265 PolarHBondContact O-N 2.87Å; P263-A266 HydrophobicContact CG-CB 3.98Å; P263-A266 PolarHBondContact O-N 3.29Å; P263-R267 PolarHBondContact O-N 2.88Å
264	K	59.6	Low	64	Low	187 Å²	187	123 Å²	123	81%	0.813	57%	0.57	S	S	*	*	H	α-helix	trans	-49.6	-31.9	-177.7	-69.1	-178.6	179.7	176	0	113.1	R268	K264-R268 PolarHBondContact O-N 3.27Å
265	K	54.7	Low	62.8	Low	182 Å²	182	123.6 Å²	123.6	79%	0.791	58%	0.576	S	S	*	*	H	α-helix	trans	-67.1	-41.7	175.4	-74	-176.9	177.7	178	0	113.1	P263 R268 F269	P263-K265 PolarHBondContact O-N 2.87Å; K265-R268 PolarHBondContact O-N 3.27Å; K265-F269 PolarHBondContact O-N 3.42Å; K265-F269 VanDerWaalsContact O-N 3.07Å
266	A	62.5	Low	61.9	Low	28 Å²	28	125.1 Å²	125.1	23%	0.231	59%	0.585	C	S	.	*	H	α-helix	trans	-69.9	-38.7	177.7	0	0	0	0	0	111.8	I262 P263 R268 F269 W270	I262-A266 HydrophobicContact CG2-CB 3.68Å; P263-A266 HydrophobicContact CG-CB 3.98Å; P263-A266 PolarHBondContact O-N 3.29Å; A266-R268 VanDerWaalsContact C-N 3.32Å; A266-R268 PolarHBondContact O-N 3.48Å; A266-F269 PolarHBondContact O-N 3.06Å; A266-W270 VanDerWaalsContact O-CD1 3.22Å; A266-W270 PolarHBondContact O-N 3.31Å
267	R	61.3	Low	60.9	Low	171 Å²	171	126.4 Å²	126.4	65%	0.645	60%	0.596	S	S	*	*	H	α-helix	trans	-58	-41.5	172.7	-75.7	178.1	65.5	169.2	-1.8	112.5	I262 P263 G271	I262-R267 HydrophobicContact CB-CG 4.13Å; I262-R267 HydrophobicContact CG2-CG 3.68Å; P263-R267 PolarHBondContact O-N 2.88Å; R267-G271 PolarHBondContact O-N 3.22Å; R267-G271 VanDerWaalsContact O-N 3.09Å
268	R	60.9	Low	60	Low	202 Å²	202	123 Å²	123	76%	0.762	59%	0.585	S	S	*	*	H	α-helix	trans	-68.7	-36.8	176.3	-75.9	-176.6	176.1	-179	-0.8	112.7	K264 K265 A266 K272	K264-R268 PolarHBondContact O-N 3.27Å; K265-R268 PolarHBondContact O-N 3.27Å; A266-R268 VanDerWaalsContact C-N 3.32Å; A266-R268 PolarHBondContact O-N 3.48Å; R268-K272 PolarHBondContact O-N 3.24Å
269	F	62.4	Low	59.2	Low	133 Å²	133	122.5 Å²	122.5	58%	0.583	59%	0.588	S	S	*	*	H	α-helix	trans	-68.5	-46.7	178.5	-172.9	-108.9	0	0	0	111.8	K265 A266 G271 K272 I273	K265-F269 PolarHBondContact O-N 3.42Å; K265-F269 VanDerWaalsContact O-N 3.07Å; A266-F269 PolarHBondContact O-N 3.06Å; F269-G271 VanDerWaalsContact C-N 3.35Å; F269-G271 PolarHBondContact O-N 2.97Å; F269-K272 PolarHBondContact O-N 3.33Å; F269-K272 VanDerWaalsContact O-N 3.13Å; F269-I273 HydrophobicContact CD1-CD1 3.62Å; F269-I273 HydrophobicContact CE1-CD1 3.24Å; F269-I273 HydrophobicContact CE1-CG1 4.42Å; F269-I273 HydrophobicContact CE2-CD1 4.33Å; F269-I273 HydrophobicContact CG-CD1 4.33Å; F269-I273 HydrophobicContact CZ-CD1 3.64Å; F269-I273 WeakPolarHBondContact O-CG1 3.24Å; F269-I273 PolarHBondContact O-N 3.14Å
270	W	60.3	Low	58.8	Low	159 Å²	159	122.6 Å²	122.6	60%	0.602	60%	0.599	S	S	*	*	H	α-helix	trans	-62.7	-38.9	174.6	-80	102.8	0	0	0	112.6	A266 K272 I273 V274	A266-W270 VanDerWaalsContact O-CD1 3.22Å; A266-W270 PolarHBondContact O-N 3.31Å; W270-K272 VanDerWaalsContact C-N 3.29Å; W270-K272 PolarHBondContact O-N 3.07Å; W270-I273 PolarHBondContact O-N 3.31Å; W270-V274 WeakPolarHBondContact O-CG2 3.46Å; W270-V274 PolarHBondContact O-N 3.36Å
271	G	58.8	Low	58.2	Low	45 Å²	45	121.8 Å²	121.8	46%	0.464	60%	0.597	S	S	.	*	H	α-helix	trans	-60.3	-35.1	172.9	0	0	0	0	0	113.7	R267 F269 A275	R267-G271 PolarHBondContact O-N 3.22Å; R267-G271 VanDerWaalsContact O-N 3.09Å; F269-G271 VanDerWaalsContact C-N 3.35Å; F269-G271 PolarHBondContact O-N 2.97Å; G271-A275 WeakPolarHBondContact O-CB 3.41Å; G271-A275 PolarHBondContact O-N 3.01Å
272	K	58.5	Low	57.6	Low	162 Å²	162	121.2 Å²	121.2	70%	0.704	60%	0.597	S	S	*	*	H	α-helix	trans	-74.2	-33.3	175.1	-76.4	-177.5	177.7	-176.4	0	113.1	R268 F269 W270 K276	R268-K272 PolarHBondContact O-N 3.24Å; F269-K272 PolarHBondContact O-N 3.33Å; F269-K272 VanDerWaalsContact O-N 3.13Å; W270-K272 VanDerWaalsContact C-N 3.29Å; W270-K272 PolarHBondContact O-N 3.07Å; K272-K276 WeakPolarHBondContact O-CB 3.39Å; K272-K276 PolarHBondContact O-N 3.08Å
273	I	60.2	Low	56.6	Low	59 Å²	59	127.1 Å²	127.1	30%	0.303	62%	0.621	S	S	.	*	H	α-helix	trans	-74.4	-44.6	179.2	-68.7	172.8	0	0	0	111.3	F269 W270 A275 K276 N277	F269-I273 HydrophobicContact CD1-CD1 3.62Å; F269-I273 HydrophobicContact CE1-CD1 3.24Å; F269-I273 HydrophobicContact CE1-CG1 4.42Å; F269-I273 HydrophobicContact CE2-CD1 4.33Å; F269-I273 HydrophobicContact CG-CD1 4.33Å; F269-I273 HydrophobicContact CZ-CD1 3.64Å; F269-I273 WeakPolarHBondContact O-CG1 3.24Å; F269-I273 PolarHBondContact O-N 3.14Å; W270-I273 PolarHBondContact O-N 3.31Å; I273-A275 VanDerWaalsContact C-N 3.31Å; I273-A275 PolarHBondContact O-N 3.32Å; I273-K276 PolarHBondContact O-N 3.15Å; I273-K276 VanDerWaalsContact O-N 3.1Å; I273-N277 PolarHBondContact O-N 3.08Å; I273-N277 VanDerWaalsContact O-N 3.15Å
274	V	60.8	Low	55.5	Low	80 Å²	80	132.5 Å²	132.5	49%	0.485	64%	0.635	S	S	.	*	H	α-helix	trans	-64.2	-37.6	178.3	175.6	0	0	0	0	111.2	W270 K276 N278	W270-V274 WeakPolarHBondContact O-CG2 3.46Å; W270-V274 PolarHBondContact O-N 3.36Å; V274-K276 VanDerWaalsContact C-N 3.29Å; V274-K276 PolarHBondContact O-N 3.13Å; V274-N278 PolarHBondContact O-N 2.85Å
275	A	55.3	Low	54.6	Low	61 Å²	61	131.1 Å²	131.1	50%	0.504	64%	0.636	S	S	.	*	H	α-helix	trans	-68.3	-24.8	174.4	0	0	0	0	0	113.8	G271 I273	G271-A275 WeakPolarHBondContact O-CB 3.41Å; G271-A275 PolarHBondContact O-N 3.01Å; I273-A275 VanDerWaalsContact C-N 3.31Å; I273-A275 PolarHBondContact O-N 3.32Å
276	K	55.9	Low	54	Low	173 Å²	173	131.9 Å²	131.9	75%	0.752	64%	0.639	S	S	*	*	H	α-helix	trans	-83.5	-29.3	179.9	-161.7	175.1	-179.2	-177.3	0	112.5	K272 I273 V274	K272-K276 WeakPolarHBondContact O-CB 3.39Å; K272-K276 PolarHBondContact O-N 3.08Å; I273-K276 PolarHBondContact O-N 3.15Å; I273-K276 VanDerWaalsContact O-N 3.1Å; V274-K276 VanDerWaalsContact C-N 3.29Å; V274-K276 PolarHBondContact O-N 3.13Å
277	N	53.5	Low	53	Low	138 Å²	138	135.8 Å²	135.8	74%	0.738	67%	0.665	S	S	*	*	H	α-helix	trans	-97.4	-8.2	-176.9	-75.9	6.8	0	0	0	114.8	I273	I273-N277 PolarHBondContact O-N 3.08Å; I273-N277 VanDerWaalsContact O-N 3.15Å
278	N	53.6	Low	52.1	Low	81 Å²	81	136.4 Å²	136.4	43%	0.433	67%	0.672	S	S	.	*			trans	-140	90.9	176.3	-156.7	-9.5	0	0	0	111.9	V274 N280 M281	V274-N278 PolarHBondContact O-N 2.85Å; N278-N280 PolarHBondContact O-N 3Å; N278-M281 PolarHBondContact O-N 3.15Å
279	K	54.7	Low	51.3	Low	180 Å²	180	132 Å²	132	78%	0.783	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.9	-16.8	-177.2	-67.2	-178.4	-179.2	177.3	0	113.6
280	N	53.3	Low	50.5	Low	146 Å²	146	130.7 Å²	130.7	78%	0.781	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.9	-13.5	-176.9	-69.7	-7.4	0	0	0	114.8	N278	N278-N280 PolarHBondContact O-N 3Å
281	M	49.2	Very low	49.7	Very low	124 Å²	124	131.1 Å²	131.1	61%	0.611	69%	0.687	S	S	*	*	S	Bend	trans	-89	-11.8	175.5	-87.4	-156.8	86.2	0	0	114.2	N278 F283	N278-M281 PolarHBondContact O-N 3.15Å; M281-F283 PolarHBondContact O-N 3.07Å; M281-F283 VanDerWaalsContact O-N 3.12Å
282	A	44.6	Very low	49.1	Very low	74 Å²	74	135.7 Å²	135.7	61%	0.612	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	-14.2	-179	0	0	0	0	0	113.7
283	F	42.1	Very low	48.2	Very low	197 Å²	197	136.1 Å²	136.1	86%	0.864	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.5	-4.7	-174.5	-110	-86.8	0	0	0	116.2	M281	M281-F283 PolarHBondContact O-N 3.07Å; M281-F283 VanDerWaalsContact O-N 3.12Å
284	K	43.3	Very low	47.4	Very low	200 Å²	200	137.8 Å²	137.8	87%	0.87	73%	0.727	S	S	*	*	S	Bend	trans	-112.3	11.3	-174.5	-126.5	176.7	-176.1	177.7	0	116.4
285	L	40.6	Very low	46.5	Very low	159 Å²	159	139.8 Å²	139.8	83%	0.832	74%	0.739	S	S	*	*	S	Bend	trans	-107.5	18.5	178.2	-98.1	160.8	0	0	0	114.7
286	K	43	Very low	45.9	Very low	197 Å²	197	148.4 Å²	148.4	86%	0.857	78%	0.775	S	S	*	*			trans	-128	86.5	170.7	-79.3	-171.9	176	-178.4	0	111.3
287	S	40.6	Very low	45.4	Very low	111 Å²	111	147.2 Å²	147.2	78%	0.776	78%	0.776	S	S	*	*			trans	-179.6	134.1	144	-78.3	0	0	0	0	107.7
288	K	42.4	Very low	44.9	Very low	183 Å²	183	147.6 Å²	147.6	80%	0.796	78%	0.778	S	S	*	*			cis	-163.2	126.6	-13.4	-111.8	172.7	-179.7	179.5	0	102.3
289	S	44.2	Very low	44.4	Very low	111 Å²	111	151.3 Å²	151.3	78%	0.776	80%	0.797	S	S	*	*			trans	-73.4	120.6	162.1	175.5	0	0	0	0	107
290	C	45.9	Very low	43.8	Very low	105 Å²	105	149.6 Å²	149.6	71%	0.709	80%	0.798	S	S	*	*			trans	-130.3	102	160.5	-63.5	0	0	0	0	103.4
291	H	43.6	Very low	43.3	Very low	168 Å²	168	149.9 Å²	149.9	78%	0.778	80%	0.799	S	S	*	*				60.8	101.9	93.9	-74.2	16.9	0	0	0	111.8
292	D	46.3	Very low	42.9	Very low	141 Å²	141	151.6 Å²	151.6	75%	0.754	81%	0.812	S	S	*	*				46.9	106.4	126.8	-142.5	3.7	0	0	0	117.5
293	L	38.8	Very low	42.7	Very low	170 Å²	170	157.1 Å²	157.1	89%	0.89	83%	0.826	S	S	*	*			trans	-139.6	87.9	152	-94.1	167.7	0	0	0	107.7
294	S	43.6	Very low	42.8	Very low	95 Å²	95	154.1 Å²	154.1	66%	0.664	82%	0.823	S	S	*	*			trans	-81.9	123.6	144	46.8	0	0	0	0	107.7
295	V	41	Very low	42.7	Very low	121 Å²	121	150.3 Å²	150.3	73%	0.733	82%	0.819	S	S	*	*			trans	-159	120.5	145	-177.6	0	0	0	0	108.3
296	L	42.9	Very low	42.9	Very low	242 Å²	242	149.5 Å²	149.5	100%	1.267	82%	0.818	S	S	*	*			trans	47.2	0	159.9	-62.2	169.2	0	0	0	120.2

Retrieved 296 of 296 residues in 142.1 ms (Link to these results)

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