A0A096MZ71_PAPAN Loading...

Calcium binding protein 2

AlphaFold DB (A0A2K5XH73), UniProt , Accession A0A096MZ71, Species PAPAN (Papio anubis, Olive baboon), Gene CABP2, Length 220 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	39.5	Very low	251 Å²	251	183.9 Å²	183.9	100%	1.236	90%	0.897	S	S	*	*				0	115	0	-63.6	131.5	150.1	0	0	106.3
2	G	37.1	Very low	39.6	Very low	72 Å²	72	173.7 Å²	173.7	74%	0.742	87%	0.874	S	S	*	*			cis	143.3	105.4	10.8	0	0	0	0	0	108.2
3	N	34.5	Very low	39.5	Very low	167 Å²	167	170.2 Å²	170.2	89%	0.893	87%	0.871	S	S	*	*			trans	60.3	159.1	154.4	-80.8	7.2	0	0	0	120.3
4	C	39.7	Very low	39.6	Very low	118 Å²	118	171.6 Å²	171.6	80%	0.797	87%	0.868	S	S	*	*			cis	-172.5	166.1	-24.7	-157.2	0	0	0	0	107.1
5	A	43.2	Very low	39.7	Very low	84 Å²	84	170.3 Å²	170.3	69%	0.694	86%	0.864	S	S	*	*			trans	-50.5	157.1	-172.2	0	0	0	0	0	119.9
6	K	39.2	Very low	39.6	Very low	210 Å²	210	166.8 Å²	166.8	91%	0.913	86%	0.856	S	S	*	*				177.8	136.4	115.5	-94.2	171.9	-172.7	-176.1	0	113.9
7	R	44.3	Very low	39.5	Very low	245 Å²	245	170.9 Å²	170.9	93%	0.925	86%	0.859	S	S	*	*			trans	-84.7	158.4	169.4	-74.2	178.7	169.5	-134.7	0.7	111.6
8	P	42	Very low	39.3	Very low	131 Å²	131	170.2 Å²	170.2	85%	0.851	85%	0.852	S	S	*	*			trans	-105	152.2	151.8	22.9	-5.8	0	0	0	113.1
9	R	39	Very low	39.1	Very low	248 Å²	248	173.3 Å²	173.3	94%	0.936	85%	0.853	S	S	*	*			trans	-89.3	148.6	-169.5	-77.4	177.5	155.9	-154.1	-4.7	113.2
10	R	37.8	Very low	38.7	Very low	252 Å²	252	173.5 Å²	173.5	95%	0.951	86%	0.857	S	S	*	*			trans	-66.6	144.7	163.5	-68.2	-177.3	171.6	-140.3	-1.6	111.2
11	R	38.8	Very low	38.5	Very low	245 Å²	245	168.9 Å²	168.9	93%	0.925	85%	0.854	S	S	*	*			trans	-119.7	120.8	165.2	-124.1	-178.4	-164.9	-151.2	5.6	108.1
12	G	40.8	Very low	38.4	Very low	61 Å²	61	162.9 Å²	162.9	63%	0.629	84%	0.837	S	S	*	*			trans	-91.9	176.2	171.3	0	0	0	0	0	112
13	P	38.7	Very low	38.9	Very low	129 Å²	129	165 Å²	165	84%	0.838	84%	0.838	S	S	*	*			trans	-76.6	156.8	-170.1	32.4	-33.6	0	0	0	112
14	K	41.3	Very low	39.2	Very low	190 Å²	190	163.4 Å²	163.4	83%	0.826	84%	0.836	S	S	*	*			trans	-117.8	120.8	175.2	-77	-171.7	170.5	-168.2	0	109.7
15	D	40.8	Very low	38.9	Very low	151 Å²	151	170 Å²	170	81%	0.807	84%	0.844	S	S	*	*			trans	-67.5	142.3	169.3	-55.6	-76.5	0	0	0	111.8
16	P	37.1	Very low	38.3	Very low	114 Å²	114	169.3 Å²	169.3	74%	0.74	85%	0.846	S	S	*	*			trans	-93.9	1.6	-180	-7.7	27.2	0	0	0	116.7	Q18	P16-Q18 PolarHBondContact O-N 3.27Å
17	W	39.1	Very low	38	Very low	238 Å²	238	165.4 Å²	165.4	90%	0.902	85%	0.845	S	S	*	*			trans	-99.8	73.9	-171.9	-61.4	110.4	0	0	0	114.3
18	Q	36	Very low	37.2	Very low	157 Å²	157	159.6 Å²	159.6	73%	0.734	84%	0.84	S	S	*	*			trans	-148.8	118	160.3	-60	-173.1	5.4	0	0	106.4	P16	P16-Q18 PolarHBondContact O-N 3.27Å
19	W	34.3	Very low	36.8	Very low	229 Å²	229	159.4 Å²	159.4	87%	0.867	84%	0.839	S	S	*	*				-173	137.5	74.4	-86.3	89.8	0	0	0	111.7
20	L	32.6	Very low	36.6	Very low	177 Å²	177	152.9 Å²	152.9	93%	0.927	83%	0.832	S	S	*	*			trans	-96.1	137.3	158.3	-95.1	128.2	0	0	0	108.9
21	G	33	Very low	36.9	Very low	78 Å²	78	146.4 Å²	146.4	80%	0.804	82%	0.822	S	S	*	*			trans	178.6	120.9	171.2	0	0	0	0	0	114.5
22	S	37.3	Very low	36.5	Very low	124 Å²	124	140 Å²	140	87%	0.867	82%	0.815	S	S	*	*			trans	-77.2	176.9	-169.2	-51.5	0	0	0	0	116.2
23	P	47.1	Very low	36	Very low	118 Å²	118	143.1 Å²	143.1	77%	0.766	83%	0.827	S	S	*	*			trans	-108.6	-173.5	-151.7	43.4	-37.1	0	0	0	115.7
24	P	41.3	Very low	35.6	Very low	132 Å²	132	142.6 Å²	142.6	86%	0.857	83%	0.827	S	S	*	*			trans	-132.4	165	147.1	34.4	-17.9	0	0	0	116.3
25	R	33.1	Very low	35.7	Very low	256 Å²	256	139.3 Å²	139.3	97%	0.966	83%	0.825	S	S	*	*			trans	-69.8	156.9	-172.4	-68.8	170.1	172.9	-116.9	-2.6	116
26	G	31	Very low	35.1	Very low	71 Å²	71	141.6 Å²	141.6	73%	0.732	83%	0.827	S	S	*	*			trans	157.7	103.3	145.2	0	0	0	0	0	118.9
27	S	31.7	Very low	35.3	Very low	128 Å²	128	145.1 Å²	145.1	90%	0.895	83%	0.834	S	S	*	*			trans	70.6	124.2	139.6	-51.9	0	0	0	0	123.5
28	C	28.6	Very low	34.9	Very low	122 Å²	122	142.2 Å²	142.2	82%	0.824	83%	0.83	S	S	*	*			trans	-85.5	156.6	161.6	-58.8	0	0	0	0	111.7
29	P	34.2	Very low	35.2	Very low	128 Å²	128	139 Å²	139	83%	0.831	84%	0.84	S	S	*	*				-146.4	162.4	98.5	35.6	-17.9	0	0	0	115.9
30	S	33.7	Very low	35	Very low	111 Å²	111	132.5 Å²	132.5	78%	0.776	84%	0.835	S	S	*	*			trans	-95.9	179.5	171	-22.8	0	0	0	0	111
31	P	44.7	Very low	35.1	Very low	115 Å²	115	130 Å²	130	75%	0.747	83%	0.829	S	S	*	*			cis	-140.4	177.1	1.3	37.7	-16.6	0	0	0	117.1
32	S	30.7	Very low	35	Very low	111 Å²	111	136.9 Å²	136.9	78%	0.776	83%	0.831	S	S	*	*			trans	85.5	112.8	153.8	76.1	0	0	0	0	119.9
33	S	29.2	Very low	34.8	Very low	126 Å²	126	137 Å²	137	88%	0.881	83%	0.828	S	S	*	*			trans	161.7	111.7	133.8	-67.3	0	0	0	0	110
34	S	31.8	Very low	34.4	Very low	119 Å²	119	134.3 Å²	134.3	83%	0.832	82%	0.822	S	S	*	*			trans	-94.7	168.2	164.1	-64.8	0	0	0	0	109.9
35	P	42.6	Very low	34.3	Very low	121 Å²	121	133.7 Å²	133.7	79%	0.786	81%	0.811	S	S	*	*			cis	-128.1	146.9	-18.2	30.8	-12.6	0	0	0	112.3
36	K	29.2	Very low	34.4	Very low	198 Å²	198	130.6 Å²	130.6	86%	0.861	81%	0.807	S	S	*	*			trans	-137.3	117.4	153.3	-92.2	-168.9	177.2	-177.5	0	110.4
37	E	40.8	Very low	34.7	Very low	188 Å²	188	129.5 Å²	129.5	88%	0.879	80%	0.796	S	S	*	*			trans	-46	126.1	165.2	-154.2	-168.1	125.8	0	0	111.1
38	Q	30.4	Very low	34.9	Very low	178 Å²	178	130 Å²	130	83%	0.832	78%	0.779	S	S	*	*			trans	-167.9	124.2	159.7	-107.8	155.3	83.3	0	0	109.4
39	G	41.8	Very low	35	Very low	90 Å²	90	128.7 Å²	128.7	93%	0.928	77%	0.771	S	S	*	*			trans	-62.6	141.9	-170.9	0	0	0	0	0	114.4
40	A	30.8	Very low	35.2	Very low	92 Å²	92	128.4 Å²	128.4	76%	0.76	77%	0.767	S	S	*	*			trans	-131	151.6	167.4	0	0	0	0	0	108.9
41	P	33.9	Very low	35.4	Very low	123 Å²	123	128.8 Å²	128.8	80%	0.799	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-76.2	148.5	-161.4	30.9	-33.6	0	0	0	112.8
42	R	30.5	Very low	34.9	Very low	224 Å²	224	129.6 Å²	129.6	85%	0.845	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-49.9	128	178.1	-64.6	176.5	168.2	-162	-7.7	111.3	G44	R42-G44 PolarHBondContact O-N 2.78Å
43	P	34	Very low	35.1	Very low	125 Å²	125	129.4 Å²	129.4	81%	0.812	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-72.5	121.5	166.2	-7.1	23.4	0	0	0	108.7
44	G	37.8	Very low	35.3	Very low	63 Å²	63	131 Å²	131	65%	0.649	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-53.7	140.6	176.5	0	0	0	0	0	112.5	R42 Q46	R42-G44 PolarHBondContact O-N 2.78Å; G44-Q46 PolarHBondContact O-N 3.46Å
45	I	39.8	Very low	35.5	Very low	119 Å²	119	129.1 Å²	129.1	61%	0.61	74%	0.737	S	S	*	*			trans	-68.9	110.6	-176.6	-54.7	171.4	0	0	0	108.3	Y48	I45-Y48 HydrophobicContact CB-CE2 3.62Å; I45-Y48 VanDerWaalsContact CB-OH 3.26Å; I45-Y48 WeakPolarHBondContact CB-OH 3.25Å; I45-Y48 WeakPolarHBondContact CD1-OH 3.31Å; I45-Y48 HydrophobicContact CG2-CD2 4.2Å; I45-Y48 HydrophobicContact CG2-CE1 3.83Å; I45-Y48 HydrophobicContact CG2-CE2 3.39Å; I45-Y48 WeakPolarHBondContact CG2-OH 3.33Å; I45-Y48 VanDerWaalsContact O-CE2 3.24Å; I45-Y48 WeakPolarHBondContact O-CE2 3.38Å
46	Q	36.1	Very low	35.2	Very low	190 Å²	190	125.7 Å²	125.7	89%	0.888	72%	0.724	S	S	*	*			trans	-103.9	22.6	173.7	-95	179.4	63.9	0	0	112.1	G44	G44-Q46 PolarHBondContact O-N 3.46Å
47	G	36.6	Very low	35.6	Very low	48 Å²	48	122 Å²	122	50%	0.495	72%	0.72	S	S	.	*			trans	-89	-8.7	-171.4	0	0	0	0	0	116.4	S49	G47-S49 VanDerWaalsContact C-N 3.26Å; G47-S49 PolarHBondContact O-N 3.43Å; G47-S49 VanDerWaalsContact O-N 3.17Å
48	Y	34.9	Very low	35.2	Very low	139 Å²	139	117 Å²	117	55%	0.545	71%	0.711	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.9	-2.4	-163.7	-49	-72.8	0	0	0	115.5	I45 V50	I45-Y48 HydrophobicContact CB-CE2 3.62Å; I45-Y48 VanDerWaalsContact CB-OH 3.26Å; I45-Y48 WeakPolarHBondContact CB-OH 3.25Å; I45-Y48 WeakPolarHBondContact CD1-OH 3.31Å; I45-Y48 HydrophobicContact CG2-CD2 4.2Å; I45-Y48 HydrophobicContact CG2-CE1 3.83Å; I45-Y48 HydrophobicContact CG2-CE2 3.39Å; I45-Y48 WeakPolarHBondContact CG2-OH 3.33Å; I45-Y48 VanDerWaalsContact O-CE2 3.24Å; I45-Y48 WeakPolarHBondContact O-CE2 3.38Å; Y48-V50 PolarHBondContact O-N 3.17Å
49	S	32.5	Very low	35.6	Very low	94 Å²	94	110.6 Å²	110.6	66%	0.657	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	-13.1	-170.8	-50.3	0	0	0	0	114.7	G47	G47-S49 VanDerWaalsContact C-N 3.26Å; G47-S49 PolarHBondContact O-N 3.43Å; G47-S49 VanDerWaalsContact O-N 3.17Å
50	V	37.5	Very low	35.5	Very low	122 Å²	122	108.1 Å²	108.1	74%	0.739	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	-26.9	-173.6	-137.1	0	0	0	0	113.1	Y48	Y48-V50 PolarHBondContact O-N 3.17Å
51	L	38.1	Very low	36	Very low	119 Å²	119	107.8 Å²	107.8	62%	0.623	63%	0.632	S	S	*	*	G	3₁₀ helix	trans	-84.4	-21.6	-179.5	-60.4	177.6	0	0	0	113	S53	L51-S53 PolarHBondContact O-N 2.92Å
52	N	34.6	Very low	36	Very low	133 Å²	133	106.5 Å²	106.5	71%	0.711	62%	0.618	S	S	*	*	G	3₁₀ helix	trans	-70.5	-10.9	176.8	-89.8	6.3	0	0	0	114.5
53	S	33.3	Very low	36.5	Very low	106 Å²	106	103.2 Å²	103.2	74%	0.741	61%	0.606	S	S	*	*	G	3₁₀ helix	trans	-98	-10.7	-173	-65.2	0	0	0	0	114.9	L51	L51-S53 PolarHBondContact O-N 2.92Å
54	L	34.7	Very low	36.8	Very low	161 Å²	161	100 Å²	100	84%	0.843	59%	0.585	S	S	*	*	S	Bend	trans	-102.9	-14.7	-173.1	-151.2	72	0	0	0	114.1
55	V	36.3	Very low	36.6	Very low	78 Å²	78	99 Å²	99	47%	0.473	57%	0.568	S	S	.	*	S	Bend	trans	-135.4	114.7	-172.2	-147.1	0	0	0	0	108.8	C59	V55-C59 HydrophobicContact CB-CB 4Å; V55-C59 HydrophobicContact CG1-CB 3.32Å; V55-C59 WeakPolarHBondContact CG1-SG 3.45Å
56	G	34.7	Very low	36.4	Very low	50 Å²	50	97 Å²	97	52%	0.515	56%	0.557	S	S	.	*			trans	-61.8	177.5	-176.1	0	0	0	0	0	113.4	A58 C59	G56-A58 PolarHBondContact O-N 3.44Å; G56-C59 PolarHBondContact O-N 3.25Å
57	P	37.9	Very low	36.3	Very low	119 Å²	119	89.4 Å²	89.4	77%	0.773	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-9.5	-170.8	18.9	-30.2	0	0	0	115.7	C59 I60	P57-C59 VanDerWaalsContact C-N 3.32Å; P57-C59 PolarHBondContact O-N 3.1Å; P57-I60 WeakPolarHBondContact O-CG1 3.28Å
58	A	32.7	Very low	36.2	Very low	83 Å²	83	90.6 Å²	90.6	69%	0.686	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	1.7	178.6	0	0	0	0	0	115	G56	G56-A58 PolarHBondContact O-N 3.44Å
59	C	38.3	Very low	36.1	Very low	44 Å²	44	89.1 Å²	89.1	30%	0.297	54%	0.538	S	S	.	.			trans	-104	24.9	-171.3	-72.1	0	0	0	0	116	V55 G56 P57 F61 L62	V55-C59 HydrophobicContact CB-CB 4Å; V55-C59 HydrophobicContact CG1-CB 3.32Å; V55-C59 WeakPolarHBondContact CG1-SG 3.45Å; G56-C59 PolarHBondContact O-N 3.25Å; P57-C59 VanDerWaalsContact C-N 3.32Å; P57-C59 PolarHBondContact O-N 3.1Å; C59-F61 PolarHBondContact O-N 2.63Å; C59-F61 VanDerWaalsContact O-N 3.12Å; C59-L62 HydrophobicContact CB-CD1 4.33Å; C59-L62 PolarHBondContact O-N 2.88Å
60	I	39.7	Very low	36.2	Very low	39 Å²	39	90.9 Å²	90.9	20%	0.2	54%	0.536	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-20	169.5	-32.4	177.3	0	0	0	111.6	P57 V85	P57-I60 WeakPolarHBondContact O-CG1 3.28Å; I60-V85 HydrophobicContact CD1-CG1 4.35Å
61	F	42.3	Very low	36.1	Very low	84 Å²	84	94.1 Å²	94.1	37%	0.368	55%	0.548	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	-3.9	-174.1	-62.3	-72.6	0	0	0	115.3	C59 L110	C59-F61 PolarHBondContact O-N 2.63Å; C59-F61 VanDerWaalsContact O-N 3.12Å; F61-L110 HydrophobicContact CD1-CD2 3.96Å; F61-L110 HydrophobicContact CE1-CD2 3.12Å; F61-L110 HydrophobicContact CE2-CD2 4.43Å; F61-L110 HydrophobicContact CZ-CD2 3.4Å; F61-L110 VanDerWaalsContact CZ-CD2 3.4Å
62	L	34.3	Very low	35.8	Very low	97 Å²	97	96.2 Å²	96.2	51%	0.508	56%	0.56	S	S	.	*	S	Bend	trans	-96.7	13	-178.4	-74.5	172.6	0	0	0	113.8	C59 E156	C59-L62 HydrophobicContact CB-CD1 4.33Å; C59-L62 PolarHBondContact O-N 2.88Å; L62-E156 HydrophobicContact CD2-CG 4.09Å
63	R	40.5	Very low	36.2	Very low	155 Å²	155	93.2 Å²	93.2	59%	0.585	54%	0.539	S	S	*	.			trans	-114.7	87.7	172.4	-77.5	-176.4	142.8	-176.7	-4.2	111.7
64	P	39.7	Very low	36.7	Very low	58 Å²	58	96.9 Å²	96.9	38%	0.377	54%	0.544	S	S	.	.			trans	-136.8	91.7	151.7	32	-14.5	0	0	0	110.4
65	S	35.1	Very low	37.5	Very low	41 Å²	41	91.7 Å²	91.7	29%	0.287	52%	0.517	S	S	.	.	S	Bend	trans	-162.7	52.9	165	-134.3	0	0	0	0	115.6	M218	S65-M218 WeakPolarHBondContact OG-CE 3.02Å
66	I	35.4	Very low	38.1	Very low	76 Å²	76	92.5 Å²	92.5	39%	0.39	51%	0.511	S	S	.	.	S	Bend	trans	-151.4	23.3	153.5	-28.9	164.5	0	0	0	113.4	L184 L185	I66-L184 HydrophobicContact CD1-CB 3.56Å; I66-L184 HydrophobicContact CD1-CD2 3.71Å; I66-L184 HydrophobicContact CD1-CG 4.18Å; I66-L184 VanDerWaalsContact CD1-O 3.24Å; I66-L184 WeakPolarHBondContact CD1-O 3.4Å; I66-L184 HydrophobicContact CG1-CB 3.97Å; I66-L184 HydrophobicContact CG1-CD2 3.86Å; I66-L184 HydrophobicContact CG1-CG 4.32Å; I66-L184 HydrophobicContact CG2-CB 4.43Å; I66-L185 HydrophobicContact CG2-CD2 3.57Å; I66-L185 HydrophobicContact CG2-CG 4.24Å
67	A	32.7	Very low	38.9	Very low	32 Å²	32	94.1 Å²	94.1	26%	0.264	51%	0.513	S	S	.	.			trans	-142.5	30.4	-172.2	0	0	0	0	0	114.8	T69	A67-T69 PolarHBondContact O-N 2.79Å
68	A	35.5	Very low	39.5	Very low	72 Å²	72	93 Å²	93	60%	0.595	50%	0.497	S	S	*	.			trans	-75	-0.5	177.4	0	0	0	0	0	114.4
69	T	31.4	Very low	40.4	Very low	108 Å²	108	90.9 Å²	90.9	66%	0.663	47%	0.473	S	S	*	.	S	Bend	trans	-107.4	80.5	176.6	48.3	0	0	0	0	111.5	A67	A67-T69 PolarHBondContact O-N 2.79Å
70	Q	34.9	Very low	41.5	Very low	132 Å²	132	91.9 Å²	91.9	62%	0.617	48%	0.475	S	S	*	.			trans	170.3	107.6	141.1	-96.1	161.6	-37.3	0	0	110.7	D72 R73	Q70-D72 PolarHBondContact O-N 3.07Å; Q70-R73 HydrophobicContact CB-CB 3.57Å; Q70-R73 HydrophobicContact CB-CG 3.96Å; Q70-R73 PolarHBondContact O-N 2.84Å; Q70-R73 VanDerWaalsContact OE1-CD 3.23Å
71	L	35.1	Very low	42.5	Very low	190 Å²	190	96 Å²	96	100%	0.995	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	19.4	170.9	-112.1	146.6	0	0	0	114.2
72	D	32.3	Very low	43.3	Very low	163 Å²	163	95 Å²	95	87%	0.872	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-161.9	37	176.2	-141.1	-23.2	0	0	0	109.3	Q70	Q70-D72 PolarHBondContact O-N 3.07Å
73	R	42.6	Very low	44.8	Very low	70 Å²	70	91 Å²	91	26%	0.264	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-84.9	126.2	179.5	-147.6	172.8	80.6	-176.8	-8.9	109.6	Q70 L75 R76 E79	Q70-R73 HydrophobicContact CB-CB 3.57Å; Q70-R73 HydrophobicContact CB-CG 3.96Å; Q70-R73 PolarHBondContact O-N 2.84Å; Q70-R73 VanDerWaalsContact OE1-CD 3.23Å; R73-L75 PolarHBondContact O-N 3.47Å; R73-R76 VanDerWaalsContact NH2-CD 3.34Å; R73-E79 IonicContact CZ-OE2 2.87Å; R73-E79 IonicContact NH2-OE1 3.95Å; R73-E79 PolarHBondContact NH2-OE1 3.48Å; R73-E79 IonicContact NH2-OE2 2.69Å; R73-E79 PolarHBondContact NH2-OE2 3.43Å
74	E	44.2	Very low	46.1	Very low	183 Å²	183	87.9 Å²	87.9	86%	0.855	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-52.5	126.2	157.7	-81.2	176.8	130.6	0	0	108.3	R76	E74-R76 PolarHBondContact O-N 2.79Å
75	L	50.9	Low	47.4	Very low	51 Å²	51	88.9 Å²	88.9	27%	0.267	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-54.6	129.5	176.9	-69.3	161.8	0	0	0	108.5	R73 E79 I80 L83 V137	R73-L75 PolarHBondContact O-N 3.47Å; L75-E79 HydrophobicContact CB-CB 4.43Å; L75-E79 HydrophobicContact CD2-CB 4.22Å; L75-I80 HydrophobicContact CB-CD1 4.23Å; L75-I80 HydrophobicContact CB-CG1 3.74Å; L75-I80 WeakPolarHBondContact O-CD1 3.43Å; L75-L83 HydrophobicContact CD1-CD1 3.77Å; L75-L83 HydrophobicContact CD2-CD1 4.4Å; L75-V137 HydrophobicContact CD1-CG1 3.23Å
76	R	50	Low	49	Very low	96 Å²	96	87.3 Å²	87.3	36%	0.362	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-66.4	153.9	177.5	-70.4	-175.8	-59.5	178.6	-4.7	109.6	R73 E74 E78 E79 I80	R73-R76 VanDerWaalsContact NH2-CD 3.34Å; E74-R76 PolarHBondContact O-N 2.79Å; R76-E78 VanDerWaalsContact CB-OE2 3.3Å; R76-E78 WeakPolarHBondContact CB-OE2 3.39Å; R76-E78 PolarHBondContact O-N 3.24Å; R76-E79 IonicContact CZ-OE1 3.24Å; R76-E79 PolarHBondContact N-OE2 2.77Å; R76-E79 IonicContact NE-OE1 3.77Å; R76-E79 PolarHBondContact NE-OE1 3.17Å; R76-E79 IonicContact NE-OE2 3.86Å; R76-E79 IonicContact NH2-OE1 2.73Å; R76-E79 PolarHBondContact NH2-OE1 3.26Å; R76-E79 WeakPolarHBondContact O-CB 3.41Å; R76-E79 PolarHBondContact O-N 3.33Å; R76-I80 WeakPolarHBondContact O-CG1 3.34Å; R76-I80 PolarHBondContact O-N 2.91Å
77	P	50.4	Low	50.8	Low	84 Å²	84	84.3 Å²	84.3	55%	0.545	44%	0.439	S	S	.	.	H	α-helix	trans	-53.6	-31.1	178.9	18.1	-29.8	0	0	0	113.2	I80 E81	P77-I80 PolarHBondContact O-N 2.98Å; P77-E81 WeakPolarHBondContact O-CG 3.39Å; P77-E81 PolarHBondContact O-N 3.42Å
78	E	51.3	Low	52.7	Low	95 Å²	95	88.1 Å²	88.1	44%	0.444	45%	0.452	S	S	.	.	H	α-helix	trans	-69.1	-37.9	175.8	-56.9	80	-170.1	0	0	112.8	R76 E81 E82	R76-E78 VanDerWaalsContact CB-OE2 3.3Å; R76-E78 WeakPolarHBondContact CB-OE2 3.39Å; R76-E78 PolarHBondContact O-N 3.24Å; E78-E81 PolarHBondContact O-N 3.15Å; E78-E82 WeakPolarHBondContact O-CG 3.41Å; E78-E82 PolarHBondContact O-N 2.99Å
79	E	52.7	Low	54.6	Low	38 Å²	38	89 Å²	89	18%	0.178	44%	0.443	C	S	.	.	H	α-helix	trans	-71.3	-35	176.4	-71.2	153.5	-176.6	0	0	110.6	R73 L75 R76 E82 L83	R73-E79 IonicContact CZ-OE2 2.87Å; R73-E79 IonicContact NH2-OE1 3.95Å; R73-E79 PolarHBondContact NH2-OE1 3.48Å; R73-E79 IonicContact NH2-OE2 2.69Å; R73-E79 PolarHBondContact NH2-OE2 3.43Å; L75-E79 HydrophobicContact CB-CB 4.43Å; L75-E79 HydrophobicContact CD2-CB 4.22Å; R76-E79 IonicContact CZ-OE1 3.24Å; R76-E79 PolarHBondContact N-OE2 2.77Å; R76-E79 IonicContact NE-OE1 3.77Å; R76-E79 PolarHBondContact NE-OE1 3.17Å; R76-E79 IonicContact NE-OE2 3.86Å; R76-E79 IonicContact NH2-OE1 2.73Å; R76-E79 PolarHBondContact NH2-OE1 3.26Å; R76-E79 WeakPolarHBondContact O-CB 3.41Å; R76-E79 PolarHBondContact O-N 3.33Å; E79-E82 PolarHBondContact O-N 3.45Å; E79-L83 WeakPolarHBondContact O-CB 3.3Å; E79-L83 VanDerWaalsContact O-CG 3.29Å; E79-L83 WeakPolarHBondContact O-CG 3.25Å; E79-L83 PolarHBondContact O-N 3.37Å
80	I	60.8	Low	56.5	Low	65 Å²	65	84.7 Å²	84.7	33%	0.333	42%	0.416	S	S	.	.	H	α-helix	trans	-66.1	-41.9	173.1	-63.8	171.9	0	0	0	110.7	L75 R76 P77 E82 L83 Q84 F133	L75-I80 HydrophobicContact CB-CD1 4.23Å; L75-I80 HydrophobicContact CB-CG1 3.74Å; L75-I80 WeakPolarHBondContact O-CD1 3.43Å; R76-I80 WeakPolarHBondContact O-CG1 3.34Å; R76-I80 PolarHBondContact O-N 2.91Å; P77-I80 PolarHBondContact O-N 2.98Å; I80-E82 VanDerWaalsContact C-N 3.35Å; I80-L83 PolarHBondContact O-N 2.78Å; I80-Q84 VanDerWaalsContact O-CB 3.23Å; I80-Q84 WeakPolarHBondContact O-CB 3.5Å; I80-Q84 PolarHBondContact O-N 2.96Å; I80-F133 HydrophobicContact CG2-CE1 4.09Å; I80-F133 HydrophobicContact CG2-CZ 3.99Å
81	E	60.2	Low	58.5	Low	125 Å²	125	78.8 Å²	78.8	58%	0.584	39%	0.389	S	S	*	.	H	α-helix	trans	-62.8	-40.8	174.6	-79.5	-176.7	176.1	0	0	111.7	P77 E78 Q84 V85	P77-E81 WeakPolarHBondContact O-CG 3.39Å; P77-E81 PolarHBondContact O-N 3.42Å; E78-E81 PolarHBondContact O-N 3.15Å; E81-Q84 WeakPolarHBondContact O-CB 3.1Å; E81-Q84 PolarHBondContact O-N 3.1Å; E81-V85 WeakPolarHBondContact O-CG2 3.33Å; E81-V85 PolarHBondContact O-N 3.29Å
82	E	60.4	Low	60.3	Low	63 Å²	63	79.6 Å²	79.6	29%	0.294	38%	0.378	S	S	.	.	H	α-helix	trans	-65.4	-44.1	175.9	-73.5	179	175.7	0	0	111.9	E78 E79 I80 Q84 V85 A86	E78-E82 WeakPolarHBondContact O-CG 3.41Å; E78-E82 PolarHBondContact O-N 2.99Å; E79-E82 PolarHBondContact O-N 3.45Å; I80-E82 VanDerWaalsContact C-N 3.35Å; E82-Q84 VanDerWaalsContact C-N 3.26Å; E82-Q84 PolarHBondContact O-N 2.8Å; E82-V85 PolarHBondContact O-N 3.13Å; E82-A86 WeakPolarHBondContact O-CB 3.5Å; E82-A86 PolarHBondContact O-N 3.43Å
83	L	64.4	Low	62.4	Low	15 Å²	15	76.8 Å²	76.8	8%	0.079	36%	0.363	C	S	.	.	H	α-helix	trans	-62.7	-33.9	172.9	-73.2	168.3	0	0	0	111.8	L75 E79 I80 A86 F87 F133 F136 V137 M140 L144	L75-L83 HydrophobicContact CD1-CD1 3.77Å; L75-L83 HydrophobicContact CD2-CD1 4.4Å; E79-L83 WeakPolarHBondContact O-CB 3.3Å; E79-L83 VanDerWaalsContact O-CG 3.29Å; E79-L83 WeakPolarHBondContact O-CG 3.25Å; E79-L83 PolarHBondContact O-N 3.37Å; I80-L83 PolarHBondContact O-N 2.78Å; L83-A86 PolarHBondContact O-N 3.31Å; L83-F87 VanDerWaalsContact O-CB 3.23Å; L83-F87 WeakPolarHBondContact O-CB 3.5Å; L83-F87 PolarHBondContact O-N 3.29Å; L83-F133 HydrophobicContact CB-CE2 4.31Å; L83-F133 HydrophobicContact CB-CZ 4.49Å; L83-F136 HydrophobicContact CD2-CE1 4.18Å; L83-V137 HydrophobicContact CB-CG2 4.39Å; L83-V137 HydrophobicContact CD1-CG1 4.33Å; L83-V137 HydrophobicContact CD1-CG2 4.12Å; L83-M140 HydrophobicContact CD2-CB 4.43Å; L83-L144 HydrophobicContact CD2-CD1 3.8Å
84	Q	67.3	Low	64.1	Low	89 Å²	89	83.1 Å²	83.1	42%	0.416	39%	0.387	S	S	.	.	H	α-helix	trans	-71	-39	177.4	-170.6	175.3	38	0	0	112.2	I80 E81 E82 F87 Q88 F133	I80-Q84 VanDerWaalsContact O-CB 3.23Å; I80-Q84 WeakPolarHBondContact O-CB 3.5Å; I80-Q84 PolarHBondContact O-N 2.96Å; E81-Q84 WeakPolarHBondContact O-CB 3.1Å; E81-Q84 PolarHBondContact O-N 3.1Å; E82-Q84 VanDerWaalsContact C-N 3.26Å; E82-Q84 PolarHBondContact O-N 2.8Å; Q84-F87 PolarHBondContact O-N 3.06Å; Q84-Q88 WeakPolarHBondContact O-CG 3.43Å; Q84-Q88 PolarHBondContact O-N 3.09Å; Q84-F133 VanDerWaalsContact CA-CE2 3.45Å; Q84-F133 HydrophobicContact CB-CE2 3.84Å; Q84-F133 HydrophobicContact CB-CZ 3.85Å; Q84-F133 HydrophobicContact CG-CE2 4.32Å; Q84-F133 HydrophobicContact CG-CZ 4.41Å
85	V	67.4	Low	65.8	Low	78 Å²	78	77.3 Å²	77.3	47%	0.473	36%	0.362	S	S	.	.	H	α-helix	trans	-66.1	-43.8	173.3	171.8	0	0	0	0	110.3	I60 E81 E82 Q88 E89	I60-V85 HydrophobicContact CD1-CG1 4.35Å; E81-V85 WeakPolarHBondContact O-CG2 3.33Å; E81-V85 PolarHBondContact O-N 3.29Å; E82-V85 PolarHBondContact O-N 3.13Å; V85-Q88 PolarHBondContact O-N 3.12Å; V85-E89 PolarHBondContact O-N 2.97Å
86	A	69.8	Low	67	Low	9 Å²	9	76.6 Å²	76.6	7%	0.074	37%	0.367	C	S	.	.	H	α-helix	trans	-61	-45.4	174.6	0	0	0	0	0	111.2	E82 L83 Q88 E89 F90	E82-A86 WeakPolarHBondContact O-CB 3.5Å; E82-A86 PolarHBondContact O-N 3.43Å; L83-A86 PolarHBondContact O-N 3.31Å; A86-Q88 VanDerWaalsContact C-N 3.33Å; A86-Q88 PolarHBondContact O-N 2.83Å; A86-E89 WeakPolarHBondContact O-CB 3.27Å; A86-E89 PolarHBondContact O-N 3.26Å; A86-F90 HydrophobicContact CB-CD2 4.47Å; A86-F90 HydrophobicContact CB-CE2 4.05Å; A86-F90 WeakPolarHBondContact O-CD2 3.28Å; A86-F90 WeakPolarHBondContact O-CE2 3.36Å; A86-F90 WeakPolarHBondContact O-CG 3.39Å; A86-F90 PolarHBondContact O-N 2.83Å
87	F	72.1	Confident	68.5	Low	12 Å²	12	77 Å²	77	5%	0.053	37%	0.369	C	S	.	.	H	α-helix	trans	-56.5	-46	175.4	-174.4	-90.5	0	0	0	111.6	L83 Q84 E89 F90 D91 G96 I98 F133 F136	L83-F87 VanDerWaalsContact O-CB 3.23Å; L83-F87 WeakPolarHBondContact O-CB 3.5Å; L83-F87 PolarHBondContact O-N 3.29Å; Q84-F87 PolarHBondContact O-N 3.06Å; F87-E89 VanDerWaalsContact C-N 3.26Å; F87-E89 PolarHBondContact O-N 3.1Å; F87-F90 PolarHBondContact O-N 2.91Å; F87-D91 HydrophobicContact CD1-CB 4.35Å; F87-D91 HydrophobicContact CE1-CB 4.15Å; F87-D91 VanDerWaalsContact O-CB 3.27Å; F87-D91 WeakPolarHBondContact O-CB 3.2Å; F87-D91 PolarHBondContact O-N 2.87Å; F87-G96 WeakPolarHBondContact CZ-O 3.06Å; F87-I98 HydrophobicContact CD2-CD1 3.3Å; F87-I98 HydrophobicContact CD2-CG1 3.94Å; F87-I98 HydrophobicContact CE2-CB 4.47Å; F87-I98 HydrophobicContact CE2-CD1 3.45Å; F87-I98 VanDerWaalsContact CE2-CD1 3.45Å; F87-I98 HydrophobicContact CE2-CG1 3.6Å; F87-I98 HydrophobicContact CG-CD1 4.06Å; F87-I98 HydrophobicContact CZ-CD1 4.3Å; F87-I98 HydrophobicContact CZ-CG1 4.01Å; F87-F133 HydrophobicContact CB-CD2 3.84Å; F87-F133 HydrophobicContact CB-CE2 4.16Å; F87-F133 HydrophobicContact CD1-CD2 4.27Å; F87-F133 HydrophobicContact CD2-CB 4.43Å; F87-F133 AromaticContact CD2-CD2 3.96Å; F87-F133 HydrophobicContact CD2-CD2 3.96Å; F87-F133 HydrophobicContact CE1-CB 4.47Å; F87-F133 HydrophobicContact CE2-CB 4.28Å; F87-F133 AromaticContact CG-CD2 3.76Å; F87-F133 HydrophobicContact CG-CD2 3.76Å; F87-F133 HydrophobicContact CZ-CB 4.3Å; F87-F136 HydrophobicContact CB-CD1 4.18Å; F87-F136 HydrophobicContact CB-CE1 4.22Å; F87-F136 HydrophobicContact CD2-CB 3.67Å; F87-F136 AromaticContact CD2-CD1 3.84Å; F87-F136 HydrophobicContact CD2-CD1 3.84Å; F87-F136 HydrophobicContact CD2-CD2 4.17Å; F87-F136 AromaticContact CD2-CG 3.64Å; F87-F136 HydrophobicContact CD2-CG 3.64Å; F87-F136 HydrophobicContact CE2-CB 3.9Å; F87-F136 HydrophobicContact CE2-CG 4.3Å
88	Q	73.7	Confident	69.8	Low	113 Å²	113	73 Å²	73	53%	0.528	34%	0.343	S	S	.	.	H	α-helix	trans	-66.6	-23.7	175.6	-76.1	179.9	21.2	0	0	114.2	Q84 V85 A86	Q84-Q88 WeakPolarHBondContact O-CG 3.43Å; Q84-Q88 PolarHBondContact O-N 3.09Å; V85-Q88 PolarHBondContact O-N 3.12Å; A86-Q88 VanDerWaalsContact C-N 3.33Å; A86-Q88 PolarHBondContact O-N 2.83Å
89	E	74	Confident	70.9	Confident	89 Å²	89	69.4 Å²	69.4	42%	0.416	33%	0.332	S	S	.	.	H	α-helix	trans	-76	-33.7	174.2	-170.3	172.3	115.7	0	0	111.5	V85 A86 F87	V85-E89 PolarHBondContact O-N 2.97Å; A86-E89 WeakPolarHBondContact O-CB 3.27Å; A86-E89 PolarHBondContact O-N 3.26Å; F87-E89 VanDerWaalsContact C-N 3.26Å; F87-E89 PolarHBondContact O-N 3.1Å
90	F	72.8	Confident	72	Confident	18 Å²	18	70 Å²	70	8%	0.079	34%	0.339	C	S	.	.	H	α-helix	trans	-85.1	-36.8	179.5	-61.7	-54.9	0	0	0	113.4	A86 F87 R92 I98 E102 C106 F136	A86-F90 HydrophobicContact CB-CD2 4.47Å; A86-F90 HydrophobicContact CB-CE2 4.05Å; A86-F90 WeakPolarHBondContact O-CD2 3.28Å; A86-F90 WeakPolarHBondContact O-CE2 3.36Å; A86-F90 WeakPolarHBondContact O-CG 3.39Å; A86-F90 PolarHBondContact O-N 2.83Å; F87-F90 PolarHBondContact O-N 2.91Å; F90-R92 VanDerWaalsContact C-N 3.34Å; F90-R92 PolarHBondContact O-N 3.47Å; F90-I98 HydrophobicContact CB-CD1 3.78Å; F90-I98 HydrophobicContact CB-CG1 4.27Å; F90-E102 WeakPolarHBondContact O-CB 3.29Å; F90-E102 WeakPolarHBondContact O-CG 3.27Å; F90-C106 HydrophobicContact CB-CB 4.39Å; F90-C106 HydrophobicContact CD1-CB 3.4Å; F90-C106 VanDerWaalsContact CD1-CB 3.4Å; F90-C106 HydrophobicContact CD2-CB 4.02Å; F90-C106 WeakPolarHBondContact CD2-SG 3.15Å; F90-C106 VanDerWaalsContact CE1-CA 3.43Å; F90-C106 HydrophobicContact CE1-CB 3.59Å; F90-C106 HydrophobicContact CE2-CB 4.19Å; F90-C106 WeakPolarHBondContact CE2-SG 3.16Å; F90-C106 HydrophobicContact CG-CB 3.66Å; F90-C106 HydrophobicContact CZ-CB 3.99Å; F90-C106 WeakPolarHBondContact CZ-SG 3.24Å; F90-F136 HydrophobicContact CD2-CE2 4.16Å; F90-F136 AromaticContact CD2-CZ 3.9Å; F90-F136 HydrophobicContact CD2-CZ 3.9Å; F90-F136 HydrophobicContact CE2-CZ 4.21Å
91	D	76.2	Confident	72.6	Confident	9 Å²	9	77.4 Å²	77.4	5%	0.048	36%	0.363	C	S	.	.			trans	-73.6	82.4	170.8	178.2	6.9	0	0	0	109.6	F87 R94 D95 G96 I98	F87-D91 HydrophobicContact CD1-CB 4.35Å; F87-D91 HydrophobicContact CE1-CB 4.15Å; F87-D91 VanDerWaalsContact O-CB 3.27Å; F87-D91 WeakPolarHBondContact O-CB 3.2Å; F87-D91 PolarHBondContact O-N 2.87Å; D91-R94 PolarHBondContact O-N 3.36Å; D91-R94 WeakPolarHBondContact OD1-CA 3.31Å; D91-R94 PolarHBondContact OD1-N 3.39Å; D91-R94 WeakPolarHBondContact OD2-CA 3.27Å; D91-D95 PolarHBondContact OD1-N 2.83Å; D91-D95 VanDerWaalsContact OD1-N 3.08Å; D91-G96 VanDerWaalsContact OD2-CA 3.27Å; D91-G96 WeakPolarHBondContact OD2-CA 3.26Å; D91-G96 PolarHBondContact OD2-N 3.13Å; D91-I98 HydrophobicContact CB-CG1 4.22Å
92	R	72.1	Confident	73.5	Confident	207 Å²	207	73 Å²	73	78%	0.781	34%	0.343	S	S	*	.	S	Bend	trans	-76.1	-31.7	-172.8	-88.5	-170.2	168.8	139.4	1.3	112.8	F90 R94 E102	F90-R92 VanDerWaalsContact C-N 3.34Å; F90-R92 PolarHBondContact O-N 3.47Å; R92-R94 VanDerWaalsContact C-N 3.28Å; R92-E102 PolarHBondContact N-OE1 2.83Å
93	D	77.4	Confident	74.2	Confident	103 Å²	103	70 Å²	70	55%	0.551	33%	0.329	S	S	*	.	S	Bend	trans	-85.2	-6.3	176.9	62.6	7.3	0	0	0	112.6	D95	D93-D95 PolarHBondContact O-N 2.63Å; D93-D95 PolarHBondContact OD1-N 3.31Å
94	R	77.2	Confident	74.6	Confident	203 Å²	203	69.3 Å²	69.3	77%	0.766	33%	0.325	S	S	*	.			trans	55.8	35	178.4	-60.7	-175.5	179.8	-175.6	-2	111.2	D91 R92 G96	D91-R94 PolarHBondContact O-N 3.36Å; D91-R94 WeakPolarHBondContact OD1-CA 3.31Å; D91-R94 PolarHBondContact OD1-N 3.39Å; D91-R94 WeakPolarHBondContact OD2-CA 3.27Å; R92-R94 VanDerWaalsContact C-N 3.28Å; R94-G96 PolarHBondContact O-N 3.13Å
95	D	81	Confident	74.8	Confident	61 Å²	61	66.5 Å²	66.5	33%	0.326	32%	0.317	S	S	.	.	S	Bend	trans	-81.1	-4.2	178.7	89.5	-10.7	0	0	0	111.8	D91 D93 Y97 K130	D91-D95 PolarHBondContact OD1-N 2.83Å; D91-D95 VanDerWaalsContact OD1-N 3.08Å; D93-D95 PolarHBondContact O-N 2.63Å; D93-D95 PolarHBondContact OD1-N 3.31Å; D95-Y97 VanDerWaalsContact C-N 3.33Å; D95-Y97 VanDerWaalsContact O-CD2 3.3Å; D95-Y97 WeakPolarHBondContact O-CD2 3.39Å; D95-Y97 WeakPolarHBondContact OD1-CA 3.46Å; D95-Y97 VanDerWaalsContact OD1-CB 3.25Å; D95-Y97 WeakPolarHBondContact OD1-CB 3.27Å; D95-Y97 PolarHBondContact OD1-N 3.22Å; D95-K130 IonicContact OD2-NZ 2.63Å; D95-K130 PolarHBondContact OD2-NZ 2.93Å
96	G	76.7	Confident	75	Confident	37 Å²	37	62.8 Å²	62.8	38%	0.381	30%	0.295	S	S	.	.	S	Bend	trans	86.3	6.1	-178.5	0	0	0	0	0	113	F87 D91 R94	F87-G96 WeakPolarHBondContact CZ-O 3.06Å; D91-G96 VanDerWaalsContact OD2-CA 3.27Å; D91-G96 WeakPolarHBondContact OD2-CA 3.26Å; D91-G96 PolarHBondContact OD2-N 3.13Å; R94-G96 PolarHBondContact O-N 3.13Å
97	Y	81.1	Confident	74.8	Confident	104 Å²	104	63.3 Å²	63.3	41%	0.408	30%	0.296	S	S	.	.	S	Bend	trans	-135.6	147.3	-179.1	-56.2	-88.5	0	0	0	111	D95 K130 V131 D132	D95-Y97 VanDerWaalsContact C-N 3.33Å; D95-Y97 VanDerWaalsContact O-CD2 3.3Å; D95-Y97 WeakPolarHBondContact O-CD2 3.39Å; D95-Y97 WeakPolarHBondContact OD1-CA 3.46Å; D95-Y97 VanDerWaalsContact OD1-CB 3.25Å; D95-Y97 WeakPolarHBondContact OD1-CB 3.27Å; D95-Y97 PolarHBondContact OD1-N 3.22Å; Y97-K130 HydrophobicContact CD1-CB 4.02Å; Y97-K130 HydrophobicContact CD1-CD 4.5Å; Y97-K130 HydrophobicContact CD2-CD 4.39Å; Y97-K130 HydrophobicContact CG-CB 4.18Å; Y97-K130 HydrophobicContact CG-CD 4.05Å; Y97-V131 CarbonylContact C-O 3.58Å; Y97-V131 WeakPolarHBondContact CA-O 3.17Å; Y97-D132 HydrophobicContact CD1-CB 3.91Å; Y97-D132 HydrophobicContact CE1-CB 3.92Å
98	I	77.3	Confident	74.5	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	115.9	171.3	-65.1	172.7	0	0	0	107.9	F87 F90 D91 E102 L103 V131 F136	F87-I98 HydrophobicContact CD2-CD1 3.3Å; F87-I98 HydrophobicContact CD2-CG1 3.94Å; F87-I98 HydrophobicContact CE2-CB 4.47Å; F87-I98 HydrophobicContact CE2-CD1 3.45Å; F87-I98 VanDerWaalsContact CE2-CD1 3.45Å; F87-I98 HydrophobicContact CE2-CG1 3.6Å; F87-I98 HydrophobicContact CG-CD1 4.06Å; F87-I98 HydrophobicContact CZ-CD1 4.3Å; F87-I98 HydrophobicContact CZ-CG1 4.01Å; F90-I98 HydrophobicContact CB-CD1 3.78Å; F90-I98 HydrophobicContact CB-CG1 4.27Å; D91-I98 HydrophobicContact CB-CG1 4.22Å; I98-E102 HydrophobicContact CG2-CB 3.69Å; I98-L103 HydrophobicContact CG2-CB 3.9Å; I98-L103 VanDerWaalsContact CG2-N 3.34Å; I98-V131 HydrophobicContact CB-CB 4.19Å; I98-V131 PolarHBondContact N-O 3.18Å; I98-V131 PolarHBondContact O-N 3.22Å; I98-F136 HydrophobicContact CD1-CD2 3.53Å; I98-F136 HydrophobicContact CD1-CE2 3.7Å; I98-F136 HydrophobicContact CD1-CG 4.2Å; I98-F136 HydrophobicContact CD1-CZ 4.5Å
99	G	75.4	Confident	73.9	Confident	19 Å²	19	67.9 Å²	67.9	20%	0.196	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	165.3	174	0	0	0	0	0	112.8	R101 E102 L103	G99-R101 PolarHBondContact O-N 3.22Å; G99-E102 PolarHBondContact N-OE2 2.83Å; G99-E102 PolarHBondContact O-N 3.46Å; G99-L103 PolarHBondContact O-N 2.9Å
100	C	73.8	Confident	72.8	Confident	50 Å²	50	66.7 Å²	66.7	34%	0.338	31%	0.314	S	S	.	.	H	α-helix	trans	-51	-34.1	179.8	-48.6	0	0	0	0	113.7	G104 S123	C100-G104 PolarHBondContact O-N 3.41Å; C100-S123 WeakPolarHBondContact SG-CB 3.17Å; C100-S123 PolarHBondContact SG-OG 2.82Å
101	R	75.4	Confident	71.7	Confident	221 Å²	221	69.1 Å²	69.1	83%	0.834	34%	0.344	S	S	*	.	H	α-helix	trans	-72.7	-37.5	-179.3	-166.3	178	-174.4	-158.7	1.2	112.3	G99 A105	G99-R101 PolarHBondContact O-N 3.22Å; R101-A105 PolarHBondContact O-N 2.82Å; R101-A105 VanDerWaalsContact O-N 3.13Å
102	E	77.6	Confident	70.4	Confident	33 Å²	33	72 Å²	72	15%	0.154	36%	0.355	C	S	.	.	H	α-helix	trans	-76.3	-40.4	177.9	-69.9	162.8	130.2	0	0	110.4	F90 R92 I98 G99 G104 A105 C106	F90-E102 WeakPolarHBondContact O-CB 3.29Å; F90-E102 WeakPolarHBondContact O-CG 3.27Å; R92-E102 PolarHBondContact N-OE1 2.83Å; I98-E102 HydrophobicContact CG2-CB 3.69Å; G99-E102 PolarHBondContact N-OE2 2.83Å; G99-E102 PolarHBondContact O-N 3.46Å; E102-G104 VanDerWaalsContact C-N 3.34Å; E102-G104 PolarHBondContact O-N 2.99Å; E102-A105 CarbonylContact O-C 3.57Å; E102-A105 WeakPolarHBondContact O-CB 3.41Å; E102-A105 PolarHBondContact O-N 3.29Å; E102-A105 VanDerWaalsContact O-N 3.1Å; E102-C106 WeakPolarHBondContact O-CB 3.48Å; E102-C106 PolarHBondContact O-N 3.21Å
103	L	75.1	Confident	69.6	Low	0 Å²	0	70 Å²	70	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-58.2	-46.1	171.4	-176	64.6	0	0	0	111.3	I98 G99 A105 C106 M107 L119 I122 V131 L139	I98-L103 HydrophobicContact CG2-CB 3.9Å; I98-L103 VanDerWaalsContact CG2-N 3.34Å; G99-L103 PolarHBondContact O-N 2.9Å; L103-A105 VanDerWaalsContact C-N 3.3Å; L103-A105 PolarHBondContact O-N 3.13Å; L103-C106 VanDerWaalsContact O-CB 3.29Å; L103-C106 WeakPolarHBondContact O-CB 3.5Å; L103-C106 PolarHBondContact O-N 2.73Å; L103-M107 HydrophobicContact CG-SD 4.27Å; L103-M107 VanDerWaalsContact O-CG 3.31Å; L103-M107 WeakPolarHBondContact O-CG 3.39Å; L103-M107 PolarHBondContact O-N 2.81Å; L103-L119 HydrophobicContact CG-CD2 4.38Å; L103-I122 HydrophobicContact CD2-CB 4.44Å; L103-I122 HydrophobicContact CD2-CG2 3.65Å; L103-V131 HydrophobicContact CD2-CG2 4.24Å; L103-L139 HydrophobicContact CD1-CD2 4.33Å
104	G	72.5	Confident	69	Low	0 Å²	0	65.8 Å²	65.8	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-65.6	-31.7	175.6	0	0	0	0	0	113.7	C100 E102 R108	C100-G104 PolarHBondContact O-N 3.41Å; E102-G104 VanDerWaalsContact C-N 3.34Å; E102-G104 PolarHBondContact O-N 2.99Å; G104-R108 WeakPolarHBondContact O-CG 3.26Å; G104-R108 PolarHBondContact O-N 3.05Å; G104-R108 PolarHBondContact O-NE 2.85Å; G104-R108 PolarHBondContact O-NH1 3.15Å; G104-R108 PolarHBondContact O-NH2 2.83Å
105	A	73.2	Confident	68.9	Low	31 Å²	31	59.8 Å²	59.8	26%	0.256	32%	0.32	S	S	.	.	H	α-helix	trans	-70.2	-41.6	172.4	0	0	0	0	0	111.2	R101 E102 L103 R108 T109	R101-A105 PolarHBondContact O-N 2.82Å; R101-A105 VanDerWaalsContact O-N 3.13Å; E102-A105 CarbonylContact O-C 3.57Å; E102-A105 WeakPolarHBondContact O-CB 3.41Å; E102-A105 PolarHBondContact O-N 3.29Å; E102-A105 VanDerWaalsContact O-N 3.1Å; L103-A105 VanDerWaalsContact C-N 3.3Å; L103-A105 PolarHBondContact O-N 3.13Å; A105-R108 PolarHBondContact O-N 3.25Å; A105-T109 PolarHBondContact O-N 2.84Å; A105-T109 PolarHBondContact O-OG1 3.19Å
106	C	69.9	Low	68.5	Low	0 Å²	0	64.4 Å²	64.4	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-55.6	-56.1	174	175.9	0	0	0	0	111.3	F90 E102 L103 R108 T109 L110	F90-C106 HydrophobicContact CB-CB 4.39Å; F90-C106 HydrophobicContact CD1-CB 3.4Å; F90-C106 VanDerWaalsContact CD1-CB 3.4Å; F90-C106 HydrophobicContact CD2-CB 4.02Å; F90-C106 WeakPolarHBondContact CD2-SG 3.15Å; F90-C106 VanDerWaalsContact CE1-CA 3.43Å; F90-C106 HydrophobicContact CE1-CB 3.59Å; F90-C106 HydrophobicContact CE2-CB 4.19Å; F90-C106 WeakPolarHBondContact CE2-SG 3.16Å; F90-C106 HydrophobicContact CG-CB 3.66Å; F90-C106 HydrophobicContact CZ-CB 3.99Å; F90-C106 WeakPolarHBondContact CZ-SG 3.24Å; E102-C106 WeakPolarHBondContact O-CB 3.48Å; E102-C106 PolarHBondContact O-N 3.21Å; L103-C106 VanDerWaalsContact O-CB 3.29Å; L103-C106 WeakPolarHBondContact O-CB 3.5Å; L103-C106 PolarHBondContact O-N 2.73Å; C106-R108 VanDerWaalsContact C-N 3.28Å; C106-R108 PolarHBondContact O-N 3.48Å; C106-T109 WeakPolarHBondContact O-CB 3.42Å; C106-T109 PolarHBondContact O-N 3.22Å; C106-L110 VanDerWaalsContact O-CG 3.3Å; C106-L110 WeakPolarHBondContact O-CG 3.35Å; C106-L110 PolarHBondContact O-N 2.8Å
107	M	66.8	Low	68.3	Low	19 Å²	19	68.7 Å²	68.7	9%	0.094	35%	0.352	C	S	.	.	H	α-helix	trans	-57.8	-40.1	179.9	-67	175.7	97.9	0	0	112.2	L103 L110 G111 Y112 P114 L119 I122	L103-M107 HydrophobicContact CG-SD 4.27Å; L103-M107 VanDerWaalsContact O-CG 3.31Å; L103-M107 WeakPolarHBondContact O-CG 3.39Å; L103-M107 PolarHBondContact O-N 2.81Å; M107-L110 CarbonylContact O-C 3.57Å; M107-L110 WeakPolarHBondContact O-CB 3.16Å; M107-L110 PolarHBondContact O-N 3.05Å; M107-G111 PolarHBondContact O-N 2.89Å; M107-Y112 CarbonylContact C-O 3.6Å; M107-Y112 HydrophobicContact CB-CD1 4.23Å; M107-Y112 HydrophobicContact CE-CD1 3.51Å; M107-Y112 HydrophobicContact CE-CE1 3.58Å; M107-Y112 CarbonylContact O-C 3.48Å; M107-Y112 WeakPolarHBondContact O-CA 3.34Å; M107-Y112 WeakPolarHBondContact O-CB 3.19Å; M107-Y112 PolarHBondContact O-N 3.44Å; M107-Y112 HydrophobicContact SD-CD1 4.46Å; M107-P114 HydrophobicContact CB-CG 3.85Å; M107-P114 HydrophobicContact CE-CB 4.19Å; M107-P114 HydrophobicContact CG-CG 4.49Å; M107-P114 HydrophobicContact SD-CB 3.96Å; M107-P114 HydrophobicContact SD-CG 3.81Å; M107-L119 HydrophobicContact SD-CD2 3.64Å; M107-I122 HydrophobicContact CE-CD1 3.67Å; M107-I122 HydrophobicContact SD-CD1 4.22Å
108	R	65.6	Low	67.7	Low	129 Å²	129	66.6 Å²	66.6	49%	0.487	35%	0.346	S	S	.	.	H	α-helix	trans	-66.6	-38.3	175.6	-75.2	-172.6	-64.3	-90.7	-3.2	113.5	G104 A105 C106 L110 G111 Y112	G104-R108 WeakPolarHBondContact O-CG 3.26Å; G104-R108 PolarHBondContact O-N 3.05Å; G104-R108 PolarHBondContact O-NE 2.85Å; G104-R108 PolarHBondContact O-NH1 3.15Å; G104-R108 PolarHBondContact O-NH2 2.83Å; A105-R108 PolarHBondContact O-N 3.25Å; C106-R108 VanDerWaalsContact C-N 3.28Å; C106-R108 PolarHBondContact O-N 3.48Å; R108-L110 PolarHBondContact O-N 3.26Å; R108-G111 PolarHBondContact O-N 3.32Å; R108-G111 VanDerWaalsContact O-N 3.12Å; R108-Y112 WeakPolarHBondContact CA-O 3.37Å; R108-Y112 PolarHBondContact N-O 3.43Å
109	T	60.4	Low	67.2	Low	92 Å²	92	67.7 Å²	67.7	56%	0.564	35%	0.351	S	S	*	.	H	α-helix	trans	-63.4	-31.5	173.7	-61	0	0	0	0	111.4	A105 C106 G111	A105-T109 PolarHBondContact O-N 2.84Å; A105-T109 PolarHBondContact O-OG1 3.19Å; C106-T109 WeakPolarHBondContact O-CB 3.42Å; C106-T109 PolarHBondContact O-N 3.22Å; T109-G111 PolarHBondContact O-N 2.74Å
110	L	51.7	Low	66.9	Low	65 Å²	65	70 Å²	70	34%	0.34	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	3.8	175.9	-61.8	168.9	0	0	0	113.8	F61 C106 M107 R108 Y112 M140	F61-L110 HydrophobicContact CD1-CD2 3.96Å; F61-L110 HydrophobicContact CE1-CD2 3.12Å; F61-L110 HydrophobicContact CE2-CD2 4.43Å; F61-L110 HydrophobicContact CZ-CD2 3.4Å; F61-L110 VanDerWaalsContact CZ-CD2 3.4Å; C106-L110 VanDerWaalsContact O-CG 3.3Å; C106-L110 WeakPolarHBondContact O-CG 3.35Å; C106-L110 PolarHBondContact O-N 2.8Å; M107-L110 CarbonylContact O-C 3.57Å; M107-L110 WeakPolarHBondContact O-CB 3.16Å; M107-L110 PolarHBondContact O-N 3.05Å; R108-L110 PolarHBondContact O-N 3.26Å; L110-Y112 VanDerWaalsContact C-N 3.33Å; L110-M140 HydrophobicContact CD1-CE 3.14Å
111	G	49.4	Very low	66.8	Low	68 Å²	68	73 Å²	73	70%	0.701	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.7	2.2	179.4	0	0	0	0	0	114.6	M107 R108 T109	M107-G111 PolarHBondContact O-N 2.89Å; R108-G111 PolarHBondContact O-N 3.32Å; R108-G111 VanDerWaalsContact O-N 3.12Å; T109-G111 PolarHBondContact O-N 2.74Å
112	Y	49.1	Very low	66.5	Low	70 Å²	70	64.1 Å²	64.1	28%	0.275	34%	0.337	S	S	.	.			trans	-91.8	128.3	173.8	-167.7	-102.7	0	0	0	110.3	M107 R108 L110 P114 E118	M107-Y112 CarbonylContact C-O 3.6Å; M107-Y112 HydrophobicContact CB-CD1 4.23Å; M107-Y112 HydrophobicContact CE-CD1 3.51Å; M107-Y112 HydrophobicContact CE-CE1 3.58Å; M107-Y112 CarbonylContact O-C 3.48Å; M107-Y112 WeakPolarHBondContact O-CA 3.34Å; M107-Y112 WeakPolarHBondContact O-CB 3.19Å; M107-Y112 PolarHBondContact O-N 3.44Å; M107-Y112 HydrophobicContact SD-CD1 4.46Å; R108-Y112 WeakPolarHBondContact CA-O 3.37Å; R108-Y112 PolarHBondContact N-O 3.43Å; L110-Y112 VanDerWaalsContact C-N 3.33Å; Y112-P114 VanDerWaalsContact C-CD 3.47Å; Y112-P114 HydrophobicContact CD1-CB 3.83Å; Y112-P114 HydrophobicContact CD1-CG 4.21Å; Y112-P114 HydrophobicContact CE1-CB 3.7Å; Y112-P114 WeakPolarHBondContact O-CD 3.06Å; Y112-E118 PolarHBondContact OH-OE1 2.87Å
113	M	55.8	Low	66	Low	166 Å²	166	63 Å²	63	82%	0.818	33%	0.332	S	S	*	.			trans	-102.5	83.1	174.5	-74.5	-158.3	-67.9	0	0	109.9
114	P	63.4	Low	65.6	Low	14 Å²	14	70.1 Å²	70.1	9%	0.091	37%	0.365	C	S	.	.			trans	-69.4	143.5	-179.9	31.8	-36.3	0	0	0	110.1	M107 Y112 L119	M107-P114 HydrophobicContact CB-CG 3.85Å; M107-P114 HydrophobicContact CE-CB 4.19Å; M107-P114 HydrophobicContact CG-CG 4.49Å; M107-P114 HydrophobicContact SD-CB 3.96Å; M107-P114 HydrophobicContact SD-CG 3.81Å; Y112-P114 VanDerWaalsContact C-CD 3.47Å; Y112-P114 HydrophobicContact CD1-CB 3.83Å; Y112-P114 HydrophobicContact CD1-CG 4.21Å; Y112-P114 HydrophobicContact CE1-CB 3.7Å; Y112-P114 WeakPolarHBondContact O-CD 3.06Å; P114-L119 HydrophobicContact CB-CD2 4.04Å; P114-L119 HydrophobicContact CB-CG 3.94Å; P114-L119 HydrophobicContact CG-CD1 4.11Å; P114-L119 HydrophobicContact CG-CD2 3.81Å; P114-L119 HydrophobicContact CG-CG 3.94Å
115	T	75.4	Confident	65.2	Low	76 Å²	76	78.3 Å²	78.3	47%	0.466	40%	0.404	S	S	.	.			trans	-72.8	160.4	166.9	63.1	0	0	0	0	110.7	M117 E118 L119	T115-M117 PolarHBondContact O-N 3.35Å; T115-E118 WeakPolarHBondContact CB-OE2 3.43Å; T115-E118 WeakPolarHBondContact CG2-OE2 3.24Å; T115-E118 PolarHBondContact N-OE2 3.37Å; T115-E118 PolarHBondContact O-N 2.93Å; T115-E118 WeakPolarHBondContact OG1-CG 3.19Å; T115-E118 PolarHBondContact OG1-N 3.38Å; T115-E118 PolarHBondContact OG1-OE2 3.23Å; T115-L119 PolarHBondContact O-N 2.98Å; T115-L119 VanDerWaalsContact O-N 3.07Å
116	E	72.6	Confident	64.7	Low	158 Å²	158	77.3 Å²	77.3	74%	0.738	39%	0.394	S	S	*	.	H	α-helix	trans	-60.8	-32.1	175.7	-166.6	170.1	-173.5	0	0	111.7	I120	E116-I120 HydrophobicContact CG-CD1 4.15Å; E116-I120 WeakPolarHBondContact O-CB 3.35Å; E116-I120 WeakPolarHBondContact O-CD1 3.37Å; E116-I120 WeakPolarHBondContact O-CG1 3.22Å; E116-I120 PolarHBondContact O-N 3.43Å
117	M	72.4	Confident	64	Low	127 Å²	127	82.6 Å²	82.6	63%	0.626	43%	0.431	S	S	*	.	H	α-helix	trans	-64.7	-48.2	175.4	-160.8	80.4	70.4	0	0	111.7	T115 L119 I120 E121	T115-M117 PolarHBondContact O-N 3.35Å; M117-L119 VanDerWaalsContact C-N 3.33Å; M117-L119 PolarHBondContact O-N 3.04Å; M117-I120 PolarHBondContact O-N 2.73Å; M117-I120 VanDerWaalsContact O-N 3.15Å; M117-E121 WeakPolarHBondContact O-CG 3.42Å; M117-E121 PolarHBondContact O-N 3.39Å
118	E	68.6	Low	63.7	Low	61 Å²	61	85.2 Å²	85.2	29%	0.285	46%	0.463	S	S	.	.	H	α-helix	trans	-63.6	-38.9	179.2	-72.3	162.8	136.7	0	0	111.4	Y112 T115 I120 E121 I122	Y112-E118 PolarHBondContact OH-OE1 2.87Å; T115-E118 WeakPolarHBondContact CB-OE2 3.43Å; T115-E118 WeakPolarHBondContact CG2-OE2 3.24Å; T115-E118 PolarHBondContact N-OE2 3.37Å; T115-E118 PolarHBondContact O-N 2.93Å; T115-E118 WeakPolarHBondContact OG1-CG 3.19Å; T115-E118 PolarHBondContact OG1-N 3.38Å; T115-E118 PolarHBondContact OG1-OE2 3.23Å; E118-I120 VanDerWaalsContact C-N 3.32Å; E118-I120 PolarHBondContact O-N 2.84Å; E118-E121 PolarHBondContact O-N 2.95Å; E118-I122 WeakPolarHBondContact O-CB 3.48Å; E118-I122 WeakPolarHBondContact O-CD1 3.26Å; E118-I122 WeakPolarHBondContact O-CG1 3.28Å; E118-I122 PolarHBondContact O-N 3.19Å
119	L	68.4	Low	63.6	Low	22 Å²	22	80.4 Å²	80.4	12%	0.115	45%	0.453	C	S	.	.	H	α-helix	trans	-63.7	-38.9	174.5	-71.8	173.5	0	0	0	112.3	L103 M107 P114 T115 M117 S123	L103-L119 HydrophobicContact CG-CD2 4.38Å; M107-L119 HydrophobicContact SD-CD2 3.64Å; P114-L119 HydrophobicContact CB-CD2 4.04Å; P114-L119 HydrophobicContact CB-CG 3.94Å; P114-L119 HydrophobicContact CG-CD1 4.11Å; P114-L119 HydrophobicContact CG-CD2 3.81Å; P114-L119 HydrophobicContact CG-CG 3.94Å; T115-L119 PolarHBondContact O-N 2.98Å; T115-L119 VanDerWaalsContact O-N 3.07Å; M117-L119 VanDerWaalsContact C-N 3.33Å; M117-L119 PolarHBondContact O-N 3.04Å; L119-S123 WeakPolarHBondContact O-CB 3.41Å; L119-S123 PolarHBondContact O-N 3.43Å; L119-S123 PolarHBondContact O-OG 3.35Å; L119-S123 VanDerWaalsContact O-OG 3.09Å
120	I	68.4	Low	64.1	Low	69 Å²	69	80.5 Å²	80.5	35%	0.354	45%	0.446	S	S	.	.	H	α-helix	trans	-67.1	-47.4	177.1	-70.3	164.4	0	0	0	110.1	E116 M117 E118 I122 S123 Q124	E116-I120 HydrophobicContact CG-CD1 4.15Å; E116-I120 WeakPolarHBondContact O-CB 3.35Å; E116-I120 WeakPolarHBondContact O-CD1 3.37Å; E116-I120 WeakPolarHBondContact O-CG1 3.22Å; E116-I120 PolarHBondContact O-N 3.43Å; M117-I120 PolarHBondContact O-N 2.73Å; M117-I120 VanDerWaalsContact O-N 3.15Å; E118-I120 VanDerWaalsContact C-N 3.32Å; E118-I120 PolarHBondContact O-N 2.84Å; I120-I122 PolarHBondContact O-N 3.38Å; I120-S123 WeakPolarHBondContact CA-OG 3.26Å; I120-S123 PolarHBondContact O-N 2.67Å; I120-S123 PolarHBondContact O-OG 3.12Å; I120-Q124 HydrophobicContact CG2-CG 4.19Å; I120-Q124 WeakPolarHBondContact O-CB 3.49Å; I120-Q124 VanDerWaalsContact O-CG 3.27Å; I120-Q124 WeakPolarHBondContact O-CG 3.45Å; I120-Q124 PolarHBondContact O-N 2.99Å
121	E	71.3	Confident	65.2	Low	112 Å²	112	77.5 Å²	77.5	52%	0.523	43%	0.43	S	S	.	.	H	α-helix	trans	-58	-49.4	178.2	-73.9	176.6	166.1	0	0	111.5	M117 E118 S123 Q124 Q125	M117-E121 WeakPolarHBondContact O-CG 3.42Å; M117-E121 PolarHBondContact O-N 3.39Å; E118-E121 PolarHBondContact O-N 2.95Å; E121-S123 VanDerWaalsContact C-N 3.35Å; E121-S123 PolarHBondContact O-N 3.39Å; E121-Q124 PolarHBondContact O-N 3.43Å; E121-Q125 WeakPolarHBondContact O-CB 3.43Å; E121-Q125 PolarHBondContact O-N 2.99Å
122	I	68.3	Low	66.4	Low	35 Å²	35	76.6 Å²	76.6	18%	0.179	41%	0.409	C	S	.	.	H	α-helix	trans	-60	-46.5	176.5	-66.8	165.3	0	0	0	110.5	L103 M107 E118 I120 Q124 Q125 I126 L139	L103-I122 HydrophobicContact CD2-CB 4.44Å; L103-I122 HydrophobicContact CD2-CG2 3.65Å; M107-I122 HydrophobicContact CE-CD1 3.67Å; M107-I122 HydrophobicContact SD-CD1 4.22Å; E118-I122 WeakPolarHBondContact O-CB 3.48Å; E118-I122 WeakPolarHBondContact O-CD1 3.26Å; E118-I122 WeakPolarHBondContact O-CG1 3.28Å; E118-I122 PolarHBondContact O-N 3.19Å; I120-I122 PolarHBondContact O-N 3.38Å; I122-Q124 VanDerWaalsContact C-N 3.31Å; I122-Q124 PolarHBondContact O-N 2.92Å; I122-Q125 PolarHBondContact O-N 3.47Å; I122-I126 HydrophobicContact CG2-CD1 3.76Å; I122-I126 VanDerWaalsContact O-CD1 3.28Å; I122-I126 WeakPolarHBondContact O-CD1 3.4Å; I122-I126 VanDerWaalsContact O-CG1 3.23Å; I122-I126 WeakPolarHBondContact O-CG1 3.41Å; I122-I126 PolarHBondContact O-N 3.37Å; I122-L139 HydrophobicContact CG2-CD1 4.02Å; I122-L139 HydrophobicContact CG2-CD2 3.52Å; I122-L139 HydrophobicContact CG2-CG 4.38Å
123	S	67.3	Low	67.6	Low	9 Å²	9	75.7 Å²	75.7	6%	0.063	41%	0.407	C	S	.	.	H	α-helix	trans	-68.5	-26.3	-179.4	72.7	0	0	0	0	114.6	C100 L119 I120 E121 G129	C100-S123 WeakPolarHBondContact SG-CB 3.17Å; C100-S123 PolarHBondContact SG-OG 2.82Å; L119-S123 WeakPolarHBondContact O-CB 3.41Å; L119-S123 PolarHBondContact O-N 3.43Å; L119-S123 PolarHBondContact O-OG 3.35Å; L119-S123 VanDerWaalsContact O-OG 3.09Å; I120-S123 WeakPolarHBondContact CA-OG 3.26Å; I120-S123 PolarHBondContact O-N 2.67Å; I120-S123 PolarHBondContact O-OG 3.12Å; E121-S123 VanDerWaalsContact C-N 3.35Å; E121-S123 PolarHBondContact O-N 3.39Å; S123-G129 VanDerWaalsContact O-CA 3.28Å; S123-G129 WeakPolarHBondContact O-CA 3.41Å; S123-G129 PolarHBondContact O-N 3.46Å
124	Q	67.1	Low	68.5	Low	149 Å²	149	75 Å²	75	70%	0.696	40%	0.402	S	S	*	.	H	α-helix	trans	-81.6	-30.4	176.7	-76.6	-179.3	9.9	0	0	112.2	I120 E121 I122	I120-Q124 HydrophobicContact CG2-CG 4.19Å; I120-Q124 WeakPolarHBondContact O-CB 3.49Å; I120-Q124 VanDerWaalsContact O-CG 3.27Å; I120-Q124 WeakPolarHBondContact O-CG 3.45Å; I120-Q124 PolarHBondContact O-N 2.99Å; E121-Q124 PolarHBondContact O-N 3.43Å; I122-Q124 VanDerWaalsContact C-N 3.31Å; I122-Q124 PolarHBondContact O-N 2.92Å
125	Q	64.2	Low	69	Low	173 Å²	173	75.7 Å²	75.7	81%	0.808	41%	0.405	S	S	*	.	H	α-helix	trans	-71.3	-25.4	176.5	-161.7	157.4	-4.1	0	0	111.5	E121 I122	E121-Q125 WeakPolarHBondContact O-CB 3.43Å; E121-Q125 PolarHBondContact O-N 2.99Å; I122-Q125 PolarHBondContact O-N 3.47Å
126	I	63.6	Low	68.8	Low	10 Å²	10	72.2 Å²	72.2	5%	0.051	38%	0.383	C	S	.	.	S	Bend	trans	-92.7	141.3	175	-56.6	161.4	0	0	0	109.4	I122 G128 G129 V131 D135 L139	I122-I126 HydrophobicContact CG2-CD1 3.76Å; I122-I126 VanDerWaalsContact O-CD1 3.28Å; I122-I126 WeakPolarHBondContact O-CD1 3.4Å; I122-I126 VanDerWaalsContact O-CG1 3.23Å; I122-I126 WeakPolarHBondContact O-CG1 3.41Å; I122-I126 PolarHBondContact O-N 3.37Å; I126-G128 VanDerWaalsContact C-N 3.32Å; I126-G128 PolarHBondContact O-N 3.23Å; I126-G129 PolarHBondContact O-N 3.32Å; I126-V131 HydrophobicContact CB-CG2 4.44Å; I126-V131 HydrophobicContact CD1-CB 4.29Å; I126-V131 HydrophobicContact CD1-CG1 4.08Å; I126-V131 HydrophobicContact CD1-CG2 3.39Å; I126-V131 HydrophobicContact CG1-CG2 4.48Å; I126-V131 HydrophobicContact CG2-CB 4.34Å; I126-V131 HydrophobicContact CG2-CG1 4.45Å; I126-V131 HydrophobicContact CG2-CG2 4.12Å; I126-D135 HydrophobicContact CG2-CB 3.69Å; I126-D135 VanDerWaalsContact CG2-CG 3.43Å; I126-D135 WeakPolarHBondContact CG2-OD2 3.41Å; I126-L139 HydrophobicContact CD1-CD1 3.75Å; I126-L139 HydrophobicContact CD1-CD2 4.43Å; I126-L139 HydrophobicContact CG1-CD1 4.22Å
127	S	54.4	Low	68.7	Low	110 Å²	110	66 Å²	66	77%	0.769	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	76.7	-164.7	-60.6	0	0	0	0	115.2
128	G	59.8	Low	68.6	Low	75 Å²	75	67 Å²	67	77%	0.773	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	102	23.9	169.3	0	0	0	0	0	116.7	I126 K130	I126-G128 VanDerWaalsContact C-N 3.32Å; I126-G128 PolarHBondContact O-N 3.23Å; G128-K130 VanDerWaalsContact C-N 3.31Å; G128-K130 PolarHBondContact O-N 3.26Å
129	G	64.4	Low	68.3	Low	27 Å²	27	66.5 Å²	66.5	28%	0.278	36%	0.358	S	S	.	.	S	Bend	trans	81	9.6	173.5	0	0	0	0	0	115.1	S123 I126	S123-G129 VanDerWaalsContact O-CA 3.28Å; S123-G129 WeakPolarHBondContact O-CA 3.41Å; S123-G129 PolarHBondContact O-N 3.46Å; I126-G129 PolarHBondContact O-N 3.32Å
130	K	70	Confident	68.1	Low	95 Å²	95	66.2 Å²	66.2	41%	0.413	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	131.9	174.9	-75.9	-166.9	170.6	-147.9	0	107.8	D95 Y97 G128	D95-K130 IonicContact OD2-NZ 2.63Å; D95-K130 PolarHBondContact OD2-NZ 2.93Å; Y97-K130 HydrophobicContact CD1-CB 4.02Å; Y97-K130 HydrophobicContact CD1-CD 4.5Å; Y97-K130 HydrophobicContact CD2-CD 4.39Å; Y97-K130 HydrophobicContact CG-CB 4.18Å; Y97-K130 HydrophobicContact CG-CD 4.05Å; G128-K130 VanDerWaalsContact C-N 3.31Å; G128-K130 PolarHBondContact O-N 3.26Å
131	V	74.9	Confident	67.5	Low	1 Å²	1	63.2 Å²	63.2	1%	0.006	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	115	-178.2	-175.1	0	0	0	0	108.3	Y97 I98 L103 I126 D135 F136	Y97-V131 CarbonylContact C-O 3.58Å; Y97-V131 WeakPolarHBondContact CA-O 3.17Å; I98-V131 HydrophobicContact CB-CB 4.19Å; I98-V131 PolarHBondContact N-O 3.18Å; I98-V131 PolarHBondContact O-N 3.22Å; L103-V131 HydrophobicContact CD2-CG2 4.24Å; I126-V131 HydrophobicContact CB-CG2 4.44Å; I126-V131 HydrophobicContact CD1-CB 4.29Å; I126-V131 HydrophobicContact CD1-CG1 4.08Å; I126-V131 HydrophobicContact CD1-CG2 3.39Å; I126-V131 HydrophobicContact CG1-CG2 4.48Å; I126-V131 HydrophobicContact CG2-CB 4.34Å; I126-V131 HydrophobicContact CG2-CG1 4.45Å; I126-V131 HydrophobicContact CG2-CG2 4.12Å; V131-D135 HydrophobicContact CG1-CB 3.73Å; V131-F136 HydrophobicContact CG1-CB 3.98Å
132	D	75.9	Confident	66.5	Low	49 Å²	49	61.6 Å²	61.6	26%	0.262	34%	0.342	S	S	.	.			trans	-81.6	179.9	172.2	70.7	29.2	0	0	0	111.4	Y97 E134 D135 F136	Y97-D132 HydrophobicContact CD1-CB 3.91Å; Y97-D132 HydrophobicContact CE1-CB 3.92Å; D132-E134 VanDerWaalsContact C-N 3.32Å; D132-E134 PolarHBondContact O-N 3.44Å; D132-E134 PolarHBondContact OD1-N 3.01Å; D132-D135 PolarHBondContact N-OD2 3.33Å; D132-D135 PolarHBondContact O-N 3.28Å; D132-D135 VanDerWaalsContact OD1-CG 3.3Å; D132-D135 PolarHBondContact OD1-N 2.92Å; D132-F136 VanDerWaalsContact O-CB 3.3Å; D132-F136 WeakPolarHBondContact O-CB 3.3Å; D132-F136 PolarHBondContact O-N 2.9Å
133	F	73.8	Confident	65.5	Low	52 Å²	52	64.9 Å²	64.9	23%	0.228	36%	0.355	C	S	.	.	H	α-helix	trans	-65.2	-35.9	-177.6	-179.1	-111.9	0	0	0	112.8	I80 L83 Q84 F87 F136 V137	I80-F133 HydrophobicContact CG2-CE1 4.09Å; I80-F133 HydrophobicContact CG2-CZ 3.99Å; L83-F133 HydrophobicContact CB-CE2 4.31Å; L83-F133 HydrophobicContact CB-CZ 4.49Å; Q84-F133 VanDerWaalsContact CA-CE2 3.45Å; Q84-F133 HydrophobicContact CB-CE2 3.84Å; Q84-F133 HydrophobicContact CB-CZ 3.85Å; Q84-F133 HydrophobicContact CG-CE2 4.32Å; Q84-F133 HydrophobicContact CG-CZ 4.41Å; F87-F133 HydrophobicContact CB-CD2 3.84Å; F87-F133 HydrophobicContact CB-CE2 4.16Å; F87-F133 HydrophobicContact CD1-CD2 4.27Å; F87-F133 HydrophobicContact CD2-CB 4.43Å; F87-F133 AromaticContact CD2-CD2 3.96Å; F87-F133 HydrophobicContact CD2-CD2 3.96Å; F87-F133 HydrophobicContact CE1-CB 4.47Å; F87-F133 HydrophobicContact CE2-CB 4.28Å; F87-F133 AromaticContact CG-CD2 3.76Å; F87-F133 HydrophobicContact CG-CD2 3.76Å; F87-F133 HydrophobicContact CZ-CB 4.3Å; F133-F136 PolarHBondContact O-N 3.06Å; F133-V137 HydrophobicContact CD1-CG2 4.41Å; F133-V137 HydrophobicContact CD2-CG2 4.33Å; F133-V137 HydrophobicContact CE1-CG2 3.98Å; F133-V137 HydrophobicContact CE2-CG2 3.87Å; F133-V137 HydrophobicContact CZ-CG2 3.69Å; F133-V137 WeakPolarHBondContact O-CG2 3.34Å; F133-V137 PolarHBondContact O-N 3.08Å
134	E	75.3	Confident	64.3	Low	151 Å²	151	68 Å²	68	71%	0.706	37%	0.37	S	S	*	.	H	α-helix	trans	-69.4	-44.1	-179.2	-68.6	169.6	177.8	0	0	109.6	D132 F136 V137 E138	D132-E134 VanDerWaalsContact C-N 3.32Å; D132-E134 PolarHBondContact O-N 3.44Å; D132-E134 PolarHBondContact OD1-N 3.01Å; E134-F136 PolarHBondContact O-N 3.38Å; E134-V137 PolarHBondContact O-N 3.27Å; E134-E138 PolarHBondContact O-N 3.16Å
135	D	73.9	Confident	63.2	Low	29 Å²	29	66 Å²	66	16%	0.155	36%	0.364	C	S	.	.	H	α-helix	trans	-62.1	-40.9	173	-64.8	-42.9	0	0	0	111.8	I126 V131 D132 V137 E138 L139	I126-D135 HydrophobicContact CG2-CB 3.69Å; I126-D135 VanDerWaalsContact CG2-CG 3.43Å; I126-D135 WeakPolarHBondContact CG2-OD2 3.41Å; V131-D135 HydrophobicContact CG1-CB 3.73Å; D132-D135 PolarHBondContact N-OD2 3.33Å; D132-D135 PolarHBondContact O-N 3.28Å; D132-D135 VanDerWaalsContact OD1-CG 3.3Å; D132-D135 PolarHBondContact OD1-N 2.92Å; D135-V137 PolarHBondContact O-N 2.89Å; D135-E138 PolarHBondContact O-N 3.16Å; D135-L139 WeakPolarHBondContact O-CB 3.47Å; D135-L139 PolarHBondContact O-N 3.09Å
136	F	71.4	Confident	62	Low	2 Å²	2	61.3 Å²	61.3	1%	0.009	35%	0.354	C	S	.	.	H	α-helix	trans	-64.2	-40.7	178.4	-179.2	-100.3	0	0	0	111.7	L83 F87 F90 I98 V131 D132 F133 E134 L139 M140	L83-F136 HydrophobicContact CD2-CE1 4.18Å; F87-F136 HydrophobicContact CB-CD1 4.18Å; F87-F136 HydrophobicContact CB-CE1 4.22Å; F87-F136 HydrophobicContact CD2-CB 3.67Å; F87-F136 AromaticContact CD2-CD1 3.84Å; F87-F136 HydrophobicContact CD2-CD1 3.84Å; F87-F136 HydrophobicContact CD2-CD2 4.17Å; F87-F136 AromaticContact CD2-CG 3.64Å; F87-F136 HydrophobicContact CD2-CG 3.64Å; F87-F136 HydrophobicContact CE2-CB 3.9Å; F87-F136 HydrophobicContact CE2-CG 4.3Å; F90-F136 HydrophobicContact CD2-CE2 4.16Å; F90-F136 AromaticContact CD2-CZ 3.9Å; F90-F136 HydrophobicContact CD2-CZ 3.9Å; F90-F136 HydrophobicContact CE2-CZ 4.21Å; I98-F136 HydrophobicContact CD1-CD2 3.53Å; I98-F136 HydrophobicContact CD1-CE2 3.7Å; I98-F136 HydrophobicContact CD1-CG 4.2Å; I98-F136 HydrophobicContact CD1-CZ 4.5Å; V131-F136 HydrophobicContact CG1-CB 3.98Å; D132-F136 VanDerWaalsContact O-CB 3.3Å; D132-F136 WeakPolarHBondContact O-CB 3.3Å; D132-F136 PolarHBondContact O-N 2.9Å; F133-F136 PolarHBondContact O-N 3.06Å; E134-F136 PolarHBondContact O-N 3.38Å; F136-L139 PolarHBondContact O-N 3.46Å; F136-M140 HydrophobicContact CD1-CG 4.26Å; F136-M140 HydrophobicContact CD2-CG 3.78Å; F136-M140 HydrophobicContact CE1-CG 4.11Å; F136-M140 HydrophobicContact CE2-CE 4.11Å; F136-M140 HydrophobicContact CE2-CG 3.61Å; F136-M140 HydrophobicContact CE2-SD 4.31Å; F136-M140 HydrophobicContact CG-CG 4.11Å; F136-M140 HydrophobicContact CZ-CE 4.07Å; F136-M140 HydrophobicContact CZ-CG 3.79Å; F136-M140 WeakPolarHBondContact O-CB 3.39Å; F136-M140 WeakPolarHBondContact O-CG 3.4Å; F136-M140 PolarHBondContact O-N 2.96Å
137	V	70.3	Confident	60.8	Low	29 Å²	29	65.3 Å²	65.3	18%	0.176	37%	0.373	C	S	.	.	H	α-helix	trans	-65.2	-40.7	175.3	171	0	0	0	0	110.9	L75 L83 F133 E134 D135 G141	L75-V137 HydrophobicContact CD1-CG1 3.23Å; L83-V137 HydrophobicContact CB-CG2 4.39Å; L83-V137 HydrophobicContact CD1-CG1 4.33Å; L83-V137 HydrophobicContact CD1-CG2 4.12Å; F133-V137 HydrophobicContact CD1-CG2 4.41Å; F133-V137 HydrophobicContact CD2-CG2 4.33Å; F133-V137 HydrophobicContact CE1-CG2 3.98Å; F133-V137 HydrophobicContact CE2-CG2 3.87Å; F133-V137 HydrophobicContact CZ-CG2 3.69Å; F133-V137 WeakPolarHBondContact O-CG2 3.34Å; F133-V137 PolarHBondContact O-N 3.08Å; E134-V137 PolarHBondContact O-N 3.27Å; D135-V137 PolarHBondContact O-N 2.89Å; V137-G141 VanDerWaalsContact O-CA 3.28Å; V137-G141 WeakPolarHBondContact O-CA 3.4Å; V137-G141 PolarHBondContact O-N 2.81Å
138	E	68.6	Low	60.2	Low	147 Å²	147	62.4 Å²	62.4	69%	0.687	35%	0.35	S	S	*	.	H	α-helix	trans	-69.6	-32.2	176.8	-168.8	176	177.7	0	0	112.6	E134 D135 P142	E134-E138 PolarHBondContact O-N 3.16Å; D135-E138 PolarHBondContact O-N 3.16Å; E138-P142 WeakPolarHBondContact O-CD 3.38Å; E138-P142 VanDerWaalsContact O-CG 3.27Å; E138-P142 WeakPolarHBondContact O-CG 3.07Å
139	L	64.2	Low	59.2	Low	50 Å²	50	62 Å²	62	26%	0.262	34%	0.34	S	S	.	.	H	α-helix	trans	-78.6	-42.1	178.8	-143.4	91.5	0	0	0	112.5	L103 I122 I126 D135 F136 K143	L103-L139 HydrophobicContact CD1-CD2 4.33Å; I122-L139 HydrophobicContact CG2-CD1 4.02Å; I122-L139 HydrophobicContact CG2-CD2 3.52Å; I122-L139 HydrophobicContact CG2-CG 4.38Å; I126-L139 HydrophobicContact CD1-CD1 3.75Å; I126-L139 HydrophobicContact CD1-CD2 4.43Å; I126-L139 HydrophobicContact CG1-CD1 4.22Å; D135-L139 WeakPolarHBondContact O-CB 3.47Å; D135-L139 PolarHBondContact O-N 3.09Å; F136-L139 PolarHBondContact O-N 3.46Å; L139-K143 WeakPolarHBondContact O-CG 3.42Å
140	M	62.4	Low	57.9	Low	16 Å²	16	68.4 Å²	68.4	8%	0.079	37%	0.368	C	S	.	.	H	α-helix	trans	-92.4	-29.1	-171.7	-59.6	-67.2	-82.9	0	0	111.9	L83 L110 F136 K143 L144	L83-M140 HydrophobicContact CD2-CB 4.43Å; L110-M140 HydrophobicContact CD1-CE 3.14Å; F136-M140 HydrophobicContact CD1-CG 4.26Å; F136-M140 HydrophobicContact CD2-CG 3.78Å; F136-M140 HydrophobicContact CE1-CG 4.11Å; F136-M140 HydrophobicContact CE2-CE 4.11Å; F136-M140 HydrophobicContact CE2-CG 3.61Å; F136-M140 HydrophobicContact CE2-SD 4.31Å; F136-M140 HydrophobicContact CG-CG 4.11Å; F136-M140 HydrophobicContact CZ-CE 4.07Å; F136-M140 HydrophobicContact CZ-CG 3.79Å; F136-M140 WeakPolarHBondContact O-CB 3.39Å; F136-M140 WeakPolarHBondContact O-CG 3.4Å; F136-M140 PolarHBondContact O-N 2.96Å; M140-K143 PolarHBondContact O-N 3.27Å; M140-L144 HydrophobicContact CB-CD1 4.27Å; M140-L144 WeakPolarHBondContact O-CB 3.27Å; M140-L144 WeakPolarHBondContact O-CD1 3.23Å; M140-L144 VanDerWaalsContact O-CG 3.27Å; M140-L144 WeakPolarHBondContact O-CG 3.42Å; M140-L144 PolarHBondContact O-N 3.29Å
141	G	56.2	Low	56.4	Low	7 Å²	7	70.4 Å²	70.4	7%	0.072	38%	0.38	C	S	.	.	H	α-helix	trans	-54.9	-58.4	176.6	0	0	0	0	0	111.7	V137 K143 L145	V137-G141 VanDerWaalsContact O-CA 3.28Å; V137-G141 WeakPolarHBondContact O-CA 3.4Å; V137-G141 PolarHBondContact O-N 2.81Å; G141-K143 PolarHBondContact O-N 3Å; G141-L145 WeakPolarHBondContact O-CB 3.19Å; G141-L145 VanDerWaalsContact O-CD1 3.29Å; G141-L145 WeakPolarHBondContact O-CD1 3.1Å; G141-L145 WeakPolarHBondContact O-CG 3.23Å; G141-L145 PolarHBondContact O-N 3.31Å; G141-L145 VanDerWaalsContact O-N 3.12Å
142	P	51.7	Low	55.3	Low	77 Å²	77	71.9 Å²	71.9	50%	0.5	39%	0.388	S	S	.	.	H	α-helix	trans	-67.2	-33.1	179.3	-20.5	33.3	0	0	0	113.6	E138 L145 A146	E138-P142 WeakPolarHBondContact O-CD 3.38Å; E138-P142 VanDerWaalsContact O-CG 3.27Å; E138-P142 WeakPolarHBondContact O-CG 3.07Å; P142-L145 CarbonylContact O-C 3.51Å; P142-L145 PolarHBondContact O-N 3.4Å; P142-A146 WeakPolarHBondContact O-CB 3.47Å; P142-A146 PolarHBondContact O-N 3.24Å
143	K	45.3	Very low	54	Low	104 Å²	104	71.1 Å²	71.1	45%	0.452	39%	0.391	S	S	.	.	H	α-helix	trans	-72.3	-39.8	178.7	-77.9	-86.7	-176.2	169.4	0	112.4	L139 M140 G141 L145 E147	L139-K143 WeakPolarHBondContact O-CG 3.42Å; M140-K143 PolarHBondContact O-N 3.27Å; G141-K143 PolarHBondContact O-N 3Å; K143-L145 PolarHBondContact O-N 3.04Å; K143-E147 PolarHBondContact O-N 2.91Å; K143-E147 VanDerWaalsContact O-N 3.13Å
144	L	43.9	Very low	53	Low	75 Å²	75	73.1 Å²	73.1	39%	0.393	41%	0.408	S	S	.	.	H	α-helix	trans	-65.6	-21.4	169.4	-78.9	164.1	0	0	0	112.6	L83 M140 T148	L83-L144 HydrophobicContact CD2-CD1 3.8Å; M140-L144 HydrophobicContact CB-CD1 4.27Å; M140-L144 WeakPolarHBondContact O-CB 3.27Å; M140-L144 WeakPolarHBondContact O-CD1 3.23Å; M140-L144 VanDerWaalsContact O-CG 3.27Å; M140-L144 WeakPolarHBondContact O-CG 3.42Å; M140-L144 PolarHBondContact O-N 3.29Å; L144-T148 WeakPolarHBondContact O-CB 3.47Å; L144-T148 WeakPolarHBondContact O-CG2 3.4Å; L144-T148 PolarHBondContact O-OG1 3.4Å
145	L	42.8	Very low	51.7	Low	108 Å²	108	74.9 Å²	74.9	57%	0.565	41%	0.408	S	S	*	.	H	α-helix	trans	-95.6	-31.3	178.3	-68.9	168.4	0	0	0	113	G141 P142 K143 T148	G141-L145 WeakPolarHBondContact O-CB 3.19Å; G141-L145 VanDerWaalsContact O-CD1 3.29Å; G141-L145 WeakPolarHBondContact O-CD1 3.1Å; G141-L145 WeakPolarHBondContact O-CG 3.23Å; G141-L145 PolarHBondContact O-N 3.31Å; G141-L145 VanDerWaalsContact O-N 3.12Å; P142-L145 CarbonylContact O-C 3.51Å; P142-L145 PolarHBondContact O-N 3.4Å; K143-L145 PolarHBondContact O-N 3.04Å; L145-T148 PolarHBondContact O-OG1 3.04Å
146	A	39.2	Very low	51.1	Low	73 Å²	73	76.2 Å²	76.2	60%	0.603	41%	0.413	S	S	*	.	H	α-helix	trans	-90.5	-33.6	-174.2	0	0	0	0	0	113.6	P142	P142-A146 WeakPolarHBondContact O-CB 3.47Å; P142-A146 PolarHBondContact O-N 3.24Å
147	E	39.1	Very low	50.7	Low	95 Å²	95	76.5 Å²	76.5	44%	0.444	42%	0.415	S	S	.	.	S	Bend	trans	-87	-18.4	175.6	-73.5	-169.5	136	0	0	112.9	K143 M151	K143-E147 PolarHBondContact O-N 2.91Å; K143-E147 VanDerWaalsContact O-N 3.13Å; E147-M151 WeakPolarHBondContact O-CB 3.47Å; E147-M151 PolarHBondContact O-N 3.34Å
148	T	40.8	Very low	50.5	Low	48 Å²	48	81.2 Å²	81.2	29%	0.294	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-17.5	-179.8	47.2	0	0	0	0	114.8	L144 L145 D150 M151 I152	L144-T148 WeakPolarHBondContact O-CB 3.47Å; L144-T148 WeakPolarHBondContact O-CG2 3.4Å; L144-T148 PolarHBondContact O-OG1 3.4Å; L145-T148 PolarHBondContact O-OG1 3.04Å; T148-D150 PolarHBondContact O-N 2.9Å; T148-M151 CarbonylContact O-C 3.11Å; T148-M151 PolarHBondContact O-N 3.01Å; T148-I152 WeakPolarHBondContact O-CG1 3.47Å; T148-I152 PolarHBondContact O-N 3.49Å
149	A	38.8	Very low	50.5	Low	67 Å²	67	77.9 Å²	77.9	55%	0.554	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-31.8	173.5	0	0	0	0	0	111.8
150	D	38.3	Very low	50.7	Low	162 Å²	162	76.3 Å²	76.3	87%	0.866	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.3	-16.3	173.1	-76.8	-37.1	0	0	0	113.6	T148	T148-D150 PolarHBondContact O-N 2.9Å
151	M	38.4	Very low	51.1	Low	136 Å²	136	76 Å²	76	67%	0.67	41%	0.409	S	S	*	.			trans	-113.3	35.3	178.4	-68.5	-171.7	126.1	0	0	114.8	E147 T148 G153	E147-M151 WeakPolarHBondContact O-CB 3.47Å; E147-M151 PolarHBondContact O-N 3.34Å; T148-M151 CarbonylContact O-C 3.11Å; T148-M151 PolarHBondContact O-N 3.01Å; M151-G153 PolarHBondContact O-N 2.91Å
152	I	51.3	Low	52	Low	33 Å²	33	83.1 Å²	83.1	17%	0.169	43%	0.433	C	S	.	.	S	Bend	trans	-68.9	95.8	145.9	-46.7	-179.5	0	0	0	104.3	T148 V154 E156 L157 M218	T148-I152 WeakPolarHBondContact O-CG1 3.47Å; T148-I152 PolarHBondContact O-N 3.49Å; I152-V154 PolarHBondContact O-N 2.85Å; I152-E156 HydrophobicContact CG2-CB 3.92Å; I152-L157 HydrophobicContact CB-CD1 4.16Å; I152-L157 HydrophobicContact CB-CD2 4.08Å; I152-L157 HydrophobicContact CB-CG 3.91Å; I152-L157 HydrophobicContact CD1-CD2 4.15Å; I152-L157 HydrophobicContact CG2-CD1 4.28Å; I152-L157 HydrophobicContact CG2-CD2 3.62Å; I152-L157 HydrophobicContact CG2-CG 3.48Å; I152-L157 VanDerWaalsContact CG2-CG 3.48Å; I152-M218 HydrophobicContact CD1-CB 4.37Å
153	G	47.8	Very low	53.2	Low	32 Å²	32	86.7 Å²	86.7	33%	0.33	44%	0.443	S	S	.	.			trans	-54.2	138.6	-175	0	0	0	0	0	108.7	M151 R155 E156 L157	M151-G153 PolarHBondContact O-N 2.91Å; G153-R155 CarbonylContact O-C 3.54Å; G153-R155 PolarHBondContact O-N 2.73Å; G153-E156 PolarHBondContact O-N 3.12Å; G153-L157 PolarHBondContact O-N 3.38Å
154	V	52.6	Low	54.7	Low	95 Å²	95	82.1 Å²	82.1	58%	0.576	42%	0.423	S	S	*	.	H	α-helix	trans	-47.2	-28.2	-179.9	177.3	0	0	0	0	112.4	I152 R158 F211	I152-V154 PolarHBondContact O-N 2.85Å; V154-R158 WeakPolarHBondContact O-CB 3.45Å; V154-R158 PolarHBondContact O-N 3.24Å; V154-F211 HydrophobicContact CG1-CE1 4.41Å; V154-F211 HydrophobicContact CG1-CZ 4.27Å
155	R	49.6	Very low	56.4	Low	188 Å²	188	79.1 Å²	79.1	71%	0.709	41%	0.408	S	S	*	.	H	α-helix	trans	-61.6	-49.3	171	-96.6	173.1	56.4	-161.2	-7.1	114.1	G153 R158 D159	G153-R155 CarbonylContact O-C 3.54Å; G153-R155 PolarHBondContact O-N 2.73Å; R155-R158 CarbonylContact O-C 3.58Å; R155-R158 PolarHBondContact O-N 3Å; R155-D159 WeakPolarHBondContact O-CB 3.49Å; R155-D159 VanDerWaalsContact O-CG 3.27Å; R155-D159 PolarHBondContact O-N 3.04Å
156	E	61.3	Low	58.1	Low	57 Å²	57	79.2 Å²	79.2	27%	0.266	41%	0.413	S	S	.	.	H	α-helix	trans	-69.3	-40.9	-178.5	-70.3	169.6	173.7	0	0	111.3	L62 I152 G153 R158 D159 A160	L62-E156 HydrophobicContact CD2-CG 4.09Å; I152-E156 HydrophobicContact CG2-CB 3.92Å; G153-E156 PolarHBondContact O-N 3.12Å; E156-R158 PolarHBondContact O-N 3.41Å; E156-D159 PolarHBondContact O-N 3.19Å; E156-A160 WeakPolarHBondContact O-CB 2.89Å; E156-A160 PolarHBondContact O-N 3.02Å
157	L	63	Low	60.2	Low	8 Å²	8	80 Å²	80	4%	0.042	41%	0.407	C	S	.	.	H	α-helix	trans	-59.2	-37.8	170.6	-71	171.2	0	0	0	111.2	I152 G153 F161 F211 F214 V215 M218	I152-L157 HydrophobicContact CB-CD1 4.16Å; I152-L157 HydrophobicContact CB-CD2 4.08Å; I152-L157 HydrophobicContact CB-CG 3.91Å; I152-L157 HydrophobicContact CD1-CD2 4.15Å; I152-L157 HydrophobicContact CG2-CD1 4.28Å; I152-L157 HydrophobicContact CG2-CD2 3.62Å; I152-L157 HydrophobicContact CG2-CG 3.48Å; I152-L157 VanDerWaalsContact CG2-CG 3.48Å; G153-L157 PolarHBondContact O-N 3.38Å; L157-F161 WeakPolarHBondContact O-CB 3.5Å; L157-F161 PolarHBondContact O-N 3.37Å; L157-F211 HydrophobicContact CB-CE2 4.13Å; L157-F211 HydrophobicContact CB-CZ 4.1Å; L157-F214 HydrophobicContact CD2-CE1 4.35Å; L157-V215 HydrophobicContact CB-CG2 4.39Å; L157-V215 HydrophobicContact CD1-CB 4.29Å; L157-V215 HydrophobicContact CD1-CG1 3.94Å; L157-V215 HydrophobicContact CD1-CG2 3.81Å; L157-M218 HydrophobicContact CD2-CB 3.85Å; L157-M218 HydrophobicContact CD2-CG 4.12Å
158	R	65.5	Low	62.4	Low	127 Å²	127	78.4 Å²	78.4	48%	0.479	42%	0.416	S	S	.	.	H	α-helix	trans	-75.9	-31.7	179.9	-161	161.3	82.2	-170.8	9.8	113.3	V154 R155 E156 R162 F211	V154-R158 WeakPolarHBondContact O-CB 3.45Å; V154-R158 PolarHBondContact O-N 3.24Å; R155-R158 CarbonylContact O-C 3.58Å; R155-R158 PolarHBondContact O-N 3Å; E156-R158 PolarHBondContact O-N 3.41Å; R158-R162 VanDerWaalsContact O-CG 3.27Å; R158-R162 WeakPolarHBondContact O-CG 3.47Å; R158-R162 PolarHBondContact O-N 3.01Å; R158-R162 VanDerWaalsContact O-N 3.09Å; R158-F211 HydrophobicContact CB-CE2 3.98Å; R158-F211 HydrophobicContact CB-CZ 4.18Å; R158-F211 HydrophobicContact CG-CE2 4.27Å
159	D	67.9	Low	64.5	Low	78 Å²	78	80.5 Å²	80.5	42%	0.417	43%	0.425	S	S	.	.	H	α-helix	trans	-73.1	-41.8	174.1	-69.8	-23.6	0	0	0	110.5	R155 E156 R162 E163	R155-D159 WeakPolarHBondContact O-CB 3.49Å; R155-D159 VanDerWaalsContact O-CG 3.27Å; R155-D159 PolarHBondContact O-N 3.04Å; E156-D159 PolarHBondContact O-N 3.19Å; D159-R162 WeakPolarHBondContact O-CB 3.43Å; D159-R162 PolarHBondContact O-N 3.33Å; D159-R162 IonicContact OD1-NH1 3.76Å; D159-E163 PolarHBondContact O-N 2.8Å; D159-E163 VanDerWaalsContact O-N 3.12Å
160	A	69.7	Low	66.6	Low	16 Å²	16	79.2 Å²	79.2	13%	0.132	42%	0.418	C	S	.	.	H	α-helix	trans	-62.2	-44.8	170.7	0	0	0	0	0	111.5	E156 R162 E163 F164 F214	E156-A160 WeakPolarHBondContact O-CB 2.89Å; E156-A160 PolarHBondContact O-N 3.02Å; A160-R162 VanDerWaalsContact C-N 3.27Å; A160-R162 PolarHBondContact O-N 3.43Å; A160-E163 WeakPolarHBondContact O-CA 3.36Å; A160-E163 WeakPolarHBondContact O-CB 3.29Å; A160-E163 PolarHBondContact O-N 3.32Å; A160-F164 WeakPolarHBondContact O-CD2 3.27Å; A160-F164 PolarHBondContact O-N 2.98Å; A160-F164 VanDerWaalsContact O-N 3.1Å; A160-F214 HydrophobicContact CB-CE1 4.2Å; A160-F214 HydrophobicContact CB-CZ 4.05Å
161	F	70.8	Confident	68.9	Low	11 Å²	11	76.1 Å²	76.1	5%	0.048	39%	0.394	C	S	.	.	H	α-helix	trans	-57.4	-40.8	176.5	-173.1	-92.9	0	0	0	112	L157 E163 F164 D165 G170 I172 F211 F214	L157-F161 WeakPolarHBondContact O-CB 3.5Å; L157-F161 PolarHBondContact O-N 3.37Å; F161-E163 VanDerWaalsContact C-N 3.28Å; F161-E163 PolarHBondContact O-N 3.38Å; F161-F164 PolarHBondContact O-N 3.46Å; F161-D165 HydrophobicContact CD1-CB 4.41Å; F161-D165 HydrophobicContact CE1-CB 4.23Å; F161-D165 WeakPolarHBondContact O-CB 3.45Å; F161-D165 PolarHBondContact O-N 2.82Å; F161-G170 VanDerWaalsContact CZ-O 3.29Å; F161-G170 WeakPolarHBondContact CZ-O 3.29Å; F161-I172 HydrophobicContact CD2-CD1 3.52Å; F161-I172 HydrophobicContact CD2-CG1 4.1Å; F161-I172 HydrophobicContact CE2-CD1 3.5Å; F161-I172 VanDerWaalsContact CE2-CD1 3.5Å; F161-I172 HydrophobicContact CE2-CG1 3.7Å; F161-I172 HydrophobicContact CG-CD1 4.35Å; F161-I172 HydrophobicContact CZ-CD1 4.32Å; F161-I172 HydrophobicContact CZ-CG1 4.03Å; F161-F211 HydrophobicContact CB-CD2 3.91Å; F161-F211 HydrophobicContact CB-CE2 4.13Å; F161-F211 HydrophobicContact CD1-CD2 4.23Å; F161-F211 HydrophobicContact CD2-CB 4.41Å; F161-F211 AromaticContact CD2-CD2 3.85Å; F161-F211 HydrophobicContact CD2-CD2 3.85Å; F161-F211 HydrophobicContact CE2-CB 4.17Å; F161-F211 HydrophobicContact CE2-CD2 4.44Å; F161-F211 AromaticContact CG-CD2 3.73Å; F161-F211 HydrophobicContact CG-CD2 3.73Å; F161-F211 HydrophobicContact CG-CE2 4.44Å; F161-F211 HydrophobicContact CZ-CB 4.27Å; F161-F214 HydrophobicContact CB-CD1 4.18Å; F161-F214 HydrophobicContact CB-CE1 4.17Å; F161-F214 HydrophobicContact CD2-CB 3.7Å; F161-F214 AromaticContact CD2-CD1 3.87Å; F161-F214 HydrophobicContact CD2-CD1 3.87Å; F161-F214 HydrophobicContact CD2-CD2 4.19Å; F161-F214 AromaticContact CD2-CG 3.66Å; F161-F214 HydrophobicContact CD2-CG 3.66Å; F161-F214 HydrophobicContact CE2-CB 3.94Å; F161-F214 HydrophobicContact CE2-CG 4.34Å
162	R	74.9	Confident	71.1	Confident	156 Å²	156	69.7 Å²	69.7	59%	0.589	36%	0.362	S	S	*	.	H	α-helix	trans	-67.4	-26	174.6	-77.6	170.2	171.3	-175.1	-5.9	114	R158 D159 A160	R158-R162 VanDerWaalsContact O-CG 3.27Å; R158-R162 WeakPolarHBondContact O-CG 3.47Å; R158-R162 PolarHBondContact O-N 3.01Å; R158-R162 VanDerWaalsContact O-N 3.09Å; D159-R162 WeakPolarHBondContact O-CB 3.43Å; D159-R162 PolarHBondContact O-N 3.33Å; D159-R162 IonicContact OD1-NH1 3.76Å; A160-R162 VanDerWaalsContact C-N 3.27Å; A160-R162 PolarHBondContact O-N 3.43Å
163	E	76.8	Confident	72.8	Confident	152 Å²	152	69.7 Å²	69.7	71%	0.71	37%	0.365	S	S	*	.	H	α-helix	trans	-76.1	-30.5	175.8	-167.2	170.5	-179.3	0	0	111.3	D159 A160 F161	D159-E163 PolarHBondContact O-N 2.8Å; D159-E163 VanDerWaalsContact O-N 3.12Å; A160-E163 WeakPolarHBondContact O-CA 3.36Å; A160-E163 WeakPolarHBondContact O-CB 3.29Å; A160-E163 PolarHBondContact O-N 3.32Å; F161-E163 VanDerWaalsContact C-N 3.28Å; F161-E163 PolarHBondContact O-N 3.38Å
164	F	75.2	Confident	74.5	Confident	7 Å²	7	70.1 Å²	70.1	3%	0.031	36%	0.362	C	S	.	.	H	α-helix	trans	-78.6	-47.9	173.6	-76.5	-123	0	0	0	111.1	A160 F161 T166 I172 E176 L177 A180 L184 F214 M218	A160-F164 WeakPolarHBondContact O-CD2 3.27Å; A160-F164 PolarHBondContact O-N 2.98Å; A160-F164 VanDerWaalsContact O-N 3.1Å; F161-F164 PolarHBondContact O-N 3.46Å; F164-T166 VanDerWaalsContact C-N 3.32Å; F164-T166 PolarHBondContact O-N 3.41Å; F164-T166 PolarHBondContact O-OG1 2.98Å; F164-I172 HydrophobicContact CB-CD1 3.5Å; F164-I172 HydrophobicContact CB-CG1 3.83Å; F164-I172 HydrophobicContact CB-CG2 4.19Å; F164-I172 HydrophobicContact CD1-CD1 4.22Å; F164-I172 HydrophobicContact CG-CD1 4.14Å; F164-E176 WeakPolarHBondContact O-CB 3.39Å; F164-L177 HydrophobicContact CD1-CD1 4.13Å; F164-L177 HydrophobicContact CE1-CD1 4.12Å; F164-A180 HydrophobicContact CB-CB 4.22Å; F164-A180 HydrophobicContact CD1-CB 3.27Å; F164-A180 HydrophobicContact CD2-CB 4.02Å; F164-A180 HydrophobicContact CE1-CB 3.55Å; F164-A180 HydrophobicContact CE2-CB 4.28Å; F164-A180 HydrophobicContact CG-CB 3.56Å; F164-A180 HydrophobicContact CZ-CB 4.08Å; F164-L184 HydrophobicContact CE1-CD1 4.17Å; F164-L184 HydrophobicContact CE2-CD1 3.62Å; F164-L184 HydrophobicContact CZ-CD1 3.23Å; F164-F214 HydrophobicContact CD1-CE2 4.05Å; F164-F214 HydrophobicContact CD2-CE2 4.24Å; F164-F214 HydrophobicContact CD2-CZ 4.37Å; F164-F214 HydrophobicContact CE1-CE2 4.08Å; F164-F214 HydrophobicContact CE2-CE2 4.24Å; F164-F214 HydrophobicContact CE2-CZ 4.27Å; F164-F214 HydrophobicContact CG-CE2 4.12Å; F164-F214 HydrophobicContact CZ-CE2 4.14Å; F164-M218 HydrophobicContact CZ-CE 4.24Å
165	D	81	Confident	75.9	Confident	13 Å²	13	68 Å²	68	7%	0.07	36%	0.358	C	S	.	.			trans	-73.2	81.6	176.4	177.8	12.7	0	0	0	111	F161 N167 G168 D169 G170 I172	F161-D165 HydrophobicContact CD1-CB 4.41Å; F161-D165 HydrophobicContact CE1-CB 4.23Å; F161-D165 WeakPolarHBondContact O-CB 3.45Å; F161-D165 PolarHBondContact O-N 2.82Å; D165-N167 VanDerWaalsContact C-N 3.28Å; D165-N167 PolarHBondContact O-N 3.26Å; D165-N167 PolarHBondContact OD1-OD1 3.39Å; D165-N167 VanDerWaalsContact OD1-OD1 3.1Å; D165-G168 PolarHBondContact O-N 3.18Å; D165-G168 WeakPolarHBondContact OD1-CA 3.27Å; D165-G168 PolarHBondContact OD1-N 3.05Å; D165-G168 VanDerWaalsContact OD2-C 3.28Å; D165-G168 VanDerWaalsContact OD2-CA 3.28Å; D165-G168 WeakPolarHBondContact OD2-CA 3.43Å; D165-D169 PolarHBondContact OD1-N 2.93Å; D165-D169 PolarHBondContact OD2-N 2.79Å; D165-G170 VanDerWaalsContact OD2-CA 3.31Å; D165-G170 WeakPolarHBondContact OD2-CA 3.34Å; D165-G170 PolarHBondContact OD2-N 2.87Å; D165-I172 HydrophobicContact CB-CG1 4.34Å
166	T	79.1	Confident	77.5	Confident	110 Å²	110	59.8 Å²	59.8	68%	0.675	33%	0.328	S	S	*	.	S	Bend	trans	-71.1	-28	-174.7	-45.9	0	0	0	0	111.9	F164 E176	F164-T166 VanDerWaalsContact C-N 3.32Å; F164-T166 PolarHBondContact O-N 3.41Å; F164-T166 PolarHBondContact O-OG1 2.98Å; T166-E176 PolarHBondContact N-OE1 3.47Å
167	N	82.7	Confident	78.4	Confident	90 Å²	90	57.1 Å²	57.1	48%	0.481	32%	0.316	S	S	.	.	S	Bend	trans	-88.4	-17.1	-178.3	77	39.6	0	0	0	112.7	D165 D169 E176	D165-N167 VanDerWaalsContact C-N 3.28Å; D165-N167 PolarHBondContact O-N 3.26Å; D165-N167 PolarHBondContact OD1-OD1 3.39Å; D165-N167 VanDerWaalsContact OD1-OD1 3.1Å; N167-D169 PolarHBondContact ND2-OD2 3.03Å; N167-D169 VanDerWaalsContact ND2-OD2 3.07Å; N167-D169 WeakPolarHBondContact OD1-CA 3.43Å; N167-D169 WeakPolarHBondContact OD1-CB 3.13Å; N167-D169 PolarHBondContact OD1-N 2.91Å; N167-D169 PolarHBondContact OD1-OD1 3.05Å; N167-D169 PolarHBondContact OD1-OD2 2.81Å; N167-E176 WeakPolarHBondContact CB-OE1 3.14Å; N167-E176 PolarHBondContact N-OE1 2.91Å; N167-E176 PolarHBondContact ND2-OE1 3.39Å
168	G	83.9	Confident	79	Confident	60 Å²	60	62.2 Å²	62.2	62%	0.619	34%	0.335	S	S	*	.			trans	76.2	22.1	176.8	0	0	0	0	0	114.6	D165 G170	D165-G168 PolarHBondContact O-N 3.18Å; D165-G168 WeakPolarHBondContact OD1-CA 3.27Å; D165-G168 PolarHBondContact OD1-N 3.05Å; D165-G168 VanDerWaalsContact OD2-C 3.28Å; D165-G168 VanDerWaalsContact OD2-CA 3.28Å; D165-G168 WeakPolarHBondContact OD2-CA 3.43Å; G168-G170 PolarHBondContact O-N 2.78Å
169	D	84.9	Confident	79.6	Confident	93 Å²	93	58.8 Å²	58.8	50%	0.497	33%	0.334	S	S	.	.	S	Bend	trans	-81.5	-2.9	-178.4	71.4	16.3	0	0	0	113.3	D165 N167 R171	D165-D169 PolarHBondContact OD1-N 2.93Å; D165-D169 PolarHBondContact OD2-N 2.79Å; N167-D169 PolarHBondContact ND2-OD2 3.03Å; N167-D169 VanDerWaalsContact ND2-OD2 3.07Å; N167-D169 WeakPolarHBondContact OD1-CA 3.43Å; N167-D169 WeakPolarHBondContact OD1-CB 3.13Å; N167-D169 PolarHBondContact OD1-N 2.91Å; N167-D169 PolarHBondContact OD1-OD1 3.05Å; N167-D169 PolarHBondContact OD1-OD2 2.81Å; D169-R171 WeakPolarHBondContact OD1-CA 3.46Å; D169-R171 WeakPolarHBondContact OD1-CB 3.3Å; D169-R171 PolarHBondContact OD1-N 3.21Å
170	G	83	Confident	79.8	Confident	39 Å²	39	55.7 Å²	55.7	40%	0.402	32%	0.318	S	S	.	.	S	Bend	trans	82.6	12.6	179.5	0	0	0	0	0	113.5	F161 D165 G168	F161-G170 VanDerWaalsContact CZ-O 3.29Å; F161-G170 WeakPolarHBondContact CZ-O 3.29Å; D165-G170 VanDerWaalsContact OD2-CA 3.31Å; D165-G170 WeakPolarHBondContact OD2-CA 3.34Å; D165-G170 PolarHBondContact OD2-N 2.87Å; G168-G170 PolarHBondContact O-N 2.78Å
171	R	87.7	Confident	79.7	Confident	98 Å²	98	56 Å²	56	37%	0.37	32%	0.318	S	S	.	.	S	Bend	trans	-139.4	147	178.9	-60.4	178.5	172.8	-117.9	-4.7	109.3	D169 D206 L208	D169-R171 WeakPolarHBondContact OD1-CA 3.46Å; D169-R171 WeakPolarHBondContact OD1-CB 3.3Å; D169-R171 PolarHBondContact OD1-N 3.21Å; R171-D206 IonicContact CZ-OD2 3.99Å; R171-D206 IonicContact NH1-OD2 2.99Å; R171-D206 PolarHBondContact NH1-OD2 3.46Å; R171-L208 HydrophobicContact CB-CB 4.33Å; R171-L208 HydrophobicContact CB-CD1 4.4Å
172	I	84.4	Confident	79.5	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	113.1	176.6	-57.8	164.6	0	0	0	107.9	F161 F164 D165 E176 L177 V209 F214	F161-I172 HydrophobicContact CD2-CD1 3.52Å; F161-I172 HydrophobicContact CD2-CG1 4.1Å; F161-I172 HydrophobicContact CE2-CD1 3.5Å; F161-I172 VanDerWaalsContact CE2-CD1 3.5Å; F161-I172 HydrophobicContact CE2-CG1 3.7Å; F161-I172 HydrophobicContact CG-CD1 4.35Å; F161-I172 HydrophobicContact CZ-CD1 4.32Å; F161-I172 HydrophobicContact CZ-CG1 4.03Å; F164-I172 HydrophobicContact CB-CD1 3.5Å; F164-I172 HydrophobicContact CB-CG1 3.83Å; F164-I172 HydrophobicContact CB-CG2 4.19Å; F164-I172 HydrophobicContact CD1-CD1 4.22Å; F164-I172 HydrophobicContact CG-CD1 4.14Å; D165-I172 HydrophobicContact CB-CG1 4.34Å; I172-E176 HydrophobicContact CG2-CB 3.94Å; I172-L177 HydrophobicContact CG2-CB 3.84Å; I172-L177 HydrophobicContact CG2-CD1 4.45Å; I172-V209 HydrophobicContact CB-CB 4.21Å; I172-V209 PolarHBondContact N-O 2.76Å; I172-V209 PolarHBondContact O-N 3.29Å; I172-F214 HydrophobicContact CD1-CB 4.49Å; I172-F214 HydrophobicContact CD1-CD2 3.48Å; I172-F214 VanDerWaalsContact CD1-CD2 3.48Å; I172-F214 HydrophobicContact CD1-CE2 3.9Å; I172-F214 HydrophobicContact CD1-CG 4.17Å
173	S	86.4	Confident	78.9	Confident	33 Å²	33	56.7 Å²	56.7	23%	0.231	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	161.6	173.2	68.3	0	0	0	0	112.1	G175 E176 L177	S173-G175 PolarHBondContact O-N 3.28Å; S173-G175 VanDerWaalsContact O-N 3.13Å; S173-E176 VanDerWaalsContact CB-OE2 3.25Å; S173-E176 WeakPolarHBondContact CB-OE2 3.25Å; S173-E176 PolarHBondContact N-OE2 3.05Å; S173-E176 WeakPolarHBondContact O-CB 3Å; S173-E176 PolarHBondContact O-N 3.37Å; S173-E176 VanDerWaalsContact OG-CD 3.31Å; S173-E176 PolarHBondContact OG-N 3.35Å; S173-E176 PolarHBondContact OG-OE2 2.96Å; S173-L177 WeakPolarHBondContact O-CB 3.33Å; S173-L177 PolarHBondContact O-N 3.25Å
174	V	83.1	Confident	77.9	Confident	42 Å²	42	52.1 Å²	52.1	26%	0.255	32%	0.321	S	S	.	.	H	α-helix	trans	-52.8	-36.3	173	-173.3	0	0	0	0	112.3	R178 V194 L198	V174-R178 VanDerWaalsContact O-CB 3.25Å; V174-R178 WeakPolarHBondContact O-CB 3.32Å; V174-R178 PolarHBondContact O-N 3.35Å; V174-V194 HydrophobicContact CG1-CG1 3.77Å; V174-L198 HydrophobicContact CG2-CD1 3.89Å; V174-L198 HydrophobicContact CG2-CD2 3.71Å; V174-L198 HydrophobicContact CG2-CG 4.45Å
175	G	82.1	Confident	76.9	Confident	49 Å²	49	56 Å²	56	51%	0.505	34%	0.341	S	S	.	.	H	α-helix	trans	-68	-42.5	178.8	0	0	0	0	0	112.5	S173 A179	S173-G175 PolarHBondContact O-N 3.28Å; S173-G175 VanDerWaalsContact O-N 3.13Å; G175-A179 WeakPolarHBondContact O-CB 3.27Å; G175-A179 PolarHBondContact O-N 2.89Å
176	E	85.1	Confident	75.3	Confident	17 Å²	17	58.5 Å²	58.5	8%	0.079	37%	0.37	C	S	.	.	H	α-helix	trans	-69.1	-46.5	176	-79.9	156.9	158.9	0	0	111.7	F164 T166 N167 I172 S173 R178 A179 A180	F164-E176 WeakPolarHBondContact O-CB 3.39Å; T166-E176 PolarHBondContact N-OE1 3.47Å; N167-E176 WeakPolarHBondContact CB-OE1 3.14Å; N167-E176 PolarHBondContact N-OE1 2.91Å; N167-E176 PolarHBondContact ND2-OE1 3.39Å; I172-E176 HydrophobicContact CG2-CB 3.94Å; S173-E176 VanDerWaalsContact CB-OE2 3.25Å; S173-E176 WeakPolarHBondContact CB-OE2 3.25Å; S173-E176 PolarHBondContact N-OE2 3.05Å; S173-E176 WeakPolarHBondContact O-CB 3Å; S173-E176 PolarHBondContact O-N 3.37Å; S173-E176 VanDerWaalsContact OG-CD 3.31Å; S173-E176 PolarHBondContact OG-N 3.35Å; S173-E176 PolarHBondContact OG-OE2 2.96Å; E176-R178 VanDerWaalsContact C-N 3.31Å; E176-R178 PolarHBondContact O-N 3.24Å; E176-A179 PolarHBondContact O-N 3.33Å; E176-A179 VanDerWaalsContact O-N 3.1Å; E176-A180 VanDerWaalsContact O-CB 3.3Å; E176-A180 WeakPolarHBondContact O-CB 3.22Å; E176-A180 PolarHBondContact O-N 3.45Å
177	L	78.3	Confident	74.3	Confident	1 Å²	1	59.5 Å²	59.5	1%	0.005	37%	0.367	C	S	.	.	H	α-helix	trans	-56.7	-46.6	174.6	-174.9	62.6	0	0	0	110.8	F164 I172 S173 A179 A180 L181 I197 L198	F164-L177 HydrophobicContact CD1-CD1 4.13Å; F164-L177 HydrophobicContact CE1-CD1 4.12Å; I172-L177 HydrophobicContact CG2-CB 3.84Å; I172-L177 HydrophobicContact CG2-CD1 4.45Å; S173-L177 WeakPolarHBondContact O-CB 3.33Å; S173-L177 PolarHBondContact O-N 3.25Å; L177-A179 VanDerWaalsContact C-N 3.35Å; L177-A179 PolarHBondContact O-N 2.89Å; L177-A180 PolarHBondContact O-N 3.37Å; L177-L181 HydrophobicContact CD1-CD1 4Å; L177-L181 HydrophobicContact CD1-CG 4.13Å; L177-L181 HydrophobicContact CG-CD1 3.8Å; L177-L181 HydrophobicContact CG-CG 4.32Å; L177-L181 VanDerWaalsContact O-CB 3.26Å; L177-L181 WeakPolarHBondContact O-CB 3.3Å; L177-L181 WeakPolarHBondContact O-CG 3.15Å; L177-L181 PolarHBondContact O-N 3.13Å; L177-I197 HydrophobicContact CD2-CG2 4.32Å; L177-L198 HydrophobicContact CD2-CD1 3.85Å
178	R	76.3	Confident	73.2	Confident	115 Å²	115	65.3 Å²	65.3	43%	0.434	38%	0.382	S	S	.	.	H	α-helix	trans	-64.3	-39.6	176.7	-170.7	176.6	85.8	173.7	5.7	112.3	V174 E176 K182 V194	V174-R178 VanDerWaalsContact O-CB 3.25Å; V174-R178 WeakPolarHBondContact O-CB 3.32Å; V174-R178 PolarHBondContact O-N 3.35Å; E176-R178 VanDerWaalsContact C-N 3.31Å; E176-R178 PolarHBondContact O-N 3.24Å; R178-K182 WeakPolarHBondContact O-CB 3.38Å; R178-K182 PolarHBondContact O-N 3.2Å; R178-V194 HydrophobicContact CB-CG1 4.29Å; R178-V194 HydrophobicContact CB-CG2 4.19Å; R178-V194 HydrophobicContact CG-CG2 3.85Å
179	A	77.4	Confident	72.3	Confident	55 Å²	55	64 Å²	64	46%	0.455	36%	0.361	S	S	.	.	H	α-helix	trans	-66.3	-44.9	178.5	0	0	0	0	0	111.2	G175 E176 L177 K182 A183	G175-A179 WeakPolarHBondContact O-CB 3.27Å; G175-A179 PolarHBondContact O-N 2.89Å; E176-A179 PolarHBondContact O-N 3.33Å; E176-A179 VanDerWaalsContact O-N 3.1Å; L177-A179 VanDerWaalsContact C-N 3.35Å; L177-A179 PolarHBondContact O-N 2.89Å; A179-K182 PolarHBondContact O-N 3.34Å; A179-A183 WeakPolarHBondContact O-CB 3.39Å; A179-A183 PolarHBondContact O-N 2.52Å
180	A	73.2	Confident	71.7	Confident	12 Å²	12	62.2 Å²	62.2	10%	0.099	36%	0.356	C	S	.	.	H	α-helix	trans	-65.1	-50.1	177.2	0	0	0	0	0	111.4	F164 E176 L177 K182 A183 L184	F164-A180 HydrophobicContact CB-CB 4.22Å; F164-A180 HydrophobicContact CD1-CB 3.27Å; F164-A180 HydrophobicContact CD2-CB 4.02Å; F164-A180 HydrophobicContact CE1-CB 3.55Å; F164-A180 HydrophobicContact CE2-CB 4.28Å; F164-A180 HydrophobicContact CG-CB 3.56Å; F164-A180 HydrophobicContact CZ-CB 4.08Å; E176-A180 VanDerWaalsContact O-CB 3.3Å; E176-A180 WeakPolarHBondContact O-CB 3.22Å; E176-A180 PolarHBondContact O-N 3.45Å; L177-A180 PolarHBondContact O-N 3.37Å; A180-K182 VanDerWaalsContact C-N 3.27Å; A180-K182 PolarHBondContact O-N 3.28Å; A180-A183 CarbonylContact O-C 3.54Å; A180-A183 WeakPolarHBondContact O-CA 3.15Å; A180-A183 WeakPolarHBondContact O-CB 3.09Å; A180-A183 PolarHBondContact O-N 2.81Å; A180-L184 WeakPolarHBondContact O-CB 2.91Å; A180-L184 VanDerWaalsContact O-CG 3.27Å; A180-L184 WeakPolarHBondContact O-CG 3.29Å; A180-L184 PolarHBondContact O-N 3.34Å
181	L	68.3	Low	71.2	Confident	22 Å²	22	65 Å²	65	12%	0.115	36%	0.358	C	S	.	.	H	α-helix	trans	-60.2	-37.7	176.5	-70.5	173.4	0	0	0	112.1	L177 L184 L185 L189 I197	L177-L181 HydrophobicContact CD1-CD1 4Å; L177-L181 HydrophobicContact CD1-CG 4.13Å; L177-L181 HydrophobicContact CG-CD1 3.8Å; L177-L181 HydrophobicContact CG-CG 4.32Å; L177-L181 VanDerWaalsContact O-CB 3.26Å; L177-L181 WeakPolarHBondContact O-CB 3.3Å; L177-L181 WeakPolarHBondContact O-CG 3.15Å; L177-L181 PolarHBondContact O-N 3.13Å; L181-L184 PolarHBondContact O-N 3.08Å; L181-L185 HydrophobicContact CB-CD1 4.44Å; L181-L185 HydrophobicContact CD2-CD1 4.2Å; L181-L185 VanDerWaalsContact O-CB 3.27Å; L181-L185 WeakPolarHBondContact O-CB 3.28Å; L181-L185 PolarHBondContact O-N 3.47Å; L181-L189 HydrophobicContact CB-CD1 3.64Å; L181-L189 HydrophobicContact CD1-CD1 3.64Å; L181-L189 HydrophobicContact CG-CD1 4.21Å; L181-I197 HydrophobicContact CD1-CD1 3.91Å
182	K	65.5	Low	70.6	Confident	99 Å²	99	68.8 Å²	68.8	43%	0.43	37%	0.372	S	S	.	.	H	α-helix	trans	-67.3	-36	173.6	-179.3	-177.6	173.1	-167.2	0	112.4	R178 A179 A180 G186	R178-K182 WeakPolarHBondContact O-CB 3.38Å; R178-K182 PolarHBondContact O-N 3.2Å; A179-K182 PolarHBondContact O-N 3.34Å; A180-K182 VanDerWaalsContact C-N 3.27Å; A180-K182 PolarHBondContact O-N 3.28Å; K182-G186 VanDerWaalsContact O-CA 3.31Å; K182-G186 WeakPolarHBondContact O-CA 3.31Å; K182-G186 PolarHBondContact O-N 2.91Å; K182-G186 VanDerWaalsContact O-N 3.13Å
183	A	61.6	Low	70	Confident	83 Å²	83	72.9 Å²	72.9	69%	0.686	39%	0.391	S	S	*	.	H	α-helix	trans	-70.4	-37.8	176.5	0	0	0	0	0	111.8	A179 A180	A179-A183 WeakPolarHBondContact O-CB 3.39Å; A179-A183 PolarHBondContact O-N 2.52Å; A180-A183 CarbonylContact O-C 3.54Å; A180-A183 WeakPolarHBondContact O-CA 3.15Å; A180-A183 WeakPolarHBondContact O-CB 3.09Å; A180-A183 PolarHBondContact O-N 2.81Å
184	L	57.3	Low	69.4	Low	57 Å²	57	71.3 Å²	71.3	30%	0.298	38%	0.38	S	S	.	.	H	α-helix	trans	-78.7	-52.3	-178	-69.9	173.1	0	0	0	112.4	I66 F164 A180 L181	I66-L184 HydrophobicContact CD1-CB 3.56Å; I66-L184 HydrophobicContact CD1-CD2 3.71Å; I66-L184 HydrophobicContact CD1-CG 4.18Å; I66-L184 VanDerWaalsContact CD1-O 3.24Å; I66-L184 WeakPolarHBondContact CD1-O 3.4Å; I66-L184 HydrophobicContact CG1-CB 3.97Å; I66-L184 HydrophobicContact CG1-CD2 3.86Å; I66-L184 HydrophobicContact CG1-CG 4.32Å; I66-L184 HydrophobicContact CG2-CB 4.43Å; F164-L184 HydrophobicContact CE1-CD1 4.17Å; F164-L184 HydrophobicContact CE2-CD1 3.62Å; F164-L184 HydrophobicContact CZ-CD1 3.23Å; A180-L184 WeakPolarHBondContact O-CB 2.91Å; A180-L184 VanDerWaalsContact O-CG 3.27Å; A180-L184 WeakPolarHBondContact O-CG 3.29Å; A180-L184 PolarHBondContact O-N 3.34Å; L181-L184 PolarHBondContact O-N 3.08Å
185	L	54.1	Low	69	Low	88 Å²	88	74.5 Å²	74.5	46%	0.461	39%	0.393	S	S	.	.	H	α-helix	trans	-86.3	-13.1	-174.9	-62.5	164.1	0	0	0	112.6	I66 L181 E187 L189	I66-L185 HydrophobicContact CG2-CD2 3.57Å; I66-L185 HydrophobicContact CG2-CG 4.24Å; L181-L185 HydrophobicContact CB-CD1 4.44Å; L181-L185 HydrophobicContact CD2-CD1 4.2Å; L181-L185 VanDerWaalsContact O-CB 3.27Å; L181-L185 WeakPolarHBondContact O-CB 3.28Å; L181-L185 PolarHBondContact O-N 3.47Å; L185-E187 PolarHBondContact O-N 3Å; L185-L189 HydrophobicContact CD1-CD1 4.32Å
186	G	46.3	Very low	68.8	Low	65 Å²	65	76.6 Å²	76.6	67%	0.67	39%	0.389	S	S	*	.			trans	67.4	-9.6	-179.6	0	0	0	0	0	114.9	K182	K182-G186 VanDerWaalsContact O-CA 3.31Å; K182-G186 WeakPolarHBondContact O-CA 3.31Å; K182-G186 PolarHBondContact O-N 2.91Å; K182-G186 VanDerWaalsContact O-N 3.13Å
187	E	59.2	Low	68.2	Low	131 Å²	131	78.3 Å²	78.3	61%	0.612	40%	0.398	S	S	*	.	S	Bend	trans	-94.9	148.8	174.6	-84.4	-174.2	155.9	0	0	112.1	L185 L189	L185-E187 PolarHBondContact O-N 3Å; E187-L189 PolarHBondContact O-N 3.39Å
188	R	58.8	Low	68	Low	213 Å²	213	79.1 Å²	79.1	80%	0.804	40%	0.403	S	S	*	.			trans	-80.6	96.9	170.6	-69.2	-173.9	-178.2	-171.6	0	107.8	S190	R188-S190 PolarHBondContact O-N 2.91Å
189	L	65.3	Low	68.2	Low	33 Å²	33	81.2 Å²	81.2	17%	0.173	42%	0.417	C	S	.	.			trans	-57	133.5	165.3	-64.2	177	0	0	0	109.5	L181 L185 E187 E193 V194 I197	L181-L189 HydrophobicContact CB-CD1 3.64Å; L181-L189 HydrophobicContact CD1-CD1 3.64Å; L181-L189 HydrophobicContact CG-CD1 4.21Å; L185-L189 HydrophobicContact CD1-CD1 4.32Å; E187-L189 PolarHBondContact O-N 3.39Å; L189-E193 HydrophobicContact CB-CB 4.44Å; L189-E193 HydrophobicContact CD2-CB 4.38Å; L189-V194 HydrophobicContact CB-CG2 3.82Å; L189-V194 HydrophobicContact CD1-CG2 4.33Å; L189-I197 HydrophobicContact CD1-CD1 4.09Å
190	S	72.6	Confident	68.1	Low	55 Å²	55	84.5 Å²	84.5	39%	0.385	43%	0.427	S	S	.	.			trans	-66.9	156.1	171.3	69.2	0	0	0	0	109.9	R188 R192 E193 V194	R188-S190 PolarHBondContact O-N 2.91Å; S190-R192 PolarHBondContact O-N 3.39Å; S190-R192 VanDerWaalsContact O-N 3.15Å; S190-E193 VanDerWaalsContact CB-OE2 3.26Å; S190-E193 WeakPolarHBondContact CB-OE2 3.08Å; S190-E193 PolarHBondContact N-OE2 2.78Å; S190-E193 PolarHBondContact O-N 2.8Å; S190-E193 VanDerWaalsContact O-N 3.13Å; S190-E193 VanDerWaalsContact OG-CD 3.3Å; S190-E193 WeakPolarHBondContact OG-CG 3.3Å; S190-E193 PolarHBondContact OG-N 3.33Å; S190-E193 PolarHBondContact OG-OE2 3.24Å; S190-V194 PolarHBondContact O-N 3.5Å
191	Q	72.3	Confident	68.2	Low	96 Å²	96	84.7 Å²	84.7	45%	0.449	43%	0.427	S	S	.	.	H	α-helix	trans	-54.5	-37.7	179.2	-166.4	68	26.6	0	0	111.5	V194 E195	Q191-V194 PolarHBondContact O-N 2.95Å; Q191-E195 WeakPolarHBondContact O-CB 3.34Å; Q191-E195 PolarHBondContact O-N 2.99Å
192	R	75	Confident	68.8	Low	179 Å²	179	84.8 Å²	84.8	68%	0.675	43%	0.428	S	S	*	.	H	α-helix	trans	-65.9	-41.9	179.7	-176.1	178.9	170.7	169.2	2	113	S190 V194 E195 E196	S190-R192 PolarHBondContact O-N 3.39Å; S190-R192 VanDerWaalsContact O-N 3.15Å; R192-V194 VanDerWaalsContact C-N 3.33Å; R192-E195 PolarHBondContact O-N 2.87Å; R192-E196 IonicContact CZ-OE1 3.63Å; R192-E196 IonicContact NE-OE1 3.49Å; R192-E196 PolarHBondContact NE-OE1 3.39Å; R192-E196 IonicContact NH2-OE1 2.85Å; R192-E196 WeakPolarHBondContact O-CG 3.32Å; R192-E196 PolarHBondContact O-N 3.1Å
193	E	72.5	Confident	69.4	Low	85 Å²	85	85.1 Å²	85.1	40%	0.397	43%	0.434	S	S	.	.	H	α-helix	trans	-65.9	-38.8	178.1	-71.8	161.2	133.4	0	0	111.3	L189 S190 E195 E196 I197	L189-E193 HydrophobicContact CB-CB 4.44Å; L189-E193 HydrophobicContact CD2-CB 4.38Å; S190-E193 VanDerWaalsContact CB-OE2 3.26Å; S190-E193 WeakPolarHBondContact CB-OE2 3.08Å; S190-E193 PolarHBondContact N-OE2 2.78Å; S190-E193 PolarHBondContact O-N 2.8Å; S190-E193 VanDerWaalsContact O-N 3.13Å; S190-E193 VanDerWaalsContact OG-CD 3.3Å; S190-E193 WeakPolarHBondContact OG-CG 3.3Å; S190-E193 PolarHBondContact OG-N 3.33Å; S190-E193 PolarHBondContact OG-OE2 3.24Å; E193-E195 VanDerWaalsContact C-N 3.31Å; E193-E195 PolarHBondContact O-N 3.44Å; E193-E196 PolarHBondContact O-N 2.87Å; E193-I197 WeakPolarHBondContact O-CD1 3.27Å; E193-I197 VanDerWaalsContact O-CG1 3.22Å; E193-I197 WeakPolarHBondContact O-CG1 3.28Å; E193-I197 PolarHBondContact O-N 3.22Å
194	V	73.6	Confident	70.4	Confident	0 Å²	0	85 Å²	85	0%	0	42%	0.422	C	S	.	.	H	α-helix	trans	-64.9	-38.8	175.1	-179.5	0	0	0	0	110.9	V174 R178 L189 S190 Q191 R192 I197 L198	V174-V194 HydrophobicContact CG1-CG1 3.77Å; R178-V194 HydrophobicContact CB-CG1 4.29Å; R178-V194 HydrophobicContact CB-CG2 4.19Å; R178-V194 HydrophobicContact CG-CG2 3.85Å; L189-V194 HydrophobicContact CB-CG2 3.82Å; L189-V194 HydrophobicContact CD1-CG2 4.33Å; S190-V194 PolarHBondContact O-N 3.5Å; Q191-V194 PolarHBondContact O-N 2.95Å; R192-V194 VanDerWaalsContact C-N 3.33Å; V194-I197 PolarHBondContact O-N 3.13Å; V194-L198 WeakPolarHBondContact O-CB 3.33Å; V194-L198 PolarHBondContact O-N 2.99Å
195	E	74	Confident	71.6	Confident	110 Å²	110	85.2 Å²	85.2	51%	0.514	44%	0.437	S	S	.	.	H	α-helix	trans	-68.9	-38	178.6	-144.3	123	-149	0	0	112.2	Q191 R192 E193 L198 Q199	Q191-E195 WeakPolarHBondContact O-CB 3.34Å; Q191-E195 PolarHBondContact O-N 2.99Å; R192-E195 PolarHBondContact O-N 2.87Å; E193-E195 VanDerWaalsContact C-N 3.31Å; E193-E195 PolarHBondContact O-N 3.44Å; E195-L198 PolarHBondContact O-N 2.76Å; E195-Q199 WeakPolarHBondContact O-CB 3.39Å; E195-Q199 PolarHBondContact O-N 3.26Å
196	E	77.9	Confident	73	Confident	93 Å²	93	84.3 Å²	84.3	44%	0.435	43%	0.433	S	S	.	.	H	α-helix	trans	-64.7	-43.8	173.3	-74.3	172.4	-173.9	0	0	110.7	R192 E193 L198 Q199 D200	R192-E196 IonicContact CZ-OE1 3.63Å; R192-E196 IonicContact NE-OE1 3.49Å; R192-E196 PolarHBondContact NE-OE1 3.39Å; R192-E196 IonicContact NH2-OE1 2.85Å; R192-E196 WeakPolarHBondContact O-CG 3.32Å; R192-E196 PolarHBondContact O-N 3.1Å; E193-E196 PolarHBondContact O-N 2.87Å; E196-L198 VanDerWaalsContact C-N 3.34Å; E196-L198 PolarHBondContact O-N 2.77Å; E196-Q199 PolarHBondContact O-N 2.69Å; E196-D200 PolarHBondContact O-N 2.81Å
197	I	72.6	Confident	74.8	Confident	52 Å²	52	82.5 Å²	82.5	27%	0.267	41%	0.414	S	S	.	.	H	α-helix	trans	-61.5	-43.7	173.6	-67	163.8	0	0	0	110.9	L177 L181 L189 E193 V194 Q199 D200 V201	L177-I197 HydrophobicContact CD2-CG2 4.32Å; L181-I197 HydrophobicContact CD1-CD1 3.91Å; L189-I197 HydrophobicContact CD1-CD1 4.09Å; E193-I197 WeakPolarHBondContact O-CD1 3.27Å; E193-I197 VanDerWaalsContact O-CG1 3.22Å; E193-I197 WeakPolarHBondContact O-CG1 3.28Å; E193-I197 PolarHBondContact O-N 3.22Å; V194-I197 PolarHBondContact O-N 3.13Å; I197-Q199 VanDerWaalsContact C-N 3.33Å; I197-Q199 PolarHBondContact O-N 3.44Å; I197-D200 PolarHBondContact O-N 3.12Å; I197-V201 HydrophobicContact CG2-CG2 4.41Å; I197-V201 VanDerWaalsContact O-CG2 3.26Å; I197-V201 WeakPolarHBondContact O-CG2 3.16Å; I197-V201 PolarHBondContact O-N 2.94Å
198	L	75.1	Confident	76.1	Confident	18 Å²	18	78.7 Å²	78.7	9%	0.094	40%	0.398	C	S	.	.	H	α-helix	trans	-62.2	-43.1	179	-154.2	87.4	0	0	0	110.9	V174 L177 V194 E195 E196 D200 V201 D202 V209	V174-L198 HydrophobicContact CG2-CD1 3.89Å; V174-L198 HydrophobicContact CG2-CD2 3.71Å; V174-L198 HydrophobicContact CG2-CG 4.45Å; L177-L198 HydrophobicContact CD2-CD1 3.85Å; V194-L198 WeakPolarHBondContact O-CB 3.33Å; V194-L198 PolarHBondContact O-N 2.99Å; E195-L198 PolarHBondContact O-N 2.76Å; E196-L198 VanDerWaalsContact C-N 3.34Å; E196-L198 PolarHBondContact O-N 2.77Å; L198-D200 PolarHBondContact O-N 2.97Å; L198-V201 PolarHBondContact O-N 3.45Å; L198-V201 VanDerWaalsContact O-N 3.16Å; L198-D202 HydrophobicContact CG-CB 4.36Å; L198-D202 WeakPolarHBondContact O-CB 3.39Å; L198-D202 PolarHBondContact O-N 2.92Å; L198-V209 HydrophobicContact CD1-CG2 4.17Å
199	Q	78.7	Confident	77.3	Confident	160 Å²	160	68.6 Å²	68.6	75%	0.748	36%	0.36	S	S	*	.	H	α-helix	trans	-60.9	-31.2	178.3	-112.6	-177.7	6.3	0	0	113.8	E195 E196 I197	E195-Q199 WeakPolarHBondContact O-CB 3.39Å; E195-Q199 PolarHBondContact O-N 3.26Å; E196-Q199 PolarHBondContact O-N 2.69Å; I197-Q199 VanDerWaalsContact C-N 3.33Å; I197-Q199 PolarHBondContact O-N 3.44Å
200	D	76.5	Confident	78.4	Confident	124 Å²	124	68.9 Å²	68.9	66%	0.663	36%	0.362	S	S	*	.	H	α-helix	trans	-82	-21.4	179.8	-78.7	-14	0	0	0	112.9	E196 I197 L198	E196-D200 PolarHBondContact O-N 2.81Å; I197-D200 PolarHBondContact O-N 3.12Å; L198-D200 PolarHBondContact O-N 2.97Å
201	V	74	Confident	78.7	Confident	16 Å²	16	69.3 Å²	69.3	10%	0.097	36%	0.357	C	S	.	.	H	α-helix	trans	-108.5	-38.3	-171.6	179	0	0	0	0	112.9	I197 L198 L203 V209 E213 M217	I197-V201 HydrophobicContact CG2-CG2 4.41Å; I197-V201 VanDerWaalsContact O-CG2 3.26Å; I197-V201 WeakPolarHBondContact O-CG2 3.16Å; I197-V201 PolarHBondContact O-N 2.94Å; L198-V201 PolarHBondContact O-N 3.45Å; L198-V201 VanDerWaalsContact O-N 3.16Å; V201-L203 PolarHBondContact O-N 2.85Å; V201-L203 VanDerWaalsContact O-N 3.16Å; V201-V209 HydrophobicContact CG1-CG1 3.76Å; V201-V209 HydrophobicContact CG1-CG2 3.99Å; V201-E213 HydrophobicContact CG1-CB 4.35Å; V201-M217 HydrophobicContact CG1-CB 3.94Å; V201-M217 HydrophobicContact CG1-CG 4.35Å; V201-M217 HydrophobicContact CG1-SD 4.2Å; V201-M217 HydrophobicContact CG2-CB 4Å; V201-M217 HydrophobicContact CG2-CG 3.69Å; V201-M217 HydrophobicContact CG2-SD 3.83Å
202	D	81.2	Confident	79.1	Confident	24 Å²	24	72.3 Å²	72.3	13%	0.128	37%	0.371	C	S	.	.			trans	-75.4	97.3	178.1	178	8.7	0	0	0	110.2	L198 N204 G205 D206 G207	L198-D202 HydrophobicContact CG-CB 4.36Å; L198-D202 WeakPolarHBondContact O-CB 3.39Å; L198-D202 PolarHBondContact O-N 2.92Å; D202-N204 PolarHBondContact OD1-N 3.5Å; D202-N204 PolarHBondContact OD1-OD1 3.44Å; D202-N204 VanDerWaalsContact OD1-OD1 3.04Å; D202-G205 VanDerWaalsContact OD1-CA 3.28Å; D202-G205 WeakPolarHBondContact OD1-CA 3.5Å; D202-G205 PolarHBondContact OD1-N 2.88Å; D202-G205 WeakPolarHBondContact OD2-CA 3.41Å; D202-D206 PolarHBondContact OD1-N 3.29Å; D202-D206 PolarHBondContact OD2-N 3.48Å; D202-G207 VanDerWaalsContact OD2-CA 3.28Å; D202-G207 WeakPolarHBondContact OD2-CA 3.28Å; D202-G207 PolarHBondContact OD2-N 2.95Å
203	L	79.3	Confident	79.4	Confident	106 Å²	106	64.1 Å²	64.1	56%	0.555	34%	0.34	S	S	*	.	S	Bend	trans	-86.4	-28.8	-176.7	-65.4	179.2	0	0	0	111.9	V201 E213	V201-L203 PolarHBondContact O-N 2.85Å; V201-L203 VanDerWaalsContact O-N 3.16Å; L203-E213 PolarHBondContact N-OE1 2.69Å
204	N	81.4	Confident	79.6	Confident	80 Å²	80	60.1 Å²	60.1	43%	0.428	32%	0.321	S	S	.	.	S	Bend	trans	-87.4	-15.1	-176.5	72.4	35.8	0	0	0	112.1	D202 D206 E213	D202-N204 PolarHBondContact OD1-N 3.5Å; D202-N204 PolarHBondContact OD1-OD1 3.44Å; D202-N204 VanDerWaalsContact OD1-OD1 3.04Å; N204-D206 PolarHBondContact ND2-OD2 3.43Å; N204-D206 WeakPolarHBondContact OD1-CB 3.33Å; N204-D206 PolarHBondContact OD1-N 3.02Å; N204-D206 PolarHBondContact OD1-OD1 2.85Å; N204-D206 VanDerWaalsContact OD1-OD1 3.13Å; N204-D206 PolarHBondContact OD1-OD2 3.07Å; N204-E213 PolarHBondContact N-OE1 3.26Å; N204-E213 PolarHBondContact ND2-OE1 2.85Å
205	G	83.5	Confident	79.5	Confident	61 Å²	61	62 Å²	62	63%	0.629	33%	0.333	S	S	*	.			trans	74.2	22.1	176.6	0	0	0	0	0	114	D202 G207	D202-G205 VanDerWaalsContact OD1-CA 3.28Å; D202-G205 WeakPolarHBondContact OD1-CA 3.5Å; D202-G205 PolarHBondContact OD1-N 2.88Å; D202-G205 WeakPolarHBondContact OD2-CA 3.41Å; G205-G207 VanDerWaalsContact C-N 3.33Å
206	D	83.8	Confident	79.3	Confident	69 Å²	69	63.5 Å²	63.5	37%	0.369	33%	0.334	S	S	.	.	S	Bend	trans	-88.1	-2.7	-178.1	78.1	10.6	0	0	0	113.6	R171 D202 N204 L208	R171-D206 IonicContact CZ-OD2 3.99Å; R171-D206 IonicContact NH1-OD2 2.99Å; R171-D206 PolarHBondContact NH1-OD2 3.46Å; D202-D206 PolarHBondContact OD1-N 3.29Å; D202-D206 PolarHBondContact OD2-N 3.48Å; N204-D206 PolarHBondContact ND2-OD2 3.43Å; N204-D206 WeakPolarHBondContact OD1-CB 3.33Å; N204-D206 PolarHBondContact OD1-N 3.02Å; N204-D206 PolarHBondContact OD1-OD1 2.85Å; N204-D206 VanDerWaalsContact OD1-OD1 3.13Å; N204-D206 PolarHBondContact OD1-OD2 3.07Å; D206-L208 PolarHBondContact O-N 3.41Å; D206-L208 WeakPolarHBondContact OD1-CA 3.09Å; D206-L208 VanDerWaalsContact OD1-CB 3.27Å; D206-L208 WeakPolarHBondContact OD1-CB 3.42Å; D206-L208 PolarHBondContact OD1-N 3.46Å
207	G	83	Confident	78.9	Confident	27 Å²	27	61.3 Å²	61.3	28%	0.278	32%	0.324	S	S	.	.	S	Bend	trans	75.6	11	178.6	0	0	0	0	0	113.7	D202 G205	D202-G207 VanDerWaalsContact OD2-CA 3.28Å; D202-G207 WeakPolarHBondContact OD2-CA 3.28Å; D202-G207 PolarHBondContact OD2-N 2.95Å; G205-G207 VanDerWaalsContact C-N 3.33Å
208	L	86.5	Confident	78.4	Confident	51 Å²	51	60.3 Å²	60.3	27%	0.267	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	160.4	175.8	-53.7	171.5	0	0	0	108.6	R171 D206	R171-L208 HydrophobicContact CB-CB 4.33Å; R171-L208 HydrophobicContact CB-CD1 4.4Å; D206-L208 PolarHBondContact O-N 3.41Å; D206-L208 WeakPolarHBondContact OD1-CA 3.09Å; D206-L208 VanDerWaalsContact OD1-CB 3.27Å; D206-L208 WeakPolarHBondContact OD1-CB 3.42Å; D206-L208 PolarHBondContact OD1-N 3.46Å
209	V	85.1	Confident	77.3	Confident	1 Å²	1	62.8 Å²	62.8	1%	0.006	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	113.7	174.8	179.2	0	0	0	0	108.5	I172 L198 V201 E213 F214	I172-V209 HydrophobicContact CB-CB 4.21Å; I172-V209 PolarHBondContact N-O 2.76Å; I172-V209 PolarHBondContact O-N 3.29Å; L198-V209 HydrophobicContact CD1-CG2 4.17Å; V201-V209 HydrophobicContact CG1-CG1 3.76Å; V201-V209 HydrophobicContact CG1-CG2 3.99Å; V209-E213 HydrophobicContact CG1-CB 3.88Å; V209-F214 HydrophobicContact CG1-CB 4.02Å
210	D	87.4	Confident	75.8	Confident	40 Å²	40	65.6 Å²	65.6	21%	0.214	34%	0.341	C	S	.	.			trans	-81.2	174.6	173.9	72.4	46.1	0	0	0	112.5	E212 E213 F214	D210-E212 VanDerWaalsContact C-N 3.28Å; D210-E212 PolarHBondContact O-N 3.25Å; D210-E212 WeakPolarHBondContact OD1-CA 3.34Å; D210-E212 WeakPolarHBondContact OD1-CB 3.34Å; D210-E212 PolarHBondContact OD1-N 3.49Å; D210-E213 PolarHBondContact N-OE2 3.29Å; D210-E213 PolarHBondContact O-N 3.47Å; D210-E213 PolarHBondContact OD1-N 3.25Å; D210-F214 WeakPolarHBondContact O-CB 3.49Å; D210-F214 PolarHBondContact O-N 3.38Å
211	F	80.3	Confident	75.7	Confident	64 Å²	64	62.7 Å²	62.7	28%	0.281	33%	0.325	S	S	.	.	H	α-helix	trans	-62	-35.4	-177.4	-176.8	-107.7	0	0	0	112.9	V154 L157 R158 F161 V215	V154-F211 HydrophobicContact CG1-CE1 4.41Å; V154-F211 HydrophobicContact CG1-CZ 4.27Å; L157-F211 HydrophobicContact CB-CE2 4.13Å; L157-F211 HydrophobicContact CB-CZ 4.1Å; R158-F211 HydrophobicContact CB-CE2 3.98Å; R158-F211 HydrophobicContact CB-CZ 4.18Å; R158-F211 HydrophobicContact CG-CE2 4.27Å; F161-F211 HydrophobicContact CB-CD2 3.91Å; F161-F211 HydrophobicContact CB-CE2 4.13Å; F161-F211 HydrophobicContact CD1-CD2 4.23Å; F161-F211 HydrophobicContact CD2-CB 4.41Å; F161-F211 AromaticContact CD2-CD2 3.85Å; F161-F211 HydrophobicContact CD2-CD2 3.85Å; F161-F211 HydrophobicContact CE2-CB 4.17Å; F161-F211 HydrophobicContact CE2-CD2 4.44Å; F161-F211 AromaticContact CG-CD2 3.73Å; F161-F211 HydrophobicContact CG-CD2 3.73Å; F161-F211 HydrophobicContact CG-CE2 4.44Å; F161-F211 HydrophobicContact CZ-CB 4.27Å; F211-V215 HydrophobicContact CD1-CG2 4.13Å; F211-V215 HydrophobicContact CD2-CG2 4.47Å; F211-V215 HydrophobicContact CE1-CG2 3.77Å; F211-V215 HydrophobicContact CE2-CG2 4.13Å; F211-V215 HydrophobicContact CG-CG2 4.48Å; F211-V215 HydrophobicContact CZ-CG2 3.78Å; F211-V215 WeakPolarHBondContact O-CB 3.2Å; F211-V215 WeakPolarHBondContact O-CG2 3.23Å; F211-V215 PolarHBondContact O-N 3.09Å
212	E	79.9	Confident	75.8	Confident	158 Å²	158	65.2 Å²	65.2	74%	0.738	34%	0.337	S	S	*	.	H	α-helix	trans	-72.4	-40	-179.2	-166.7	172.7	173.1	0	0	110.8	D210 V215 R216	D210-E212 VanDerWaalsContact C-N 3.28Å; D210-E212 PolarHBondContact O-N 3.25Å; D210-E212 WeakPolarHBondContact OD1-CA 3.34Å; D210-E212 WeakPolarHBondContact OD1-CB 3.34Å; D210-E212 PolarHBondContact OD1-N 3.49Å; E212-V215 PolarHBondContact O-N 3.44Å; E212-R216 WeakPolarHBondContact O-CB 3.16Å; E212-R216 PolarHBondContact O-N 3.34Å
213	E	81.9	Confident	75.5	Confident	8 Å²	8	67.4 Å²	67.4	4%	0.037	35%	0.349	C	S	.	.	H	α-helix	trans	-65.4	-41	173.2	-68.2	170.7	147.5	0	0	111.8	V201 L203 N204 V209 D210 R216 M217	V201-E213 HydrophobicContact CG1-CB 4.35Å; L203-E213 PolarHBondContact N-OE1 2.69Å; N204-E213 PolarHBondContact N-OE1 3.26Å; N204-E213 PolarHBondContact ND2-OE1 2.85Å; V209-E213 HydrophobicContact CG1-CB 3.88Å; D210-E213 PolarHBondContact N-OE2 3.29Å; D210-E213 PolarHBondContact O-N 3.47Å; D210-E213 PolarHBondContact OD1-N 3.25Å; E213-R216 PolarHBondContact O-N 2.99Å; E213-M217 PolarHBondContact O-N 2.88Å
214	F	76.1	Confident	75.3	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-63.8	-44	174.8	-179	-96	0	0	0	112.5	L157 A160 F161 F164 I172 V209 D210 R216 M217 M218	L157-F214 HydrophobicContact CD2-CE1 4.35Å; A160-F214 HydrophobicContact CB-CE1 4.2Å; A160-F214 HydrophobicContact CB-CZ 4.05Å; F161-F214 HydrophobicContact CB-CD1 4.18Å; F161-F214 HydrophobicContact CB-CE1 4.17Å; F161-F214 HydrophobicContact CD2-CB 3.7Å; F161-F214 AromaticContact CD2-CD1 3.87Å; F161-F214 HydrophobicContact CD2-CD1 3.87Å; F161-F214 HydrophobicContact CD2-CD2 4.19Å; F161-F214 AromaticContact CD2-CG 3.66Å; F161-F214 HydrophobicContact CD2-CG 3.66Å; F161-F214 HydrophobicContact CE2-CB 3.94Å; F161-F214 HydrophobicContact CE2-CG 4.34Å; F164-F214 HydrophobicContact CD1-CE2 4.05Å; F164-F214 HydrophobicContact CD2-CE2 4.24Å; F164-F214 HydrophobicContact CD2-CZ 4.37Å; F164-F214 HydrophobicContact CE1-CE2 4.08Å; F164-F214 HydrophobicContact CE2-CE2 4.24Å; F164-F214 HydrophobicContact CE2-CZ 4.27Å; F164-F214 HydrophobicContact CG-CE2 4.12Å; F164-F214 HydrophobicContact CZ-CE2 4.14Å; I172-F214 HydrophobicContact CD1-CB 4.49Å; I172-F214 HydrophobicContact CD1-CD2 3.48Å; I172-F214 VanDerWaalsContact CD1-CD2 3.48Å; I172-F214 HydrophobicContact CD1-CE2 3.9Å; I172-F214 HydrophobicContact CD1-CG 4.17Å; V209-F214 HydrophobicContact CG1-CB 4.02Å; D210-F214 WeakPolarHBondContact O-CB 3.49Å; D210-F214 PolarHBondContact O-N 3.38Å; F214-R216 VanDerWaalsContact C-N 3.29Å; F214-R216 PolarHBondContact O-N 3.49Å; F214-M217 HydrophobicContact CD2-CE 3.63Å; F214-M217 HydrophobicContact CE2-CE 3.7Å; F214-M217 WeakPolarHBondContact O-CB 3.27Å; F214-M217 PolarHBondContact O-N 2.83Å; F214-M218 HydrophobicContact CD1-CG 4.41Å; F214-M218 HydrophobicContact CE1-CE 4.27Å; F214-M218 HydrophobicContact CE1-CG 4.07Å; F214-M218 HydrophobicContact CE2-CE 3.69Å; F214-M218 HydrophobicContact CZ-CE 3.47Å; F214-M218 VanDerWaalsContact CZ-CE 3.47Å; F214-M218 HydrophobicContact CZ-CG 4.19Å; F214-M218 WeakPolarHBondContact O-CG 3.38Å; F214-M218 PolarHBondContact O-N 3.15Å; F214-M218 VanDerWaalsContact O-N 3.08Å
215	V	71.8	Confident	74.9	Confident	39 Å²	39	64.3 Å²	64.3	24%	0.236	33%	0.331	C	S	.	.	H	α-helix	trans	-58.7	-46.4	174.4	169	0	0	0	0	109.5	L157 F211 E212 M217 M218 S219	L157-V215 HydrophobicContact CB-CG2 4.39Å; L157-V215 HydrophobicContact CD1-CB 4.29Å; L157-V215 HydrophobicContact CD1-CG1 3.94Å; L157-V215 HydrophobicContact CD1-CG2 3.81Å; F211-V215 HydrophobicContact CD1-CG2 4.13Å; F211-V215 HydrophobicContact CD2-CG2 4.47Å; F211-V215 HydrophobicContact CE1-CG2 3.77Å; F211-V215 HydrophobicContact CE2-CG2 4.13Å; F211-V215 HydrophobicContact CG-CG2 4.48Å; F211-V215 HydrophobicContact CZ-CG2 3.78Å; F211-V215 WeakPolarHBondContact O-CB 3.2Å; F211-V215 WeakPolarHBondContact O-CG2 3.23Å; F211-V215 PolarHBondContact O-N 3.09Å; E212-V215 PolarHBondContact O-N 3.44Å; V215-M217 VanDerWaalsContact C-N 3.31Å; V215-M217 PolarHBondContact O-N 3.23Å; V215-M218 CarbonylContact O-C 3.58Å; V215-M218 PolarHBondContact O-N 3.05Å; V215-S219 WeakPolarHBondContact O-CB 3.4Å; V215-S219 PolarHBondContact O-N 2.95Å; V215-S219 PolarHBondContact O-OG 3.25Å; V215-S219 VanDerWaalsContact O-OG 3.09Å
216	R	69.2	Low	74.3	Confident	143 Å²	143	64.5 Å²	64.5	54%	0.54	31%	0.311	S	S	.	.	H	α-helix	trans	-64.1	-34.7	179.8	-164.7	-177.2	-170.7	132.5	1.9	113.2	E212 E213 F214 M218	E212-R216 WeakPolarHBondContact O-CB 3.16Å; E212-R216 PolarHBondContact O-N 3.34Å; E213-R216 PolarHBondContact O-N 2.99Å; F214-R216 VanDerWaalsContact C-N 3.29Å; F214-R216 PolarHBondContact O-N 3.49Å; R216-M218 VanDerWaalsContact C-N 3.32Å
217	M	69.4	Low	73.7	Confident	46 Å²	46	64.1 Å²	64.1	23%	0.227	31%	0.307	C	S	.	.	H	α-helix	trans	-62.6	-40.1	171.9	-178	-173.9	73.2	0	0	111.4	V201 E213 F214 V215	V201-M217 HydrophobicContact CG1-CB 3.94Å; V201-M217 HydrophobicContact CG1-CG 4.35Å; V201-M217 HydrophobicContact CG1-SD 4.2Å; V201-M217 HydrophobicContact CG2-CB 4Å; V201-M217 HydrophobicContact CG2-CG 3.69Å; V201-M217 HydrophobicContact CG2-SD 3.83Å; E213-M217 PolarHBondContact O-N 2.88Å; F214-M217 HydrophobicContact CD2-CE 3.63Å; F214-M217 HydrophobicContact CE2-CE 3.7Å; F214-M217 WeakPolarHBondContact O-CB 3.27Å; F214-M217 PolarHBondContact O-N 2.83Å; V215-M217 VanDerWaalsContact C-N 3.31Å; V215-M217 PolarHBondContact O-N 3.23Å
218	M	62.8	Low	73	Confident	32 Å²	32	67 Å²	67	16%	0.158	31%	0.309	C	S	.	.	H	α-helix	trans	-83.5	-17.1	-178	-65.4	-60.3	-168.8	0	0	114.2	S65 I152 L157 F164 F214 V215 R216	S65-M218 WeakPolarHBondContact OG-CE 3.02Å; I152-M218 HydrophobicContact CD1-CB 4.37Å; L157-M218 HydrophobicContact CD2-CB 3.85Å; L157-M218 HydrophobicContact CD2-CG 4.12Å; F164-M218 HydrophobicContact CZ-CE 4.24Å; F214-M218 HydrophobicContact CD1-CG 4.41Å; F214-M218 HydrophobicContact CE1-CE 4.27Å; F214-M218 HydrophobicContact CE1-CG 4.07Å; F214-M218 HydrophobicContact CE2-CE 3.69Å; F214-M218 HydrophobicContact CZ-CE 3.47Å; F214-M218 VanDerWaalsContact CZ-CE 3.47Å; F214-M218 HydrophobicContact CZ-CG 4.19Å; F214-M218 WeakPolarHBondContact O-CG 3.38Å; F214-M218 PolarHBondContact O-N 3.15Å; F214-M218 VanDerWaalsContact O-N 3.08Å; V215-M218 CarbonylContact O-C 3.58Å; V215-M218 PolarHBondContact O-N 3.05Å; R216-M218 VanDerWaalsContact C-N 3.32Å
219	S	51.9	Low	71.8	Confident	70 Å²	70	68.3 Å²	68.3	49%	0.49	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	6.8	179.2	-63.2	0	0	0	0	114.5	V215	V215-S219 WeakPolarHBondContact O-CB 3.4Å; V215-S219 PolarHBondContact O-N 2.95Å; V215-S219 PolarHBondContact O-OG 3.25Å; V215-S219 VanDerWaalsContact O-OG 3.09Å
220	R	46.2	Very low	70.6	Confident	219 Å²	219	74.5 Å²	74.5	83%	0.826	34%	0.341	S	S	*	.			trans	-106.7	0	179.1	-101.2	-173.8	167	-171.2	-2	111.8

Retrieved 220 of 220 residues in 104.2 ms (Link to these results)

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