YME1_SCHMA Loading...

ATP-dependent zinc metalloprotease YME1 homolog

Putative ATP-dependent protease.

AlphaFold DB , UniProt , Accession P46508, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 662 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	31.4	Very low	28.1	Very low	237 Å²	237	162.1 Å²	162.1	100%	1.167	84%	0.844	S	S	*	*				0	105.7	0	-82.3	174.4	130.6	0	0	107.1	V3	M1-V3 PolarHBondContact O-N 2.93Å
2	I	30.1	Very low	27.8	Very low	171 Å²	171	158.3 Å²	158.3	88%	0.877	83%	0.833	S	S	*	*			trans	-72.5	107	178.2	-66.2	169.1	0	0	0	106.3	S4	I2-S4 PolarHBondContact O-N 2.9Å
3	V	30.6	Very low	27.6	Very low	130 Å²	130	155.7 Å²	155.7	79%	0.788	83%	0.834	S	S	*	*			trans	-71.8	119.1	168.7	177.4	0	0	0	0	106.4	M1	M1-V3 PolarHBondContact O-N 2.93Å
4	S	28	Very low	27.5	Very low	80 Å²	80	153.9 Å²	153.9	56%	0.559	84%	0.837	S	S	*	*			trans	-47.2	124.9	177.1	172.2	0	0	0	0	111.7	I2 C6	I2-S4 PolarHBondContact O-N 2.9Å; S4-C6 PolarHBondContact O-N 3.42Å
5	P	30.8	Very low	27.5	Very low	122 Å²	122	151.8 Å²	151.8	79%	0.792	83%	0.831	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	68.4	172.3	35.5	-30.7	0	0	0	109.2
6	C	29.9	Very low	27.6	Very low	111 Å²	111	148.5 Å²	148.5	75%	0.75	82%	0.822	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.1	3.5	164.8	-74.8	0	0	0	0	113	S4	S4-C6 PolarHBondContact O-N 3.42Å
7	C	25.7	Very low	27.7	Very low	126 Å²	126	149.3 Å²	149.3	85%	0.851	83%	0.825	S	S	*	*	S	Bend	trans	-129.1	70.2	176	-71.6	0	0	0	0	111.7
8	R	24.2	Very low	27.7	Very low	235 Å²	235	153.8 Å²	153.8	89%	0.887	83%	0.827	S	S	*	*	S	Bend	trans	-158.8	130.4	153.6	-119.8	173.4	-173.7	179.4	0.7	109.9
9	I	26.8	Very low	27.9	Very low	161 Å²	161	147.8 Å²	147.8	83%	0.826	81%	0.806	S	S	*	*			trans	85.6	82	173.7	-44.3	162.1	0	0	0	113.8
10	I	28.2	Very low	28.2	Very low	175 Å²	175	145.9 Å²	145.9	90%	0.897	80%	0.799	S	S	*	*				-145.5	84.8	112.2	-77.2	147.2	0	0	0	104.5
11	R	23.8	Very low	28.5	Very low	235 Å²	235	146.2 Å²	146.2	89%	0.887	79%	0.793	S	S	*	*			trans	-92.3	116.5	156.1	-107.3	-175.2	179.3	179.4	-1.6	105
12	T	24.6	Very low	28.6	Very low	116 Å²	116	142.1 Å²	142.1	71%	0.712	77%	0.771	S	S	*	*			trans	33.8	104.9	144.5	48.3	0	0	0	0	117.6
13	C	25.3	Very low	29.1	Very low	125 Å²	125	137 Å²	137	85%	0.845	75%	0.75	S	S	*	*			trans	-136.9	76.3	144.1	-101.6	0	0	0	0	109	V15	C13-V15 PolarHBondContact O-N 3.23Å; C13-V15 VanDerWaalsContact O-N 3.12Å
14	C	25.3	Very low	29.2	Very low	131 Å²	131	138.7 Å²	138.7	89%	0.885	74%	0.742	S	S	*	*			trans	-71.9	77.5	153.3	-72	0	0	0	0	108.1
15	V	28.1	Very low	29.6	Very low	122 Å²	122	138.7 Å²	138.7	74%	0.739	74%	0.735	S	S	*	*			trans	-148.2	113.6	165.2	-178.1	0	0	0	0	109.4	C13	C13-V15 PolarHBondContact O-N 3.23Å; C13-V15 VanDerWaalsContact O-N 3.12Å
16	S	28.4	Very low	30	Very low	99 Å²	99	136.3 Å²	136.3	69%	0.692	73%	0.726	S	S	*	*			trans	59.9	114.4	153.1	-174.9	0	0	0	0	119.6	R18	S16-R18 VanDerWaalsContact C-N 3.3Å; S16-R18 PolarHBondContact O-N 3.38Å
17	N	30.1	Very low	30.5	Very low	162 Å²	162	135 Å²	135	87%	0.866	72%	0.723	S	S	*	*	S	Bend	trans	-27.3	61.2	158.9	-100.9	-15	0	0	0	118.9
18	R	27.7	Very low	31	Very low	230 Å²	230	135 Å²	135	87%	0.868	71%	0.714	S	S	*	*			trans	-139.4	66.1	165.4	-70.3	-169.4	-175.2	-177.8	2.5	111.5	S16	S16-R18 VanDerWaalsContact C-N 3.3Å; S16-R18 PolarHBondContact O-N 3.38Å
19	G	31.7	Very low	31.4	Very low	41 Å²	41	131.5 Å²	131.5	42%	0.423	70%	0.702	S	S	.	*			trans	-78.3	124.3	164.8	0	0	0	0	0	110.4
20	T	34.4	Very low	31.8	Very low	109 Å²	109	129.2 Å²	129.2	67%	0.669	70%	0.698	S	S	*	*			trans	-64.7	153.2	174.3	52.2	0	0	0	0	110.9	H22 S23	T20-H22 PolarHBondContact O-N 3.44Å; T20-S23 PolarHBondContact O-N 2.89Å; T20-S23 PolarHBondContact O-OG 3.05Å
21	F	34.1	Very low	31.9	Very low	153 Å²	153	125.8 Å²	125.8	67%	0.671	69%	0.689	S	S	*	*	H	α-helix	trans	-46.2	-34.2	-174.3	-176.3	-108.4	0	0	0	114.4	R24 L25	F21-R24 PolarHBondContact O-N 3.16Å; F21-L25 HydrophobicContact CD1-CD1 3.73Å; F21-L25 HydrophobicContact CE1-CD1 3.24Å; F21-L25 HydrophobicContact CE2-CD1 4.41Å; F21-L25 HydrophobicContact CG-CD1 4.5Å; F21-L25 HydrophobicContact CZ-CD1 3.63Å; F21-L25 PolarHBondContact O-N 2.77Å; F21-L25 VanDerWaalsContact O-N 3.14Å
22	H	33	Very low	32	Very low	151 Å²	151	125 Å²	125	70%	0.699	69%	0.688	S	S	*	*	H	α-helix	trans	-67.9	-34.2	177.7	-77.7	37.4	0	0	0	113.9	T20 R24 L25 A26	T20-H22 PolarHBondContact O-N 3.44Å; H22-R24 VanDerWaalsContact C-N 3.31Å; H22-R24 PolarHBondContact O-N 3.15Å; H22-L25 PolarHBondContact O-N 3.12Å; H22-A26 PolarHBondContact O-N 3.08Å; H22-A26 VanDerWaalsContact O-N 3.12Å
23	S	40.5	Very low	32.2	Very low	64 Å²	64	126.3 Å²	126.3	45%	0.448	69%	0.689	S	S	.	*	H	α-helix	trans	-68.5	-31.4	175.9	65.7	0	0	0	0	112.5	T20	T20-S23 PolarHBondContact O-N 2.89Å; T20-S23 PolarHBondContact O-OG 3.05Å
24	R	33.7	Very low	32.2	Very low	165 Å²	165	130.1 Å²	130.1	62%	0.623	69%	0.691	S	S	*	*	H	α-helix	trans	-73.4	-37.7	174.8	-67	-175.8	179.5	-179.2	-1.5	112	F21 H22 A27 L28	F21-R24 PolarHBondContact O-N 3.16Å; H22-R24 VanDerWaalsContact C-N 3.31Å; H22-R24 PolarHBondContact O-N 3.15Å; R24-A27 PolarHBondContact O-N 3.03Å; R24-L28 PolarHBondContact O-N 3.02Å
25	L	35	Very low	32.4	Very low	79 Å²	79	130.6 Å²	130.6	41%	0.414	68%	0.683	S	S	.	*	H	α-helix	trans	-68.1	-39	178.2	-109.1	150	0	0	0	112.9	F21 H22 A27 L28 Y29	F21-L25 HydrophobicContact CD1-CD1 3.73Å; F21-L25 HydrophobicContact CE1-CD1 3.24Å; F21-L25 HydrophobicContact CE2-CD1 4.41Å; F21-L25 HydrophobicContact CG-CD1 4.5Å; F21-L25 HydrophobicContact CZ-CD1 3.63Å; F21-L25 PolarHBondContact O-N 2.77Å; F21-L25 VanDerWaalsContact O-N 3.14Å; H22-L25 PolarHBondContact O-N 3.12Å; L25-A27 VanDerWaalsContact C-N 3.3Å; L25-A27 PolarHBondContact O-N 2.89Å; L25-L28 PolarHBondContact O-N 3.5Å; L25-Y29 HydrophobicContact CD2-CD2 4.31Å; L25-Y29 PolarHBondContact O-N 3.5Å
26	A	38.9	Very low	32.4	Very low	72 Å²	72	130.4 Å²	130.4	60%	0.595	69%	0.685	S	S	*	*	H	α-helix	trans	-66.5	-29.7	178.2	0	0	0	0	0	113.2	H22	H22-A26 PolarHBondContact O-N 3.08Å; H22-A26 VanDerWaalsContact O-N 3.12Å
27	A	41.3	Very low	32.2	Very low	84 Å²	84	132.7 Å²	132.7	69%	0.694	69%	0.689	S	S	*	*	H	α-helix	trans	-76.9	-25.5	175.7	0	0	0	0	0	113.2	R24 L25	R24-A27 PolarHBondContact O-N 3.03Å; L25-A27 VanDerWaalsContact C-N 3.3Å; L25-A27 PolarHBondContact O-N 2.89Å
28	L	35.4	Very low	32.1	Very low	126 Å²	126	131.9 Å²	131.9	66%	0.66	69%	0.685	S	S	*	*	H	α-helix	trans	-89.8	-20.7	-176.7	-76	164.4	0	0	0	113.7	R24 L25	R24-L28 PolarHBondContact O-N 3.02Å; L25-L28 PolarHBondContact O-N 3.5Å
29	Y	32.6	Very low	32.1	Very low	162 Å²	162	129.2 Å²	129.2	64%	0.635	68%	0.682	S	S	*	*			trans	-142.8	87.4	-177.1	-63.2	-82.5	0	0	0	112.7	L25 S31	L25-Y29 HydrophobicContact CD2-CD2 4.31Å; L25-Y29 PolarHBondContact O-N 3.5Å; Y29-S31 PolarHBondContact O-N 2.9Å
30	P	36.4	Very low	31.8	Very low	113 Å²	113	132.1 Å²	132.1	73%	0.734	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.4	1.6	-179.3	-15.3	29.5	0	0	0	115.1	Y32	P30-Y32 PolarHBondContact O-N 3.25Å
31	S	29.6	Very low	31.1	Very low	103 Å²	103	136.8 Å²	136.8	72%	0.72	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	5	-166.4	-37.8	0	0	0	0	115.6	Y29	Y29-S31 PolarHBondContact O-N 2.9Å
32	Y	25.8	Very low	30.5	Very low	218 Å²	218	137 Å²	137	86%	0.855	71%	0.714	S	S	*	*			trans	-123.6	69.1	-178.9	-90	-89	0	0	0	112.8	P30	P30-Y32 PolarHBondContact O-N 3.25Å
33	I	29.4	Very low	30	Very low	144 Å²	144	138.4 Å²	138.4	74%	0.738	72%	0.718	S	S	*	*			trans	-128.2	92.7	160.1	-57.5	177.8	0	0	0	108.2	I35	I33-I35 HydrophobicContact CG2-CG1 3.96Å
34	K	24.9	Very low	29	Very low	205 Å²	205	141.4 Å²	141.4	89%	0.891	73%	0.734	S	S	*	*			trans	-86.8	107.3	163.1	-84	-176.2	176.5	178.6	0	107.9	P36	K34-P36 WeakPolarHBondContact O-CD 3.25Å
35	I	29.4	Very low	28.5	Very low	140 Å²	140	140 Å²	140	72%	0.718	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-78.7	118.4	169.4	-56.8	174.3	0	0	0	107.3	I33	I33-I35 HydrophobicContact CG2-CG1 3.96Å
36	P	28	Very low	27.8	Very low	118 Å²	118	145.8 Å²	145.8	77%	0.766	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-77.7	127.8	178.8	29.3	-30.4	0	0	0	111.1	K34	K34-P36 WeakPolarHBondContact O-CD 3.25Å
37	N	25.1	Very low	26.9	Very low	148 Å²	148	147.4 Å²	147.4	79%	0.791	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-67.5	128.2	166.5	-76.7	-29.8	0	0	0	110.2
38	N	27	Very low	26.1	Very low	144 Å²	144	154.8 Å²	154.8	77%	0.77	78%	0.782	S	S	*	*			trans	156.5	114	136.6	-80.9	-18	0	0	0	110.7
39	H	27.6	Very low	25.4	Very low	175 Å²	175	158.3 Å²	158.3	81%	0.81	79%	0.792	S	S	*	*			trans	171.9	79.7	138.5	-88.7	-58.5	0	0	0	110
40	A	25	Very low	25.2	Very low	102 Å²	102	158.6 Å²	158.6	84%	0.843	80%	0.803	S	S	*	*			trans	-96.9	103.1	161.4	0	0	0	0	0	108.3
41	R	21.6	Very low	24.5	Very low	207 Å²	207	160.3 Å²	160.3	78%	0.781	81%	0.806	S	S	*	*			trans	-99.8	112.8	169.1	-83.3	-177	174.6	164.4	-0.8	108.9
42	I	20.7	Very low	24.5	Very low	157 Å²	157	167.1 Å²	167.1	81%	0.805	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-82.8	119.5	174.9	-63.3	171	0	0	0	108.2
43	F	21.3	Very low	24.6	Very low	180 Å²	180	162.2 Å²	162.2	79%	0.789	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-97.7	119.6	169.9	-89.6	-87.9	0	0	0	110.3
44	V	19.6	Very low	24.2	Very low	128 Å²	128	160.8 Å²	160.8	78%	0.776	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-87.7	124.3	169.5	177.4	0	0	0	0	108.2
45	T	23.8	Very low	24.3	Very low	134 Å²	134	156.8 Å²	156.8	82%	0.822	81%	0.812	S	S	*	*			trans	-117.4	124.3	169.7	47.1	0	0	0	0	110.8
46	K	20.3	Very low	24	Very low	202 Å²	202	154.8 Å²	154.8	88%	0.878	81%	0.81	S	S	*	*			trans	-86.5	135.7	177.5	-92.6	177.9	172.5	175.1	0	111
47	S	20	Very low	24	Very low	106 Å²	106	159.4 Å²	159.4	74%	0.741	82%	0.818	S	S	*	*			trans	46.3	121.7	131.4	-159.3	0	0	0	0	121
48	R	24.8	Very low	24	Very low	239 Å²	239	159.2 Å²	159.2	90%	0.902	82%	0.816	S	S	*	*				-174.6	131.4	108.5	-105.3	176.8	176.9	168.7	-0.8	113.1
49	K	20.8	Very low	24.1	Very low	200 Å²	200	159.9 Å²	159.9	87%	0.87	82%	0.818	S	S	*	*			trans	-80.1	141.4	163.6	-75	176	171.2	177.7	0	110.1
50	I	28	Very low	24	Very low	167 Å²	167	157.5 Å²	157.5	86%	0.856	81%	0.811	S	S	*	*			trans	-144.9	126.6	147.4	-63.5	-173.5	0	0	0	109.5
51	N	22.8	Very low	24.4	Very low	150 Å²	150	158.6 Å²	158.6	80%	0.802	81%	0.807	S	S	*	*			trans	-83.7	146.4	168	-79.2	-24.3	0	0	0	110.7
52	R	28.9	Very low	24.6	Very low	245 Å²	245	157.2 Å²	157.2	93%	0.925	81%	0.807	S	S	*	*			trans	171	165.2	133	-99.4	-164.8	177.6	173.8	0.9	113.3
53	P	28	Very low	24.9	Very low	115 Å²	115	158.9 Å²	158.9	75%	0.747	81%	0.811	S	S	*	*				-110	176.9	-125.5	42.9	-37.5	0	0	0	116.3
54	S	20.7	Very low	25.4	Very low	115 Å²	115	155 Å²	155	80%	0.804	81%	0.813	S	S	*	*			trans	-59.4	137.3	172.3	49.9	0	0	0	0	116.6
55	S	27.4	Very low	25.8	Very low	121 Å²	121	160.7 Å²	160.7	85%	0.846	82%	0.82	S	S	*	*				-163.1	113.8	128.8	57.2	0	0	0	0	109.3
56	S	23.1	Very low	26	Very low	98 Å²	98	163.2 Å²	163.2	69%	0.685	82%	0.823	S	S	*	*			trans	-79.4	138.5	177.5	48.1	0	0	0	0	112
57	F	28	Very low	26.4	Very low	215 Å²	215	164.7 Å²	164.7	94%	0.943	82%	0.823	S	S	*	*			trans	-128.2	122.8	149.2	-114.4	-93.3	0	0	0	107
58	I	25.4	Very low	26.9	Very low	144 Å²	144	167.1 Å²	167.1	74%	0.738	83%	0.828	S	S	*	*			trans	-97.8	125.4	-171.7	-66	168.5	0	0	0	107.7
59	I	29.2	Very low	27.3	Very low	157 Å²	157	159.7 Å²	159.7	81%	0.805	81%	0.812	S	S	*	*			trans	-120.1	130	161	-64.5	178.4	0	0	0	107.4
60	D	25.2	Very low	27.8	Very low	126 Å²	126	156.1 Å²	156.1	67%	0.674	80%	0.802	S	S	*	*			trans	-81.7	119.8	-167	-146.4	-12.8	0	0	0	110.4
61	T	33.9	Very low	28.3	Very low	125 Å²	125	153.4 Å²	153.4	77%	0.767	80%	0.798	S	S	*	*			trans	-126.6	62.4	171.4	48.5	0	0	0	0	110.1	E63	T61-E63 PolarHBondContact O-N 3.38Å; T61-E63 VanDerWaalsContact O-N 3.16Å
62	K	24.3	Very low	29.4	Very low	178 Å²	178	150.4 Å²	150.4	77%	0.774	79%	0.789	S	S	*	*			trans	-70.1	98.4	156.2	-78.3	178	178.8	169.8	0	108.1
63	E	28.2	Very low	30.2	Very low	191 Å²	191	141.9 Å²	141.9	89%	0.893	76%	0.764	S	S	*	*			trans	156	82.1	144.3	-86	175.4	-170.3	0	0	110.9	T61	T61-E63 PolarHBondContact O-N 3.38Å; T61-E63 VanDerWaalsContact O-N 3.16Å
64	A	30.3	Very low	31.3	Very low	99 Å²	99	140 Å²	140	82%	0.818	75%	0.75	S	S	*	*			trans	-138.3	83.4	159.5	0	0	0	0	0	108.5	Q66	A64-Q66 PolarHBondContact O-N 3.44Å
65	R	28.8	Very low	32.7	Very low	248 Å²	248	138 Å²	138	94%	0.936	74%	0.736	S	S	*	*			trans	-63.8	126.7	167.7	-84.3	178.1	170.9	172.7	-2.4	108.6	R67	R65-R67 PolarHBondContact O-N 2.99Å
66	Q	29.1	Very low	34	Very low	186 Å²	186	135.1 Å²	135.1	87%	0.869	72%	0.717	S	S	*	*			trans	-50	105.5	173.1	-69.8	166.2	-37.9	0	0	111	A64	A64-Q66 PolarHBondContact O-N 3.44Å
67	R	28.1	Very low	35.7	Very low	233 Å²	233	134.8 Å²	134.8	88%	0.879	71%	0.707	S	S	*	*			trans	-94.6	114.8	150.5	-71.7	-173.7	-167.9	170.1	4.6	106.3	R65 S69	R65-R67 PolarHBondContact O-N 2.99Å; R67-S69 VanDerWaalsContact C-N 3.35Å; R67-S69 PolarHBondContact O-N 3.41Å
68	N	29.3	Very low	37.3	Very low	158 Å²	158	128.3 Å²	128.3	85%	0.845	68%	0.682	S	S	*	*			trans	-67.8	97.2	165.7	-69.6	-23.2	0	0	0	106.6
69	S	34.2	Very low	38.7	Very low	82 Å²	82	126.5 Å²	126.5	57%	0.573	67%	0.674	S	S	*	*			trans	-104.6	120.9	169	54.4	0	0	0	0	108.3	R67	R67-S69 VanDerWaalsContact C-N 3.35Å; R67-S69 PolarHBondContact O-N 3.41Å
70	D	30.6	Very low	40.5	Very low	125 Å²	125	125.9 Å²	125.9	67%	0.668	67%	0.667	S	S	*	*			trans	-53.5	145.8	178.4	-67.1	-45.8	0	0	0	111.7	S72 T73	D70-S72 PolarHBondContact O-N 2.89Å; D70-T73 PolarHBondContact O-N 2.86Å; D70-T73 PolarHBondContact O-OG1 3.4Å
71	S	39.9	Very low	42.1	Very low	111 Å²	111	124.7 Å²	124.7	78%	0.776	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.3	-13.7	-173.7	54.8	0	0	0	0	114.8
72	S	44.1	Very low	43.5	Very low	86 Å²	86	120.4 Å²	120.4	60%	0.601	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	-27.5	179.3	52.2	0	0	0	0	113.7	D70 S75	D70-S72 PolarHBondContact O-N 2.89Å; S72-S75 PolarHBondContact O-OG 3.35Å
73	T	47.1	Very low	45.2	Very low	67 Å²	67	120.1 Å²	120.1	41%	0.411	63%	0.631	S	S	.	*	H	α-helix	trans	-77.7	-25.7	-178.3	-28.3	0	0	0	0	112.2	D70 S75 S76	D70-T73 PolarHBondContact O-N 2.86Å; D70-T73 PolarHBondContact O-OG1 3.4Å; T73-S75 PolarHBondContact O-N 3.49Å; T73-S76 PolarHBondContact O-OG 2.96Å
74	V	51.7	Low	46.9	Very low	74 Å²	74	118.8 Å²	118.8	45%	0.448	63%	0.63	S	S	.	*	H	α-helix	trans	-72.7	-29.8	-173.1	-176.6	0	0	0	0	112.4
75	S	49.8	Very low	48.5	Very low	73 Å²	73	118.1 Å²	118.1	51%	0.51	61%	0.61	S	S	.	*	H	α-helix	trans	-74.9	-34.4	179	46	0	0	0	0	113.2	S72 T73 D79	S72-S75 PolarHBondContact O-OG 3.35Å; T73-S75 PolarHBondContact O-N 3.49Å; S75-D79 PolarHBondContact O-N 3.39Å
76	S	53.3	Low	50.6	Low	62 Å²	62	110.5 Å²	110.5	43%	0.434	59%	0.591	S	S	.	*	H	α-helix	trans	-68.6	-40.5	-178.7	51.3	0	0	0	0	112.5	T73 L78 D79 E80	T73-S76 PolarHBondContact O-OG 2.96Å; S76-L78 VanDerWaalsContact C-N 3.33Å; S76-L78 PolarHBondContact O-N 3Å; S76-D79 PolarHBondContact O-N 3Å; S76-E80 PolarHBondContact O-N 3.29Å
77	D	59.3	Low	52.5	Low	90 Å²	90	106.8 Å²	106.8	48%	0.481	58%	0.583	S	S	.	*	H	α-helix	trans	-68.6	-34.2	-175.8	-67.6	1.1	0	0	0	111.8	I81	D77-I81 WeakPolarHBondContact O-CD1 3.43Å; D77-I81 VanDerWaalsContact O-CG1 3.24Å; D77-I81 WeakPolarHBondContact O-CG1 3.49Å; D77-I81 PolarHBondContact O-N 3.29Å
78	L	60.9	Low	54.5	Low	79 Å²	79	99.4 Å²	99.4	41%	0.414	57%	0.567	S	S	.	*	H	α-helix	trans	-71	-40.3	179.7	-155.6	80	0	0	0	111.6	S76 E80 I81 L82	S76-L78 VanDerWaalsContact C-N 3.33Å; S76-L78 PolarHBondContact O-N 3Å; L78-E80 VanDerWaalsContact C-N 3.33Å; L78-I81 PolarHBondContact O-N 3.27Å; L78-L82 HydrophobicContact CG-CD1 4.3Å; L78-L82 WeakPolarHBondContact O-CD1 3.42Å; L78-L82 WeakPolarHBondContact O-CG 3.41Å; L78-L82 PolarHBondContact O-N 3.36Å
79	D	56.7	Low	56.5	Low	106 Å²	106	93 Å²	93	57%	0.567	54%	0.537	S	S	*	.	H	α-helix	trans	-68.8	-32.1	178.6	-76.3	-20.9	0	0	0	112.2	S75 S76	S75-D79 PolarHBondContact O-N 3.39Å; S76-D79 PolarHBondContact O-N 3Å
80	E	65.8	Low	58.1	Low	145 Å²	145	92.5 Å²	92.5	68%	0.678	53%	0.525	S	S	*	.	H	α-helix	trans	-71	-41.2	176.8	-167.6	168.6	-167.1	0	0	112	S76 L78 L82 K83	S76-E80 PolarHBondContact O-N 3.29Å; L78-E80 VanDerWaalsContact C-N 3.33Å; E80-L82 VanDerWaalsContact C-N 3.27Å; E80-L82 PolarHBondContact O-N 3.44Å; E80-K83 PolarHBondContact O-N 3.44Å
81	I	60	Low	60.3	Low	101 Å²	101	92.4 Å²	92.4	52%	0.518	52%	0.524	S	S	.	.	H	α-helix	trans	-66.9	-29.7	178.2	-66.8	165.9	0	0	0	111.9	D77 L78	D77-I81 WeakPolarHBondContact O-CD1 3.43Å; D77-I81 VanDerWaalsContact O-CG1 3.24Å; D77-I81 WeakPolarHBondContact O-CG1 3.49Å; D77-I81 PolarHBondContact O-N 3.29Å; L78-I81 PolarHBondContact O-N 3.27Å
82	L	61.5	Low	62	Low	34 Å²	34	96.6 Å²	96.6	18%	0.178	52%	0.523	C	S	.	.	H	α-helix	trans	-80.8	-14.3	-176.3	-71.3	168.1	0	0	0	114	L78 E80 D84 Q90	L78-L82 HydrophobicContact CG-CD1 4.3Å; L78-L82 WeakPolarHBondContact O-CD1 3.42Å; L78-L82 WeakPolarHBondContact O-CG 3.41Å; L78-L82 PolarHBondContact O-N 3.36Å; E80-L82 VanDerWaalsContact C-N 3.27Å; E80-L82 PolarHBondContact O-N 3.44Å; L82-D84 PolarHBondContact O-N 2.82Å; L82-Q90 HydrophobicContact CD2-CB 3.89Å; L82-Q90 HydrophobicContact CD2-CG 3.73Å; L82-Q90 PolarHBondContact O-NE2 2.92Å
83	K	60.2	Low	63.4	Low	172 Å²	172	95.9 Å²	95.9	75%	0.748	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-34.7	-172.1	-91.3	178.7	178.4	173.8	0	115.2	E80	E80-K83 PolarHBondContact O-N 3.44Å
84	D	63.7	Low	64.8	Low	163 Å²	163	95.8 Å²	95.8	87%	0.872	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	16.2	-172.4	-80.9	-4.3	0	0	0	114.2	L82	L82-D84 PolarHBondContact O-N 2.82Å
85	Q	64.2	Low	65.9	Low	85 Å²	85	94.9 Å²	94.9	40%	0.397	50%	0.504	S	S	.	.	S	Bend	trans	-117.6	142.5	-175.6	-64.9	-150.2	-1.1	0	0	114.2	A89 Q90	Q85-A89 HydrophobicContact CB-CB 4.12Å; Q85-Q90 HydrophobicContact CB-CG 4.33Å
86	T	74.3	Confident	66.9	Low	89 Å²	89	94.3 Å²	94.3	55%	0.546	50%	0.503	S	S	.	.			trans	-61.7	152.1	176.4	56	0	0	0	0	111.2	S88 A89 Q90	T86-S88 PolarHBondContact O-N 3.26Å; T86-A89 WeakPolarHBondContact O-CA 3.49Å; T86-A89 WeakPolarHBondContact O-CB 3.49Å; T86-A89 PolarHBondContact O-N 3.05Å; T86-Q90 PolarHBondContact O-N 3.31Å; T86-Q90 VanDerWaalsContact O-N 3.12Å
87	P	67.3	Low	68	Low	107 Å²	107	97.7 Å²	97.7	70%	0.695	51%	0.507	S	S	*	.	H	α-helix	trans	-56.2	-31.5	-173.7	-26.5	33.6	0	0	0	114.5	L91	P87-L91 PolarHBondContact O-N 3.35Å
88	S	71	Confident	68.6	Low	78 Å²	78	100 Å²	100	55%	0.545	51%	0.509	S	S	.	.	H	α-helix	trans	-72.4	-30.7	177	56.8	0	0	0	0	113.1	T86 R92	T86-S88 PolarHBondContact O-N 3.26Å; S88-R92 WeakPolarHBondContact O-CG 3.35Å; S88-R92 PolarHBondContact O-N 3.06Å
89	A	71.8	Confident	69.1	Low	25 Å²	25	104.7 Å²	104.7	21%	0.207	52%	0.522	C	S	.	.	H	α-helix	trans	-75.8	-38.4	175.7	0	0	0	0	0	111.4	Q85 T86 L91 R92 L93	Q85-A89 HydrophobicContact CB-CB 4.12Å; T86-A89 WeakPolarHBondContact O-CA 3.49Å; T86-A89 WeakPolarHBondContact O-CB 3.49Å; T86-A89 PolarHBondContact O-N 3.05Å; A89-L91 PolarHBondContact O-N 3.45Å; A89-R92 PolarHBondContact O-N 3.5Å; A89-L93 PolarHBondContact O-N 3.25Å
90	Q	67.5	Low	69.5	Low	71 Å²	71	101.1 Å²	101.1	33%	0.332	51%	0.51	S	S	.	.	H	α-helix	trans	-57.5	-45.5	173.2	-65.9	-176.7	-21.7	0	0	111.9	L82 Q85 T86 R92 L93 V94	L82-Q90 HydrophobicContact CD2-CB 3.89Å; L82-Q90 HydrophobicContact CD2-CG 3.73Å; L82-Q90 PolarHBondContact O-NE2 2.92Å; Q85-Q90 HydrophobicContact CB-CG 4.33Å; T86-Q90 PolarHBondContact O-N 3.31Å; T86-Q90 VanDerWaalsContact O-N 3.12Å; Q90-R92 PolarHBondContact O-N 3.44Å; Q90-L93 PolarHBondContact O-N 3.43Å; Q90-V94 WeakPolarHBondContact O-CG2 3.35Å; Q90-V94 PolarHBondContact O-N 3.23Å
91	L	75.4	Confident	69.7	Low	122 Å²	122	100.2 Å²	100.2	64%	0.639	50%	0.504	S	S	*	.	H	α-helix	trans	-62.9	-41.6	178.4	-158.2	89.6	0	0	0	112	P87 A89 V94 D95	P87-L91 PolarHBondContact O-N 3.35Å; A89-L91 PolarHBondContact O-N 3.45Å; L91-V94 PolarHBondContact O-N 3.18Å; L91-D95 PolarHBondContact O-N 3.46Å
92	R	76.1	Confident	69.6	Low	200 Å²	200	101.1 Å²	101.1	76%	0.755	51%	0.506	S	S	*	.	H	α-helix	trans	-65.4	-38.3	177.4	-73.8	179.1	-178.9	-178.5	1.8	112.1	S88 A89 Q90 A96	S88-R92 WeakPolarHBondContact O-CG 3.35Å; S88-R92 PolarHBondContact O-N 3.06Å; A89-R92 PolarHBondContact O-N 3.5Å; Q90-R92 PolarHBondContact O-N 3.44Å; R92-A96 VanDerWaalsContact O-CB 3.25Å; R92-A96 WeakPolarHBondContact O-CB 3.36Å; R92-A96 PolarHBondContact O-N 2.87Å
93	L	74.5	Confident	69.3	Low	70 Å²	70	103 Å²	103	37%	0.366	52%	0.522	S	S	.	.	H	α-helix	trans	-64	-45.3	174.8	-94	162.5	0	0	0	111.8	A89 Q90 D95 A96 Y97	A89-L93 PolarHBondContact O-N 3.25Å; Q90-L93 PolarHBondContact O-N 3.43Å; L93-D95 PolarHBondContact O-N 3.49Å; L93-A96 PolarHBondContact O-N 3.48Å; L93-Y97 WeakPolarHBondContact O-CB 3.36Å; L93-Y97 PolarHBondContact O-N 3.04Å
94	V	75.7	Confident	68.6	Low	65 Å²	65	99 Å²	99	39%	0.394	52%	0.515	S	S	.	.	H	α-helix	trans	-63.4	-42.8	177.9	172.9	0	0	0	0	111.3	Q90 L91 Y97 R98	Q90-V94 WeakPolarHBondContact O-CG2 3.35Å; Q90-V94 PolarHBondContact O-N 3.23Å; L91-V94 PolarHBondContact O-N 3.18Å; V94-Y97 PolarHBondContact O-N 3.3Å; V94-R98 WeakPolarHBondContact O-CB 3.24Å; V94-R98 PolarHBondContact O-N 3.46Å
95	D	75.2	Confident	67.8	Low	56 Å²	56	94.3 Å²	94.3	30%	0.299	49%	0.493	S	S	.	.	H	α-helix	trans	-69.2	-37.4	177	-87.2	-16.6	0	0	0	112.7	L91 L93 R98 R99	L91-D95 PolarHBondContact O-N 3.46Å; L93-D95 PolarHBondContact O-N 3.49Å; D95-R98 PolarHBondContact O-N 3.07Å; D95-R98 IonicContact OD1-NH1 2.77Å; D95-R98 PolarHBondContact OD1-NH1 3.43Å; D95-R99 WeakPolarHBondContact O-CG 3.4Å; D95-R99 PolarHBondContact O-N 3.09Å
96	A	70.7	Confident	67	Low	61 Å²	61	97 Å²	97	50%	0.504	51%	0.51	S	S	.	.	H	α-helix	trans	-62.7	-43.3	172.9	0	0	0	0	0	111.3	R92 L93 R99 G100	R92-A96 VanDerWaalsContact O-CB 3.25Å; R92-A96 WeakPolarHBondContact O-CB 3.36Å; R92-A96 PolarHBondContact O-N 2.87Å; L93-A96 PolarHBondContact O-N 3.48Å; A96-R99 PolarHBondContact O-N 3.46Å; A96-G100 PolarHBondContact O-N 2.95Å
97	Y	75.8	Confident	65.4	Low	132 Å²	132	97.3 Å²	97.3	52%	0.518	52%	0.516	S	S	.	.	H	α-helix	trans	-63.7	-43.4	176	-168.5	-96.8	0	0	0	111.7	L93 V94 R99 G100 F101	L93-Y97 WeakPolarHBondContact O-CB 3.36Å; L93-Y97 PolarHBondContact O-N 3.04Å; V94-Y97 PolarHBondContact O-N 3.3Å; Y97-R99 PolarHBondContact O-N 3.11Å; Y97-G100 PolarHBondContact O-N 3.45Å; Y97-F101 WeakPolarHBondContact O-CB 3.37Å; Y97-F101 PolarHBondContact O-N 3.06Å
98	R	71.6	Confident	64.2	Low	138 Å²	138	94.8 Å²	94.8	52%	0.521	51%	0.509	S	S	.	.	H	α-helix	trans	-61.2	-42.2	176.8	-168.5	-175.4	-78.1	144.6	-11.9	111.8	V94 D95 F101 Q102	V94-R98 WeakPolarHBondContact O-CB 3.24Å; V94-R98 PolarHBondContact O-N 3.46Å; D95-R98 PolarHBondContact O-N 3.07Å; D95-R98 IonicContact OD1-NH1 2.77Å; D95-R98 PolarHBondContact OD1-NH1 3.43Å; R98-F101 PolarHBondContact O-N 3.34Å; R98-Q102 WeakPolarHBondContact O-CG 3.37Å; R98-Q102 PolarHBondContact O-N 3.48Å
99	R	71.7	Confident	62.9	Low	179 Å²	179	98.9 Å²	98.9	68%	0.675	52%	0.517	S	S	*	.	H	α-helix	trans	-68.2	-38.3	175.3	-71.4	177.5	-171.8	159.9	5.3	112.5	D95 A96 Y97 Q102 S103	D95-R99 WeakPolarHBondContact O-CG 3.4Å; D95-R99 PolarHBondContact O-N 3.09Å; A96-R99 PolarHBondContact O-N 3.46Å; Y97-R99 PolarHBondContact O-N 3.11Å; R99-Q102 PolarHBondContact O-N 3.06Å; R99-S103 WeakPolarHBondContact O-CB 3.22Å; R99-S103 PolarHBondContact O-N 3.05Å; R99-S103 PolarHBondContact O-OG 3.27Å
100	G	66	Low	61.7	Low	31 Å²	31	102.9 Å²	102.9	32%	0.32	54%	0.544	S	S	.	.	H	α-helix	trans	-62.7	-40.8	173.4	0	0	0	0	0	112.5	A96 Y97 S103 S104	A96-G100 PolarHBondContact O-N 2.95Å; Y97-G100 PolarHBondContact O-N 3.45Å; G100-S103 WeakPolarHBondContact CA-OG 3.45Å; G100-S103 PolarHBondContact O-OG 3.15Å; G100-S104 WeakPolarHBondContact O-CB 3.48Å; G100-S104 PolarHBondContact O-N 3.5Å; G100-S104 VanDerWaalsContact O-N 3.08Å; G100-S104 PolarHBondContact O-OG 3.47Å
101	F	70.5	Confident	60.8	Low	126 Å²	126	104 Å²	104	55%	0.553	56%	0.559	S	S	*	*	H	α-helix	trans	-68.3	-42.7	178.1	-155.6	-92.6	0	0	0	112	Y97 R98 S103 S104 T105	Y97-F101 WeakPolarHBondContact O-CB 3.37Å; Y97-F101 PolarHBondContact O-N 3.06Å; R98-F101 PolarHBondContact O-N 3.34Å; F101-S103 PolarHBondContact O-N 2.81Å; F101-S104 PolarHBondContact O-N 3.47Å; F101-T105 HydrophobicContact CE1-CG2 4.4Å; F101-T105 PolarHBondContact O-N 3.2Å; F101-T105 PolarHBondContact O-OG1 3.42Å
102	Q	56.9	Low	59.7	Low	119 Å²	119	103.2 Å²	103.2	56%	0.556	56%	0.556	S	S	*	*	H	α-helix	trans	-66.4	-35.6	177.5	-75.2	175.7	-17.1	0	0	112.9	R98 R99 T105	R98-Q102 WeakPolarHBondContact O-CG 3.37Å; R98-Q102 PolarHBondContact O-N 3.48Å; R99-Q102 PolarHBondContact O-N 3.06Å; Q102-T105 PolarHBondContact O-N 2.96Å; Q102-T105 PolarHBondContact O-OG1 3.27Å
103	S	55.5	Low	58.7	Low	74 Å²	74	100.4 Å²	100.4	52%	0.517	55%	0.549	S	S	.	.	H	α-helix	trans	-74.9	-25.6	175.9	53.1	0	0	0	0	113.5	R99 G100 F101 S107	R99-S103 WeakPolarHBondContact O-CB 3.22Å; R99-S103 PolarHBondContact O-N 3.05Å; R99-S103 PolarHBondContact O-OG 3.27Å; G100-S103 WeakPolarHBondContact CA-OG 3.45Å; G100-S103 PolarHBondContact O-OG 3.15Å; F101-S103 PolarHBondContact O-N 2.81Å; S103-S107 PolarHBondContact O-OG 3.5Å
104	S	44.9	Very low	57.8	Low	87 Å²	87	104.3 Å²	104.3	61%	0.608	57%	0.567	S	S	*	*	H	α-helix	trans	-74.7	-25.9	174.8	-58.9	0	0	0	0	112.9	G100 F101	G100-S104 WeakPolarHBondContact O-CB 3.48Å; G100-S104 PolarHBondContact O-N 3.5Å; G100-S104 VanDerWaalsContact O-N 3.08Å; G100-S104 PolarHBondContact O-OG 3.47Å; F101-S104 PolarHBondContact O-N 3.47Å
105	T	47.5	Very low	57.2	Low	65 Å²	65	107.3 Å²	107.3	40%	0.399	58%	0.577	S	S	.	*	H	α-helix	trans	-78.9	-20.4	-179.6	42.8	0	0	0	0	114.6	F101 Q102	F101-T105 HydrophobicContact CE1-CG2 4.4Å; F101-T105 PolarHBondContact O-N 3.2Å; F101-T105 PolarHBondContact O-OG1 3.42Å; Q102-T105 PolarHBondContact O-N 2.96Å; Q102-T105 PolarHBondContact O-OG1 3.27Å
106	D	46.6	Very low	56.9	Low	141 Å²	141	110 Å²	110	75%	0.754	59%	0.589	S	S	*	*	H	α-helix	trans	-107.4	-12.6	-171.6	-75.5	-16.6	0	0	0	115.4
107	S	40.6	Very low	57	Low	96 Å²	96	114.5 Å²	114.5	67%	0.671	59%	0.593	S	S	*	*	S	Bend	trans	-96.5	-9.1	-178.2	52	0	0	0	0	115.5	S103	S103-S107 PolarHBondContact O-OG 3.5Å
108	G	43.3	Very low	57	Low	54 Å²	54	117 Å²	117	56%	0.557	60%	0.602	S	S	*	*	S	Bend	trans	-95.7	-6	-177.6	0	0	0	0	0	117.4
109	K	43.3	Very low	57.2	Low	164 Å²	164	114.3 Å²	114.3	71%	0.713	60%	0.6	S	S	*	*	S	Bend	trans	-107.4	-4.5	-165.5	-75.5	178.8	-178.5	163.3	0	116.9
110	S	45.6	Very low	57.7	Low	110 Å²	110	110 Å²	110	77%	0.769	59%	0.59	S	S	*	*	S	Bend	trans	-84.9	-37.3	-178.2	-162.6	0	0	0	0	113.7
111	S	49	Very low	58.5	Low	94 Å²	94	112.7 Å²	112.7	66%	0.657	60%	0.596	S	S	*	*	H	α-helix	trans	-75.8	-39.4	-174.6	-168.9	0	0	0	0	114	K113 M114	S111-K113 VanDerWaalsContact C-N 3.29Å; S111-K113 PolarHBondContact O-N 3.02Å; S111-M114 PolarHBondContact O-N 3.44Å
112	N	53.6	Low	59.1	Low	105 Å²	105	112.1 Å²	112.1	56%	0.561	60%	0.598	S	S	*	*	H	α-helix	trans	-68.8	-22.3	-177.8	-82.6	-12.6	0	0	0	114.3	M116	N112-M116 VanDerWaalsContact O-CB 3.29Å; N112-M116 WeakPolarHBondContact O-CB 3.29Å; N112-M116 PolarHBondContact O-N 3.33Å
113	K	53.6	Low	60.2	Low	141 Å²	141	114 Å²	114	61%	0.613	60%	0.604	S	S	*	*	H	α-helix	trans	-71.3	-38.4	-178.6	-148.5	176.3	-174.3	-179	0	111.3	S111 W117	S111-K113 VanDerWaalsContact C-N 3.29Å; S111-K113 PolarHBondContact O-N 3.02Å; K113-W117 PolarHBondContact O-N 3.19Å; K113-W117 VanDerWaalsContact O-N 3.11Å
114	M	56.2	Low	61.5	Low	153 Å²	153	114.7 Å²	114.7	75%	0.754	61%	0.605	S	S	*	*	H	α-helix	trans	-69	-40.9	179.2	-163.1	81.2	95.8	0	0	112.1	S111 R118	S111-M114 PolarHBondContact O-N 3.44Å; M114-R118 PolarHBondContact O-N 3.46Å; M114-R118 VanDerWaalsContact O-N 3.09Å
115	Q	63.5	Low	63.6	Low	128 Å²	128	115.5 Å²	115.5	60%	0.598	60%	0.602	S	S	*	*	H	α-helix	trans	-67	-41.6	176.1	-99.8	178.2	-29.6	0	0	112.3	W117 R118 T119	Q115-W117 PolarHBondContact O-N 3.07Å; Q115-R118 PolarHBondContact O-N 3.45Å; Q115-T119 WeakPolarHBondContact O-CG2 3.37Å; Q115-T119 PolarHBondContact O-N 2.99Å; Q115-T119 PolarHBondContact O-OG1 3.49Å
116	M	69.3	Low	65.4	Low	111 Å²	111	118.2 Å²	118.2	55%	0.547	61%	0.613	S	S	.	*	H	α-helix	trans	-61	-45.2	177.4	-169.4	-175.1	-66.7	0	0	111.3	N112 R118 T119 I120	N112-M116 VanDerWaalsContact O-CB 3.29Å; N112-M116 WeakPolarHBondContact O-CB 3.29Å; N112-M116 PolarHBondContact O-N 3.33Å; M116-R118 PolarHBondContact O-N 2.94Å; M116-T119 PolarHBondContact O-N 2.9Å; M116-T119 PolarHBondContact O-OG1 3.37Å; M116-I120 HydrophobicContact CG-CD1 4.03Å; M116-I120 VanDerWaalsContact O-CG1 3.29Å; M116-I120 WeakPolarHBondContact O-CG1 3.5Å; M116-I120 PolarHBondContact O-N 2.85Å
117	W	72.4	Confident	67.2	Low	156 Å²	156	119 Å²	119	59%	0.591	61%	0.61	S	S	*	*	H	α-helix	trans	-65.5	-38.1	177.9	-79.5	63.8	0	0	0	112.7	K113 Q115 T119 I120 I121	K113-W117 PolarHBondContact O-N 3.19Å; K113-W117 VanDerWaalsContact O-N 3.11Å; Q115-W117 PolarHBondContact O-N 3.07Å; W117-T119 PolarHBondContact O-N 3.16Å; W117-I120 PolarHBondContact O-N 3Å; W117-I121 WeakPolarHBondContact O-CD1 3.29Å; W117-I121 VanDerWaalsContact O-CG1 3.29Å; W117-I121 WeakPolarHBondContact O-CG1 3.37Å; W117-I121 PolarHBondContact O-N 2.98Å
118	R	76.1	Confident	69.3	Low	186 Å²	186	116.1 Å²	116.1	70%	0.702	60%	0.595	S	S	*	*	H	α-helix	trans	-58.7	-45.8	172.3	-107	179.9	144	-171	-6.1	112.4	M114 Q115 M116 I120 I121 I122	M114-R118 PolarHBondContact O-N 3.46Å; M114-R118 VanDerWaalsContact O-N 3.09Å; Q115-R118 PolarHBondContact O-N 3.45Å; M116-R118 PolarHBondContact O-N 2.94Å; R118-I120 PolarHBondContact O-N 2.91Å; R118-I121 PolarHBondContact O-N 3.34Å; R118-I122 WeakPolarHBondContact O-CG1 3.32Å; R118-I122 PolarHBondContact O-N 2.88Å; R118-I122 VanDerWaalsContact O-N 3.15Å
119	T	76.3	Confident	71.5	Confident	80 Å²	80	117.9 Å²	117.9	49%	0.491	60%	0.595	S	S	.	*	H	α-helix	trans	-68.4	-33.2	179.6	61.1	0	0	0	0	113.1	Q115 M116 W117 K123	Q115-T119 WeakPolarHBondContact O-CG2 3.37Å; Q115-T119 PolarHBondContact O-N 2.99Å; Q115-T119 PolarHBondContact O-OG1 3.49Å; M116-T119 PolarHBondContact O-N 2.9Å; M116-T119 PolarHBondContact O-OG1 3.37Å; W117-T119 PolarHBondContact O-N 3.16Å; T119-K123 WeakPolarHBondContact O-CB 3.49Å; T119-K123 WeakPolarHBondContact O-CG 3.29Å; T119-K123 PolarHBondContact O-N 2.85Å; T119-K123 VanDerWaalsContact O-N 3.16Å
120	I	80.5	Confident	73.5	Confident	89 Å²	89	114.1 Å²	114.1	46%	0.456	59%	0.586	S	S	.	*	H	α-helix	trans	-67.2	-46.4	176.6	-68.3	165.1	0	0	0	110.3	M116 W117 R118 K123 T124	M116-I120 HydrophobicContact CG-CD1 4.03Å; M116-I120 VanDerWaalsContact O-CG1 3.29Å; M116-I120 WeakPolarHBondContact O-CG1 3.5Å; M116-I120 PolarHBondContact O-N 2.85Å; W117-I120 PolarHBondContact O-N 3Å; R118-I120 PolarHBondContact O-N 2.91Å; I120-K123 PolarHBondContact O-N 3.38Å; I120-T124 PolarHBondContact O-N 3.38Å; I120-T124 PolarHBondContact O-OG1 2.99Å
121	I	83.1	Confident	75.3	Confident	88 Å²	88	111 Å²	111	45%	0.451	56%	0.564	S	S	.	*	H	α-helix	trans	-63.7	-42.9	-179.1	-66.6	165.1	0	0	0	111.5	W117 R118 K123 T124 I125	W117-I121 WeakPolarHBondContact O-CD1 3.29Å; W117-I121 VanDerWaalsContact O-CG1 3.29Å; W117-I121 WeakPolarHBondContact O-CG1 3.37Å; W117-I121 PolarHBondContact O-N 2.98Å; R118-I121 PolarHBondContact O-N 3.34Å; I121-K123 PolarHBondContact O-N 2.92Å; I121-T124 WeakPolarHBondContact CA-OG1 3.42Å; I121-T124 PolarHBondContact O-N 2.98Å; I121-T124 PolarHBondContact O-OG1 3.5Å; I121-I125 HydrophobicContact CG2-CD1 3.81Å; I121-I125 VanDerWaalsContact O-CG1 3.28Å; I121-I125 WeakPolarHBondContact O-CG1 3.38Å; I121-I125 PolarHBondContact O-N 2.97Å
122	I	83.7	Confident	76.9	Confident	114 Å²	114	110.1 Å²	110.1	59%	0.585	56%	0.557	S	S	*	*	H	α-helix	trans	-65.1	-41.3	178.8	-67.9	168.5	0	0	0	110.8	R118 I125 L126	R118-I122 WeakPolarHBondContact O-CG1 3.32Å; R118-I122 PolarHBondContact O-N 2.88Å; R118-I122 VanDerWaalsContact O-N 3.15Å; I122-I125 PolarHBondContact O-N 3.21Å; I122-L126 WeakPolarHBondContact O-CB 3.45Å; I122-L126 PolarHBondContact O-N 3.31Å
123	K	80	Confident	78.5	Confident	158 Å²	158	112.3 Å²	112.3	69%	0.687	56%	0.562	S	S	*	*	H	α-helix	trans	-67.5	-38.4	178.1	-77	-175.5	177.6	-174.3	0	112.9	T119 I120 I121 L126 F127	T119-K123 WeakPolarHBondContact O-CB 3.49Å; T119-K123 WeakPolarHBondContact O-CG 3.29Å; T119-K123 PolarHBondContact O-N 2.85Å; T119-K123 VanDerWaalsContact O-N 3.16Å; I120-K123 PolarHBondContact O-N 3.38Å; I121-K123 PolarHBondContact O-N 2.92Å; K123-L126 PolarHBondContact O-N 3.18Å; K123-F127 WeakPolarHBondContact O-CB 3.28Å; K123-F127 PolarHBondContact O-N 2.9Å
124	T	83.3	Confident	79.7	Confident	88 Å²	88	109.4 Å²	109.4	54%	0.54	56%	0.556	S	S	.	*	H	α-helix	trans	-68.6	-37.3	176.1	37.7	0	0	0	0	112.3	I120 I121 G128	I120-T124 PolarHBondContact O-N 3.38Å; I120-T124 PolarHBondContact O-OG1 2.99Å; I121-T124 WeakPolarHBondContact CA-OG1 3.42Å; I121-T124 PolarHBondContact O-N 2.98Å; I121-T124 PolarHBondContact O-OG1 3.5Å; T124-G128 PolarHBondContact O-N 2.97Å
125	I	87.6	Confident	80.8	Confident	105 Å²	105	105.9 Å²	105.9	54%	0.538	54%	0.539	S	S	.	.	H	α-helix	trans	-65	-46.3	174.7	-67	167.2	0	0	0	110.3	I121 I122 F127 G128 V129	I121-I125 HydrophobicContact CG2-CD1 3.81Å; I121-I125 VanDerWaalsContact O-CG1 3.28Å; I121-I125 WeakPolarHBondContact O-CG1 3.38Å; I121-I125 PolarHBondContact O-N 2.97Å; I122-I125 PolarHBondContact O-N 3.21Å; I125-F127 PolarHBondContact O-N 3.49Å; I125-G128 PolarHBondContact O-N 2.91Å; I125-V129 HydrophobicContact CG2-CG2 4.39Å; I125-V129 WeakPolarHBondContact O-CG2 3.22Å; I125-V129 PolarHBondContact O-N 3.38Å
126	L	85.6	Confident	81.6	Confident	121 Å²	121	103.5 Å²	103.5	63%	0.634	53%	0.533	S	S	*	.	H	α-helix	trans	-60.9	-44.4	178.5	-163.2	82.3	0	0	0	111.8	I122 K123 G128 V129 V130	I122-L126 WeakPolarHBondContact O-CB 3.45Å; I122-L126 PolarHBondContact O-N 3.31Å; K123-L126 PolarHBondContact O-N 3.18Å; L126-G128 VanDerWaalsContact C-N 3.34Å; L126-G128 PolarHBondContact O-N 3.45Å; L126-V129 PolarHBondContact O-N 2.94Å; L126-V130 VanDerWaalsContact O-CG2 3.32Å; L126-V130 WeakPolarHBondContact O-CG2 3.08Å; L126-V130 PolarHBondContact O-N 2.89Å
127	F	84.2	Confident	82	Confident	157 Å²	157	104.9 Å²	104.9	69%	0.689	54%	0.537	S	S	*	.	H	α-helix	trans	-64.9	-38.4	176.2	-168.8	-96.8	0	0	0	112	K123 I125 S131	K123-F127 WeakPolarHBondContact O-CB 3.28Å; K123-F127 PolarHBondContact O-N 2.9Å; I125-F127 PolarHBondContact O-N 3.49Å; F127-S131 WeakPolarHBondContact O-CB 3.39Å; F127-S131 PolarHBondContact O-N 2.84Å
128	G	86.2	Confident	82.1	Confident	36 Å²	36	102.2 Å²	102.2	37%	0.371	53%	0.533	S	S	.	.	H	α-helix	trans	-63	-42.8	175	0	0	0	0	0	112.7	T124 I125 L126 C132	T124-G128 PolarHBondContact O-N 2.97Å; I125-G128 PolarHBondContact O-N 2.91Å; L126-G128 VanDerWaalsContact C-N 3.34Å; L126-G128 PolarHBondContact O-N 3.45Å; G128-C132 VanDerWaalsContact O-CB 3.22Å; G128-C132 WeakPolarHBondContact O-CB 3.41Å; G128-C132 PolarHBondContact O-N 3.15Å
129	V	88.7	Confident	81.8	Confident	92 Å²	92	99.8 Å²	99.8	56%	0.558	53%	0.528	S	S	*	.	H	α-helix	trans	-68.2	-45.2	178.2	175.3	0	0	0	0	111.1	I125 L126 C132 F133	I125-V129 HydrophobicContact CG2-CG2 4.39Å; I125-V129 WeakPolarHBondContact O-CG2 3.22Å; I125-V129 PolarHBondContact O-N 3.38Å; L126-V129 PolarHBondContact O-N 2.94Å; V129-C132 PolarHBondContact O-N 3.43Å; V129-F133 WeakPolarHBondContact O-CB 3.39Å; V129-F133 PolarHBondContact O-N 2.86Å
130	V	86.1	Confident	81.3	Confident	85 Å²	85	104.2 Å²	104.2	52%	0.515	54%	0.54	S	S	.	.	H	α-helix	trans	-63.8	-43.2	176.7	174.4	0	0	0	0	111	L126 F133 T134	L126-V130 VanDerWaalsContact O-CG2 3.32Å; L126-V130 WeakPolarHBondContact O-CG2 3.08Å; L126-V130 PolarHBondContact O-N 2.89Å; V130-F133 PolarHBondContact O-N 3.06Å; V130-T134 WeakPolarHBondContact O-CG2 3.32Å; V130-T134 PolarHBondContact O-N 3.39Å; V130-T134 PolarHBondContact O-OG1 2.89Å
131	S	82.7	Confident	80.6	Confident	45 Å²	45	103.6 Å²	103.6	32%	0.315	54%	0.541	S	S	.	.	H	α-helix	trans	-63.2	-41.1	175.6	179.7	0	0	0	0	112.3	F127 T134 I135	F127-S131 WeakPolarHBondContact O-CB 3.39Å; F127-S131 PolarHBondContact O-N 2.84Å; S131-T134 WeakPolarHBondContact CA-OG1 3.39Å; S131-T134 PolarHBondContact O-N 2.95Å; S131-T134 PolarHBondContact O-OG1 3.35Å; S131-I135 WeakPolarHBondContact O-CB 3.31Å; S131-I135 WeakPolarHBondContact O-CD1 3.17Å; S131-I135 WeakPolarHBondContact O-CG1 3.46Å; S131-I135 PolarHBondContact O-N 3.05Å
132	C	83.1	Confident	79.2	Confident	75 Å²	75	103.2 Å²	103.2	51%	0.507	54%	0.539	S	S	.	.	H	α-helix	trans	-65.9	-40.9	176.2	-162.8	0	0	0	0	111.1	G128 V129 I135 V136	G128-C132 VanDerWaalsContact O-CB 3.22Å; G128-C132 WeakPolarHBondContact O-CB 3.41Å; G128-C132 PolarHBondContact O-N 3.15Å; V129-C132 PolarHBondContact O-N 3.43Å; C132-I135 PolarHBondContact O-N 3.33Å; C132-V136 VanDerWaalsContact O-CG2 3.31Å; C132-V136 WeakPolarHBondContact O-CG2 3.33Å; C132-V136 PolarHBondContact O-N 3.5Å
133	F	85.5	Confident	77.9	Confident	150 Å²	150	102.7 Å²	102.7	66%	0.658	54%	0.541	S	S	*	.	H	α-helix	trans	-66.3	-42.3	178	-157.8	-94	0	0	0	112.2	V129 V130 V136 F137	V129-F133 WeakPolarHBondContact O-CB 3.39Å; V129-F133 PolarHBondContact O-N 2.86Å; V130-F133 PolarHBondContact O-N 3.06Å; F133-V136 PolarHBondContact O-N 3.33Å; F133-F137 WeakPolarHBondContact O-CB 3.26Å; F133-F137 PolarHBondContact O-N 3.43Å
134	T	80	Confident	76.4	Confident	80 Å²	80	97.4 Å²	97.4	49%	0.491	53%	0.532	S	S	.	.	H	α-helix	trans	-66.3	-37.3	175.4	55.4	0	0	0	0	112	V130 S131 L138	V130-T134 WeakPolarHBondContact O-CG2 3.32Å; V130-T134 PolarHBondContact O-N 3.39Å; V130-T134 PolarHBondContact O-OG1 2.89Å; S131-T134 WeakPolarHBondContact CA-OG1 3.39Å; S131-T134 PolarHBondContact O-N 2.95Å; S131-T134 PolarHBondContact O-OG1 3.35Å; T134-L138 WeakPolarHBondContact O-CB 3.31Å; T134-L138 PolarHBondContact O-N 3.27Å
135	I	79.2	Confident	74.7	Confident	79 Å²	79	97.6 Å²	97.6	41%	0.405	53%	0.533	S	S	.	.	H	α-helix	trans	-67.2	-41.3	175.1	-68.6	165.6	0	0	0	111.3	S131 C132 K139	S131-I135 WeakPolarHBondContact O-CB 3.31Å; S131-I135 WeakPolarHBondContact O-CD1 3.17Å; S131-I135 WeakPolarHBondContact O-CG1 3.46Å; S131-I135 PolarHBondContact O-N 3.05Å; C132-I135 PolarHBondContact O-N 3.33Å; I135-K139 HydrophobicContact CG2-CD 4.18Å; I135-K139 HydrophobicContact CG2-CG 4.46Å; I135-K139 VanDerWaalsContact O-CB 3.31Å; I135-K139 WeakPolarHBondContact O-CB 3.08Å; I135-K139 VanDerWaalsContact O-CG 3.26Å; I135-K139 WeakPolarHBondContact O-CG 3.05Å; I135-K139 PolarHBondContact O-N 3.4Å
136	V	79.9	Confident	72.8	Confident	78 Å²	78	98.9 Å²	98.9	47%	0.473	54%	0.535	S	S	.	.	H	α-helix	trans	-68.4	-40.6	177.5	171.2	0	0	0	0	111.4	C132 F133 K139 K140	C132-V136 VanDerWaalsContact O-CG2 3.31Å; C132-V136 WeakPolarHBondContact O-CG2 3.33Å; C132-V136 PolarHBondContact O-N 3.5Å; F133-V136 PolarHBondContact O-N 3.33Å; V136-K139 PolarHBondContact O-N 3.46Å; V136-K140 PolarHBondContact O-N 3.04Å
137	F	78.8	Confident	71.1	Confident	140 Å²	140	96.8 Å²	96.8	61%	0.614	53%	0.528	S	S	*	.	H	α-helix	trans	-64.9	-46.7	175.3	-164.1	-97.8	0	0	0	110.9	F133 K139 K140 T141	F133-F137 WeakPolarHBondContact O-CB 3.26Å; F133-F137 PolarHBondContact O-N 3.43Å; F137-K139 VanDerWaalsContact C-N 3.33Å; F137-K139 PolarHBondContact O-N 3.33Å; F137-K140 PolarHBondContact O-N 3.34Å; F137-K140 VanDerWaalsContact O-N 3.15Å; F137-T141 PolarHBondContact O-N 2.95Å; F137-T141 PolarHBondContact O-OG1 3.07Å
138	L	74	Confident	69.2	Low	100 Å²	100	97.7 Å²	97.7	52%	0.524	53%	0.532	S	S	.	.	H	α-helix	trans	-60.8	-40.2	176.2	-173	63	0	0	0	111.8	T134 L142	T134-L138 WeakPolarHBondContact O-CB 3.31Å; T134-L138 PolarHBondContact O-N 3.27Å; L138-L142 HydrophobicContact CD1-CD1 3.42Å; L138-L142 VanDerWaalsContact CD1-CD1 3.42Å; L138-L142 HydrophobicContact CD1-CG 4.03Å; L138-L142 HydrophobicContact CD2-CD1 4.41Å; L138-L142 HydrophobicContact CG-CD1 3.69Å; L138-L142 VanDerWaalsContact O-CB 3.22Å; L138-L142 WeakPolarHBondContact O-CB 3.33Å; L138-L142 PolarHBondContact O-N 3.33Å
139	K	70.2	Confident	67.3	Low	135 Å²	135	104 Å²	104	59%	0.587	55%	0.55	S	S	*	.	H	α-helix	trans	-65.3	-41.7	173.9	-77.7	-177.7	177	-168.6	0	112.1	I135 V136 F137 V143	I135-K139 HydrophobicContact CG2-CD 4.18Å; I135-K139 HydrophobicContact CG2-CG 4.46Å; I135-K139 VanDerWaalsContact O-CB 3.31Å; I135-K139 WeakPolarHBondContact O-CB 3.08Å; I135-K139 VanDerWaalsContact O-CG 3.26Å; I135-K139 WeakPolarHBondContact O-CG 3.05Å; I135-K139 PolarHBondContact O-N 3.4Å; V136-K139 PolarHBondContact O-N 3.46Å; F137-K139 VanDerWaalsContact C-N 3.33Å; F137-K139 PolarHBondContact O-N 3.33Å; K139-V143 HydrophobicContact CB-CG2 4.41Å; K139-V143 WeakPolarHBondContact O-CB 3.41Å; K139-V143 WeakPolarHBondContact O-CG2 3.3Å; K139-V143 PolarHBondContact O-N 3.42Å
140	K	65.5	Low	65.4	Low	173 Å²	173	105.4 Å²	105.4	75%	0.752	55%	0.554	S	S	*	*	H	α-helix	trans	-67.2	-37.1	177.7	-88.8	-172	172.2	-175.2	0	112.8	V136 F137	V136-K140 PolarHBondContact O-N 3.04Å; F137-K140 PolarHBondContact O-N 3.34Å; F137-K140 VanDerWaalsContact O-N 3.15Å
141	T	64.7	Low	63.5	Low	77 Å²	77	107 Å²	107	47%	0.472	56%	0.559	S	S	.	*	H	α-helix	trans	-81.3	-36.1	-178.8	-36.4	0	0	0	0	112.6	F137 T145	F137-T141 PolarHBondContact O-N 2.95Å; F137-T141 PolarHBondContact O-OG1 3.07Å; T141-T145 PolarHBondContact O-OG1 2.99Å; T141-T145 VanDerWaalsContact O-OG1 3.05Å
142	L	54.7	Low	62	Low	79 Å²	79	110.7 Å²	110.7	41%	0.414	57%	0.571	S	S	.	*	H	α-helix	trans	-82.2	-39	178.7	-80.3	170.8	0	0	0	113.8	L138 G144 F146	L138-L142 HydrophobicContact CD1-CD1 3.42Å; L138-L142 VanDerWaalsContact CD1-CD1 3.42Å; L138-L142 HydrophobicContact CD1-CG 4.03Å; L138-L142 HydrophobicContact CD2-CD1 4.41Å; L138-L142 HydrophobicContact CG-CD1 3.69Å; L138-L142 VanDerWaalsContact O-CB 3.22Å; L138-L142 WeakPolarHBondContact O-CB 3.33Å; L138-L142 PolarHBondContact O-N 3.33Å; L142-G144 VanDerWaalsContact C-N 3.31Å; L142-G144 PolarHBondContact O-N 2.79Å; L142-F146 HydrophobicContact CD2-CD2 3.5Å; L142-F146 HydrophobicContact CD2-CE2 3.4Å; L142-F146 VanDerWaalsContact CD2-CE2 3.4Å; L142-F146 PolarHBondContact O-N 3.46Å
143	V	56.5	Low	60.4	Low	103 Å²	103	112.9 Å²	112.9	62%	0.624	58%	0.578	S	S	*	*	H	α-helix	trans	-71.9	-26.2	-173.8	178.3	0	0	0	0	112.1	K139 P147	K139-V143 HydrophobicContact CB-CG2 4.41Å; K139-V143 WeakPolarHBondContact O-CB 3.41Å; K139-V143 WeakPolarHBondContact O-CG2 3.3Å; K139-V143 PolarHBondContact O-N 3.42Å; V143-P147 WeakPolarHBondContact O-CD 3.22Å; V143-P147 WeakPolarHBondContact O-CG 3.07Å
144	G	48.1	Very low	58.9	Low	47 Å²	47	107.2 Å²	107.2	49%	0.485	55%	0.554	S	S	.	*	H	α-helix	trans	-83.4	-26.3	179.9	0	0	0	0	0	115.4	L142	L142-G144 VanDerWaalsContact C-N 3.31Å; L142-G144 PolarHBondContact O-N 2.79Å
145	T	47	Very low	57.6	Low	93 Å²	93	104.6 Å²	104.6	57%	0.571	54%	0.543	S	S	*	.	H	α-helix	trans	-105.9	-31.4	-166.9	-38.4	0	0	0	0	112.8	T141	T141-T145 PolarHBondContact O-OG1 2.99Å; T141-T145 VanDerWaalsContact O-OG1 3.05Å
146	F	48.3	Very low	56.6	Low	131 Å²	131	102.6 Å²	102.6	58%	0.575	54%	0.536	S	S	*	.	H	α-helix	trans	-69.5	-37	-178.4	-104	-94.1	0	0	0	115.9	L142 K148 F149	L142-F146 HydrophobicContact CD2-CD2 3.5Å; L142-F146 HydrophobicContact CD2-CE2 3.4Å; L142-F146 VanDerWaalsContact CD2-CE2 3.4Å; L142-F146 PolarHBondContact O-N 3.46Å; F146-K148 VanDerWaalsContact C-N 3.26Å; F146-K148 PolarHBondContact O-N 3.21Å; F146-F149 PolarHBondContact O-N 2.97Å
147	P	49.5	Very low	55.9	Low	77 Å²	77	106.6 Å²	106.6	50%	0.5	55%	0.547	S	S	.	.	H	α-helix	trans	-63.7	-34	179.7	-19.7	30.3	0	0	0	112.5	V143 F149 L150 D151	V143-P147 WeakPolarHBondContact O-CD 3.22Å; V143-P147 WeakPolarHBondContact O-CG 3.07Å; P147-F149 VanDerWaalsContact C-N 3.32Å; P147-F149 PolarHBondContact O-N 3.48Å; P147-L150 PolarHBondContact O-N 3.13Å; P147-D151 PolarHBondContact O-N 3.33Å
148	K	44.5	Very low	55.6	Low	177 Å²	177	101.5 Å²	101.5	77%	0.77	53%	0.531	S	S	*	.	H	α-helix	trans	-75.2	-18.6	-177.4	-70.1	-173.5	177	-178.2	0	114	F146	F146-K148 VanDerWaalsContact C-N 3.26Å; F146-K148 PolarHBondContact O-N 3.21Å
149	F	46.6	Very low	56	Low	168 Å²	168	101.7 Å²	101.7	74%	0.737	53%	0.529	S	S	*	.	H	α-helix	trans	-83.4	-18	175.6	-137.5	-85.3	0	0	0	112.3	F146 P147	F146-F149 PolarHBondContact O-N 2.97Å; P147-F149 VanDerWaalsContact C-N 3.32Å; P147-F149 PolarHBondContact O-N 3.48Å
150	L	49.2	Very low	56.6	Low	122 Å²	122	101.3 Å²	101.3	64%	0.639	53%	0.533	S	S	*	.	H	α-helix	trans	-92.4	-21.1	-179.4	-68.1	177	0	0	0	113.6	P147 Q152	P147-L150 PolarHBondContact O-N 3.13Å; L150-Q152 PolarHBondContact O-N 3.33Å
151	D	46.1	Very low	57.4	Low	119 Å²	119	93.9 Å²	93.9	64%	0.636	50%	0.503	S	S	*	.			trans	-93.6	70.3	179.8	-135.1	10.3	0	0	0	110.1	P147	P147-D151 PolarHBondContact O-N 3.33Å
152	Q	50.4	Low	58.4	Low	121 Å²	121	98 Å²	98	57%	0.565	52%	0.522	S	S	*	.			trans	-92.8	114.2	163.3	-75.6	-169.9	-23.2	0	0	108	L150 I154	L150-Q152 PolarHBondContact O-N 3.33Å; Q152-I154 WeakPolarHBondContact O-CD1 3.43Å; Q152-I154 VanDerWaalsContact O-CG1 3.29Å; Q152-I154 WeakPolarHBondContact O-CG1 3.37Å; Q152-I154 PolarHBondContact O-N 3.08Å
153	N	50.1	Low	60.1	Low	121 Å²	121	95.9 Å²	95.9	65%	0.647	51%	0.512	S	S	*	.			trans	-53	102	176.1	-58.6	-49.3	0	0	0	110.5
154	I	54	Low	61.8	Low	32 Å²	32	92.5 Å²	92.5	16%	0.164	49%	0.493	C	S	.	.			trans	-87.9	-39.2	-178.5	-62.9	123.9	0	0	0	111.7	Q152 F235 R246	Q152-I154 WeakPolarHBondContact O-CD1 3.43Å; Q152-I154 VanDerWaalsContact O-CG1 3.29Å; Q152-I154 WeakPolarHBondContact O-CG1 3.37Å; Q152-I154 PolarHBondContact O-N 3.08Å; I154-F235 HydrophobicContact CG2-CE1 3.84Å; I154-F235 HydrophobicContact CG2-CZ 4.36Å; I154-R246 HydrophobicContact CD1-CB 3.74Å; I154-R246 VanDerWaalsContact CD1-CD 3.47Å; I154-R246 HydrophobicContact CD1-CG 3.29Å; I154-R246 HydrophobicContact CG1-CB 4.34Å; I154-R246 HydrophobicContact CG1-CG 3.96Å; I154-R246 HydrophobicContact CG2-CB 4.45Å
155	G	52.9	Low	63.8	Low	24 Å²	24	91.5 Å²	91.5	25%	0.247	48%	0.475	C	S	.	.	S	Bend	trans	-84.7	131.4	163.9	0	0	0	0	0	108	F157	G155-F157 PolarHBondContact O-N 3.12Å
156	S	57.5	Low	65.8	Low	37 Å²	37	90.9 Å²	90.9	26%	0.259	48%	0.475	S	S	.	.			trans	-47.1	139.3	151.1	52.9	0	0	0	0	107.3	A158	S156-A158 PolarHBondContact O-N 3.26Å
157	F	64.8	Low	67.7	Low	163 Å²	163	88.3 Å²	88.3	72%	0.715	47%	0.467	S	S	*	.			trans	-44.5	141	166.5	-72.4	-85.6	0	0	0	108	G155 E159	G155-F157 PolarHBondContact O-N 3.12Å; F157-E159 WeakPolarHBondContact O-CG 3.25Å; F157-E159 PolarHBondContact O-N 3.24Å
158	A	72.8	Confident	69.6	Low	32 Å²	32	85 Å²	85	26%	0.264	45%	0.445	S	S	.	.			trans	-49.4	111.1	-178.8	0	0	0	0	0	109.2	S156 P226 L228 N257	S156-A158 PolarHBondContact O-N 3.26Å; A158-P226 HydrophobicContact CB-CB 3.75Å; A158-L228 HydrophobicContact CB-CD2 3.75Å; A158-L228 HydrophobicContact CB-CG 4.41Å; A158-N257 HydrophobicContact CB-CB 4.28Å
159	E	82.1	Confident	71.7	Confident	105 Å²	105	79.5 Å²	79.5	49%	0.491	42%	0.422	S	S	.	.	B	Isolated β-bridge	trans	-98	140.6	-174.5	-57.2	-168.4	165	0	0	108.2	F157 F227	F157-E159 WeakPolarHBondContact O-CG 3.25Å; F157-E159 PolarHBondContact O-N 3.24Å; E159-F227 PolarHBondContact N-O 3.32Å; E159-F227 VanDerWaalsContact N-O 3.12Å; E159-F227 WeakPolarHBondContact O-CB 3.34Å; E159-F227 PolarHBondContact O-N 3.12Å
160	N	82.5	Confident	73.6	Confident	126 Å²	126	71.9 Å²	71.9	67%	0.674	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-84.1	119.9	165.9	-67	-35.5	0	0	0	107.6
161	T	82.5	Confident	75.4	Confident	18 Å²	18	66.8 Å²	66.8	11%	0.11	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-90.2	125.1	-179.5	52.6	0	0	0	0	110.4	V163 K217 S220 G221 F227	T161-V163 PolarHBondContact O-N 2.85Å; T161-K217 HydrophobicContact CG2-CB 4.25Å; T161-K217 HydrophobicContact CG2-CG 4.16Å; T161-K217 PolarHBondContact OG1-O 3.45Å; T161-S220 PolarHBondContact OG1-OG 3Å; T161-G221 WeakPolarHBondContact O-CA 3.3Å; T161-G221 WeakPolarHBondContact OG1-CA 3.39Å; T161-G221 PolarHBondContact OG1-N 3.47Å; T161-G221 VanDerWaalsContact OG1-N 3.12Å; T161-F227 HydrophobicContact CG2-CB 3.67Å; T161-F227 HydrophobicContact CG2-CD1 3.9Å; T161-F227 HydrophobicContact CG2-CG 3.85Å
162	D	85.9	Confident	77.5	Confident	162 Å²	162	65.1 Å²	65.1	87%	0.866	36%	0.357	S	S	*	.			trans	-81.5	3.7	174.5	-62.2	-37.2	0	0	0	113.5
163	V	91.1	Very high	79.3	Confident	36 Å²	36	66.7 Å²	66.7	22%	0.218	36%	0.364	C	S	.	.			trans	-84.1	131.1	-178.2	-177.5	0	0	0	0	109.4	T161 D167 L214 K217 A218 G221	T161-V163 PolarHBondContact O-N 2.85Å; V163-D167 HydrophobicContact CG1-CB 4.09Å; V163-L214 HydrophobicContact CG1-CD1 4.01Å; V163-K217 HydrophobicContact CB-CB 4.27Å; V163-A218 HydrophobicContact CG1-CB 4.16Å; V163-A218 WeakPolarHBondContact O-CA 3.43Å; V163-G221 WeakPolarHBondContact O-CA 3.48Å
164	S	91.3	Very high	81.3	Confident	32 Å²	32	61.5 Å²	61.5	22%	0.224	34%	0.337	C	S	.	.			trans	-121.1	176.2	177.5	75.4	0	0	0	0	112.2	S166 D167	S164-S166 PolarHBondContact O-N 3.49Å; S164-S166 VanDerWaalsContact O-N 3.14Å; S164-S166 PolarHBondContact OG-N 3.2Å; S164-S166 PolarHBondContact OG-OG 3.08Å; S164-D167 PolarHBondContact N-OD2 3.46Å; S164-D167 VanDerWaalsContact N-OD2 3.11Å; S164-D167 PolarHBondContact O-N 3.48Å; S164-D167 VanDerWaalsContact O-N 3.09Å
165	F	91.7	Very high	83.2	Confident	25 Å²	25	61.3 Å²	61.3	11%	0.11	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-16.4	177.3	-73.7	-26.7	0	0	0	113.9	D167 L178 V179 V182 A218 V219 E222	F165-D167 VanDerWaalsContact C-N 3.3Å; F165-L178 HydrophobicContact CZ-CB 4.03Å; F165-V179 HydrophobicContact CE2-CG2 3.98Å; F165-V182 HydrophobicContact CE2-CG2 3.75Å; F165-V182 HydrophobicContact CZ-CG2 3.65Å; F165-A218 HydrophobicContact CD1-CB 3.61Å; F165-A218 HydrophobicContact CE1-CB 4.04Å; F165-V219 HydrophobicContact CE1-CB 4.47Å; F165-V219 HydrophobicContact CE1-CG2 3.71Å; F165-V219 HydrophobicContact CZ-CG2 3.82Å; F165-E222 HydrophobicContact CD2-CB 4.26Å; F165-E222 HydrophobicContact CD2-CG 3.95Å; F165-E222 HydrophobicContact CE2-CB 4.31Å; F165-E222 HydrophobicContact CE2-CG 4.09Å
166	S	88.5	Confident	85	Confident	80 Å²	80	67.5 Å²	67.5	56%	0.559	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-26.5	174	63.2	0	0	0	0	113.1	S164 V168 Q169	S164-S166 PolarHBondContact O-N 3.49Å; S164-S166 VanDerWaalsContact O-N 3.14Å; S164-S166 PolarHBondContact OG-N 3.2Å; S164-S166 PolarHBondContact OG-OG 3.08Å; S166-V168 VanDerWaalsContact C-N 3.34Å; S166-Q169 PolarHBondContact O-NE2 3.37Å
167	D	87.5	Confident	86.7	Confident	77 Å²	77	70.5 Å²	70.5	41%	0.412	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-20.8	-179.3	-60	-40.5	0	0	0	112.4	V163 S164 F165	V163-D167 HydrophobicContact CG1-CB 4.09Å; S164-D167 PolarHBondContact N-OD2 3.46Å; S164-D167 VanDerWaalsContact N-OD2 3.11Å; S164-D167 PolarHBondContact O-N 3.48Å; S164-D167 VanDerWaalsContact O-N 3.09Å; F165-D167 VanDerWaalsContact C-N 3.3Å
168	V	89.2	Confident	88.1	Confident	7 Å²	7	62.8 Å²	62.8	4%	0.042	33%	0.331	C	S	.	.			trans	-88.6	130.1	175.9	-174.1	0	0	0	0	109.2	S166 K175 L214 L215 A218	S166-V168 VanDerWaalsContact C-N 3.34Å; V168-K175 WeakPolarHBondContact O-CE 3.23Å; V168-K175 PolarHBondContact O-NZ 3.49Å; V168-L214 HydrophobicContact CG2-CD2 4.12Å; V168-L214 HydrophobicContact CG2-CG 4.01Å; V168-L215 HydrophobicContact CB-CD2 4.49Å; V168-L215 HydrophobicContact CG1-CD2 3.69Å; V168-L215 HydrophobicContact CG1-CG 4.13Å; V168-L215 HydrophobicContact CG2-CD2 4.46Å; V168-A218 HydrophobicContact CG2-CB 3.63Å
169	Q	89.8	Confident	89.1	Confident	62 Å²	62	64.7 Å²	64.7	29%	0.29	34%	0.34	S	S	.	.			trans	-126.9	146.6	-179.9	-63.5	-62.5	-29.3	0	0	110.6	S166 A341 L342 L345	S166-Q169 PolarHBondContact O-NE2 3.37Å; Q169-A341 HydrophobicContact CB-CB 4.16Å; Q169-L342 HydrophobicContact CB-CD2 4.02Å; Q169-L342 HydrophobicContact CB-CG 4.25Å; Q169-L345 HydrophobicContact CG-CD2 4.1Å
170	G	85.9	Confident	89.5	Confident	9 Å²	9	64.3 Å²	64.3	9%	0.093	34%	0.341	C	S	.	.	S	Bend	trans	83	11.7	172	0	0	0	0	0	117.3	G338	G170-G338 VanDerWaalsContact CA-CA 3.4Å
171	C	87.4	Confident	89.9	Confident	14 Å²	14	58.6 Å²	58.6	10%	0.095	31%	0.311	C	S	.	.			trans	-129.5	46.1	177.9	-58.5	0	0	0	0	111.6	E173 V174 K175	C171-E173 VanDerWaalsContact C-N 3.35Å; C171-E173 PolarHBondContact O-N 3.06Å; C171-V174 HydrophobicContact CB-CB 4.16Å; C171-V174 HydrophobicContact CB-CG2 4.46Å; C171-V174 PolarHBondContact O-N 3.48Å; C171-K175 WeakPolarHBondContact O-CG 3.26Å; C171-K175 PolarHBondContact O-N 3.43Å
172	D	88.9	Confident	90.4	Very high	85 Å²	85	58.1 Å²	58.1	46%	0.455	31%	0.307	S	S	.	.	H	α-helix	trans	-69.6	-30.5	-168.7	-60.6	-35.3	0	0	0	113.8	K175 K176	D172-K175 IonicContact OD1-NZ 2.86Å; D172-K175 PolarHBondContact OD1-NZ 3.46Å; D172-K176 WeakPolarHBondContact O-CG 3.37Å; D172-K176 PolarHBondContact O-N 3.12Å
173	E	89.2	Confident	90.7	Very high	153 Å²	153	53 Å²	53	72%	0.715	28%	0.278	S	S	*	.	H	α-helix	trans	-64	-47.4	171.9	-63.2	-179	168.5	0	0	111.1	C171 K175 K176 E177	C171-E173 VanDerWaalsContact C-N 3.35Å; C171-E173 PolarHBondContact O-N 3.06Å; E173-K175 VanDerWaalsContact C-N 3.34Å; E173-K175 PolarHBondContact O-N 3.13Å; E173-K176 WeakPolarHBondContact O-CB 3.48Å; E173-K176 PolarHBondContact O-N 3.5Å; E173-E177 PolarHBondContact O-N 3.41Å
174	V	92.5	Very high	90.6	Very high	13 Å²	13	53 Å²	53	8%	0.079	28%	0.276	C	S	.	.	H	α-helix	trans	-63.2	-40	177.4	176.3	0	0	0	0	111.3	C171 K176 E177 L178 L215 I329 V331	C171-V174 HydrophobicContact CB-CB 4.16Å; C171-V174 HydrophobicContact CB-CG2 4.46Å; C171-V174 PolarHBondContact O-N 3.48Å; V174-K176 VanDerWaalsContact C-N 3.29Å; V174-K176 PolarHBondContact O-N 3.05Å; V174-E177 PolarHBondContact O-N 3.03Å; V174-L178 HydrophobicContact CG1-CD1 3.92Å; V174-L178 HydrophobicContact CG1-CG 4.42Å; V174-L178 WeakPolarHBondContact O-CG 3.34Å; V174-L178 PolarHBondContact O-N 3.4Å; V174-L215 HydrophobicContact CG1-CD1 3.95Å; V174-L215 HydrophobicContact CG1-CD2 4.45Å; V174-I329 HydrophobicContact CB-CG2 4.49Å; V174-I329 HydrophobicContact CG1-CG2 3.87Å; V174-I329 HydrophobicContact CG2-CG2 4.39Å; V174-V331 HydrophobicContact CG1-CG2 4.06Å; V174-V331 HydrophobicContact CG2-CG1 4.45Å; V174-V331 HydrophobicContact CG2-CG2 4.39Å
175	K	92.4	Very high	90.6	Very high	28 Å²	28	51.7 Å²	51.7	12%	0.122	27%	0.266	C	S	.	.	H	α-helix	trans	-59.1	-41.2	175.5	-74	177.1	-168.3	165.2	0	111.5	V168 C171 D172 E173 E177 L178 V179	V168-K175 WeakPolarHBondContact O-CE 3.23Å; V168-K175 PolarHBondContact O-NZ 3.49Å; C171-K175 WeakPolarHBondContact O-CG 3.26Å; C171-K175 PolarHBondContact O-N 3.43Å; D172-K175 IonicContact OD1-NZ 2.86Å; D172-K175 PolarHBondContact OD1-NZ 3.46Å; E173-K175 VanDerWaalsContact C-N 3.34Å; E173-K175 PolarHBondContact O-N 3.13Å; K175-E177 VanDerWaalsContact C-N 3.32Å; K175-E177 PolarHBondContact O-N 3.04Å; K175-L178 CarbonylContact O-C 3.49Å; K175-L178 PolarHBondContact O-N 3.47Å; K175-L178 VanDerWaalsContact O-N 3.16Å; K175-V179 WeakPolarHBondContact O-CG2 3.21Å; K175-V179 PolarHBondContact O-N 3.07Å
176	K	92.7	Very high	90.5	Very high	154 Å²	154	56 Å²	56	67%	0.67	28%	0.282	S	S	*	.	H	α-helix	trans	-59.9	-42.4	179.2	-72	170.8	-176	175.1	0	111.8	D172 E173 V174 V179	D172-K176 WeakPolarHBondContact O-CG 3.37Å; D172-K176 PolarHBondContact O-N 3.12Å; E173-K176 WeakPolarHBondContact O-CB 3.48Å; E173-K176 PolarHBondContact O-N 3.5Å; V174-K176 VanDerWaalsContact C-N 3.29Å; V174-K176 PolarHBondContact O-N 3.05Å; K176-V179 PolarHBondContact O-N 3.43Å
177	E	91.7	Very high	90.5	Very high	100 Å²	100	56 Å²	56	47%	0.467	28%	0.275	S	S	.	.	H	α-helix	trans	-68	-35.7	176	-64.9	-174.2	-170.9	0	0	112.3	E173 V174 K175 V179 D180 I329	E173-E177 PolarHBondContact O-N 3.41Å; V174-E177 PolarHBondContact O-N 3.03Å; K175-E177 VanDerWaalsContact C-N 3.32Å; K175-E177 PolarHBondContact O-N 3.04Å; E177-V179 VanDerWaalsContact C-N 3.33Å; E177-V179 PolarHBondContact O-N 3.4Å; E177-D180 PolarHBondContact O-N 3.23Å; E177-I329 HydrophobicContact CB-CD1 3.95Å; E177-I329 WeakPolarHBondContact OE2-CG1 3.34Å; E177-I329 WeakPolarHBondContact OE2-CG2 3.45Å
178	L	93.7	Very high	90.4	Very high	1 Å²	1	53.5 Å²	53.5	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-75.5	-17.5	178.3	-69.2	175.6	0	0	0	113.9	F165 V174 K175 D180 V181 V182 L204 L215 V219 I329	F165-L178 HydrophobicContact CZ-CB 4.03Å; V174-L178 HydrophobicContact CG1-CD1 3.92Å; V174-L178 HydrophobicContact CG1-CG 4.42Å; V174-L178 WeakPolarHBondContact O-CG 3.34Å; V174-L178 PolarHBondContact O-N 3.4Å; K175-L178 CarbonylContact O-C 3.49Å; K175-L178 PolarHBondContact O-N 3.47Å; K175-L178 VanDerWaalsContact O-N 3.16Å; L178-D180 PolarHBondContact O-N 3.11Å; L178-V181 HydrophobicContact CD2-CG2 4.22Å; L178-V181 WeakPolarHBondContact O-CB 3.49Å; L178-V181 PolarHBondContact O-N 3.4Å; L178-V182 WeakPolarHBondContact O-CG2 3.45Å; L178-V182 PolarHBondContact O-N 3.49Å; L178-L204 HydrophobicContact CD2-CD2 4.4Å; L178-L215 HydrophobicContact CD1-CB 4.33Å; L178-L215 HydrophobicContact CD1-CD2 4.06Å; L178-V219 HydrophobicContact CB-CG2 4Å; L178-V219 HydrophobicContact CD1-CG2 3.93Å; L178-V219 HydrophobicContact CD2-CG2 4.2Å; L178-V219 HydrophobicContact CG-CG2 4.28Å; L178-I329 HydrophobicContact CD2-CD1 3.69Å; L178-I329 HydrophobicContact CG-CD1 4.18Å
179	V	94	Very high	90.2	Very high	72 Å²	72	60 Å²	60	44%	0.436	29%	0.293	S	S	.	.	H	α-helix	trans	-61.5	-36.1	172.6	167.4	0	0	0	0	111	F165 K175 K176 E177 V181 V182 E183	F165-V179 HydrophobicContact CE2-CG2 3.98Å; K175-V179 WeakPolarHBondContact O-CG2 3.21Å; K175-V179 PolarHBondContact O-N 3.07Å; K176-V179 PolarHBondContact O-N 3.43Å; E177-V179 VanDerWaalsContact C-N 3.33Å; E177-V179 PolarHBondContact O-N 3.4Å; V179-V181 VanDerWaalsContact C-N 3.3Å; V179-V181 PolarHBondContact O-N 2.84Å; V179-V182 WeakPolarHBondContact O-CB 3.46Å; V179-V182 PolarHBondContact O-N 3.23Å; V179-E183 PolarHBondContact O-N 3.11Å
180	D	90.8	Very high	90.1	Very high	97 Å²	97	62.2 Å²	62.2	52%	0.519	30%	0.302	S	S	.	.	H	α-helix	trans	-62.2	-41.4	175.5	-67.7	-18.6	0	0	0	110.9	E177 L178 V182 E183 F184	E177-D180 PolarHBondContact O-N 3.23Å; L178-D180 PolarHBondContact O-N 3.11Å; D180-V182 VanDerWaalsContact C-N 3.35Å; D180-V182 PolarHBondContact O-N 3.32Å; D180-E183 PolarHBondContact O-N 3.4Å; D180-F184 HydrophobicContact CB-CE2 4.17Å; D180-F184 HydrophobicContact CB-CZ 4.09Å; D180-F184 WeakPolarHBondContact O-CD1 3.31Å; D180-F184 VanDerWaalsContact O-CD2 3.24Å; D180-F184 WeakPolarHBondContact O-CD2 3.4Å; D180-F184 WeakPolarHBondContact O-CG 3.29Å; D180-F184 PolarHBondContact O-N 3.09Å
181	V	91.9	Very high	90.2	Very high	6 Å²	6	63.7 Å²	63.7	4%	0.036	31%	0.305	C	S	.	.	H	α-helix	trans	-62.9	-41.1	175.9	-176.2	0	0	0	0	111.4	L178 V179 F184 L185 V202 V219 I304	L178-V181 HydrophobicContact CD2-CG2 4.22Å; L178-V181 WeakPolarHBondContact O-CB 3.49Å; L178-V181 PolarHBondContact O-N 3.4Å; V179-V181 VanDerWaalsContact C-N 3.3Å; V179-V181 PolarHBondContact O-N 2.84Å; V181-F184 WeakPolarHBondContact O-CB 3.46Å; V181-F184 PolarHBondContact O-N 3.4Å; V181-L185 HydrophobicContact CG1-CD1 4.31Å; V181-L185 WeakPolarHBondContact O-CG 3.34Å; V181-L185 PolarHBondContact O-N 3.17Å; V181-L185 VanDerWaalsContact O-N 3.07Å; V181-V202 HydrophobicContact CG2-CG2 4.07Å; V181-V219 HydrophobicContact CG1-CG1 4.14Å; V181-I304 HydrophobicContact CG1-CD1 3.9Å; V181-I304 HydrophobicContact CG1-CG2 4.12Å
182	V	93	Very high	90	Very high	7 Å²	7	65.3 Å²	65.3	4%	0.042	31%	0.313	C	S	.	.	H	α-helix	trans	-61.4	-44.9	175.1	169.3	0	0	0	0	111.1	F165 L178 V179 D180 F184 L185 R186 V219 E222 A223	F165-V182 HydrophobicContact CE2-CG2 3.75Å; F165-V182 HydrophobicContact CZ-CG2 3.65Å; L178-V182 WeakPolarHBondContact O-CG2 3.45Å; L178-V182 PolarHBondContact O-N 3.49Å; V179-V182 WeakPolarHBondContact O-CB 3.46Å; V179-V182 PolarHBondContact O-N 3.23Å; D180-V182 VanDerWaalsContact C-N 3.35Å; D180-V182 PolarHBondContact O-N 3.32Å; V182-F184 VanDerWaalsContact C-N 3.31Å; V182-F184 PolarHBondContact O-N 2.91Å; V182-L185 PolarHBondContact O-N 3.35Å; V182-R186 HydrophobicContact CG1-CG 4.42Å; V182-R186 PolarHBondContact O-N 2.7Å; V182-V219 HydrophobicContact CG2-CB 4.46Å; V182-V219 HydrophobicContact CG2-CG1 3.93Å; V182-E222 HydrophobicContact CG1-CB 4.22Å; V182-E222 HydrophobicContact CG1-CG 3.75Å; V182-E222 HydrophobicContact CG2-CB 4.08Å; V182-E222 HydrophobicContact CG2-CG 4.18Å; V182-A223 HydrophobicContact CG1-CB 4.2Å
183	E	91.6	Very high	89.9	Confident	54 Å²	54	69 Å²	69	25%	0.252	33%	0.328	S	S	.	.	H	α-helix	trans	-65.8	-35.2	178.7	-177.8	65.9	-174.9	0	0	111.5	V179 D180 L185 R186 N187 K190 F191	V179-E183 PolarHBondContact O-N 3.11Å; D180-E183 PolarHBondContact O-N 3.4Å; E183-L185 VanDerWaalsContact C-N 3.34Å; E183-R186 PolarHBondContact O-N 2.9Å; E183-N187 PolarHBondContact O-N 3.01Å; E183-K190 IonicContact OE1-NZ 3.82Å; E183-K190 PolarHBondContact OE1-NZ 2.93Å; E183-F191 HydrophobicContact CB-CZ 4.5Å; E183-F191 HydrophobicContact CG-CE2 3.87Å; E183-F191 HydrophobicContact CG-CZ 3.68Å
184	F	89.6	Confident	89.9	Confident	38 Å²	38	68.5 Å²	68.5	17%	0.167	33%	0.328	C	S	.	.	H	α-helix	trans	-62.7	-38.9	172.9	-59.1	-27.3	0	0	0	112.7	D180 V181 V182 P188 F191 L198 P199 I304	D180-F184 HydrophobicContact CB-CE2 4.17Å; D180-F184 HydrophobicContact CB-CZ 4.09Å; D180-F184 WeakPolarHBondContact O-CD1 3.31Å; D180-F184 VanDerWaalsContact O-CD2 3.24Å; D180-F184 WeakPolarHBondContact O-CD2 3.4Å; D180-F184 WeakPolarHBondContact O-CG 3.29Å; D180-F184 PolarHBondContact O-N 3.09Å; V181-F184 WeakPolarHBondContact O-CB 3.46Å; V181-F184 PolarHBondContact O-N 3.4Å; V182-F184 VanDerWaalsContact C-N 3.31Å; V182-F184 PolarHBondContact O-N 2.91Å; F184-P188 WeakPolarHBondContact O-CA 3.21Å; F184-F191 HydrophobicContact CD1-CD1 4.09Å; F184-F191 AromaticContact CD1-CD2 3.84Å; F184-F191 HydrophobicContact CD1-CD2 3.84Å; F184-F191 AromaticContact CD1-CE1 3.8Å; F184-F191 HydrophobicContact CD1-CE1 3.8Å; F184-F191 AromaticContact CD1-CE2 3.55Å; F184-F191 HydrophobicContact CD1-CE2 3.55Å; F184-F191 HydrophobicContact CD1-CG 4.11Å; F184-F191 AromaticContact CD1-CZ 3.51Å; F184-F191 HydrophobicContact CD1-CZ 3.51Å; F184-F191 AromaticContact CE1-CD1 3.91Å; F184-F191 HydrophobicContact CE1-CD1 3.91Å; F184-F191 HydrophobicContact CE1-CD2 4.47Å; F184-F191 AromaticContact CE1-CE1 3.5Å; F184-F191 HydrophobicContact CE1-CE1 3.5Å; F184-F191 VanDerWaalsContact CE1-CE1 3.5Å; F184-F191 HydrophobicContact CE1-CE2 4.13Å; F184-F191 HydrophobicContact CE1-CG 4.37Å; F184-F191 AromaticContact CE1-CZ 3.62Å; F184-F191 HydrophobicContact CE1-CZ 3.62Å; F184-L198 HydrophobicContact CB-CD2 3.96Å; F184-L198 HydrophobicContact CD1-CD2 3.52Å; F184-L198 HydrophobicContact CD2-CD2 4.4Å; F184-L198 HydrophobicContact CE1-CD2 4.12Å; F184-L198 HydrophobicContact CG-CD2 3.7Å; F184-P199 HydrophobicContact CD2-CG 3.72Å; F184-P199 HydrophobicContact CE2-CG 3.59Å; F184-I304 HydrophobicContact CB-CD1 3.86Å
185	L	90.4	Very high	89.5	Confident	3 Å²	3	70.7 Å²	70.7	2%	0.016	35%	0.354	C	S	.	.	H	α-helix	trans	-74.6	-38.5	178	-70.3	167.5	0	0	0	112.6	V181 V182 E183 V219 A223 V225 L261 I304	V181-L185 HydrophobicContact CG1-CD1 4.31Å; V181-L185 WeakPolarHBondContact O-CG 3.34Å; V181-L185 PolarHBondContact O-N 3.17Å; V181-L185 VanDerWaalsContact O-N 3.07Å; V182-L185 PolarHBondContact O-N 3.35Å; E183-L185 VanDerWaalsContact C-N 3.34Å; L185-V219 HydrophobicContact CD1-CG1 4.03Å; L185-A223 HydrophobicContact CB-CB 3.66Å; L185-A223 HydrophobicContact CD1-CB 3.92Å; L185-A223 HydrophobicContact CG-CB 4.45Å; L185-V225 HydrophobicContact CB-CG1 4.23Å; L185-V225 HydrophobicContact CB-CG2 4.5Å; L185-V225 HydrophobicContact CD1-CG2 4.1Å; L185-V225 HydrophobicContact CD2-CG2 4.43Å; L185-L261 HydrophobicContact CD1-CD1 3.99Å; L185-I304 HydrophobicContact CD1-CD1 4.46Å; L185-I304 HydrophobicContact CD2-CB 4.05Å; L185-I304 HydrophobicContact CD2-CD1 3.72Å; L185-I304 HydrophobicContact CD2-CG1 3.71Å; L185-I304 HydrophobicContact CG-CD1 3.72Å; L185-I304 HydrophobicContact CG-CG1 4.28Å
186	R	90.4	Very high	89.2	Confident	117 Å²	117	71.3 Å²	71.3	44%	0.442	36%	0.364	S	S	.	.	H	α-helix	trans	-69.7	-45.2	179.5	-77.5	-173.6	173.8	174	2.6	112.4	V182 E183 E222 A223	V182-R186 HydrophobicContact CG1-CG 4.42Å; V182-R186 PolarHBondContact O-N 2.7Å; E183-R186 PolarHBondContact O-N 2.9Å; R186-E222 IonicContact CZ-OE1 2.64Å; R186-E222 PolarHBondContact NE-O 2.93Å; R186-E222 PolarHBondContact NH2-O 3.21Å; R186-E222 IonicContact NH2-OE1 3.65Å; R186-E222 PolarHBondContact NH2-OE1 3.49Å; R186-A223 HydrophobicContact CG-CB 4.38Å
187	N	87.9	Confident	88.7	Confident	79 Å²	79	73.3 Å²	73.3	42%	0.422	37%	0.373	S	S	.	.			trans	-131.8	61.9	-172	-67	-46.7	0	0	0	112.6	E183 E189 K190 F191	E183-N187 PolarHBondContact O-N 3.01Å; N187-E189 PolarHBondContact O-N 2.98Å; N187-K190 HydrophobicContact CB-CB 4.21Å; N187-K190 WeakPolarHBondContact O-CB 3.45Å; N187-K190 PolarHBondContact O-N 3.35Å; N187-F191 WeakPolarHBondContact O-CD2 3.43Å
188	P	85.4	Confident	88.4	Confident	24 Å²	24	69 Å²	69	16%	0.156	35%	0.353	C	S	.	.	H	α-helix	trans	-60.7	-31.4	-177.5	24	-33.8	0	0	0	112.8	F184 K190 F191 N192 L198	F184-P188 WeakPolarHBondContact O-CA 3.21Å; P188-K190 VanDerWaalsContact C-N 3.35Å; P188-K190 PolarHBondContact O-N 3.28Å; P188-F191 PolarHBondContact O-N 2.94Å; P188-N192 PolarHBondContact O-N 3.26Å; P188-N192 VanDerWaalsContact O-N 3.16Å; P188-N192 PolarHBondContact O-ND2 3.23Å; P188-N192 VanDerWaalsContact O-ND2 3.08Å; P188-L198 HydrophobicContact CB-CD1 4.06Å
189	E	86.2	Confident	88.1	Confident	143 Å²	143	69.7 Å²	69.7	67%	0.668	36%	0.358	S	S	*	.	H	α-helix	trans	-62.2	-38	179.7	-62.2	-170.6	173	0	0	113.3	N187 F191 N192 Q193	N187-E189 PolarHBondContact O-N 2.98Å; E189-F191 VanDerWaalsContact C-N 3.29Å; E189-F191 PolarHBondContact O-N 3.23Å; E189-N192 PolarHBondContact O-N 2.93Å; E189-Q193 WeakPolarHBondContact O-CG 3.35Å; E189-Q193 PolarHBondContact O-N 2.9Å
190	K	87.5	Confident	87.8	Confident	110 Å²	110	67.5 Å²	67.5	48%	0.478	34%	0.342	S	S	.	.	H	α-helix	trans	-57.7	-42.2	-179.8	176.5	-179.1	166.8	-172.7	0	111.6	E183 N187 P188	E183-K190 IonicContact OE1-NZ 3.82Å; E183-K190 PolarHBondContact OE1-NZ 2.93Å; N187-K190 HydrophobicContact CB-CB 4.21Å; N187-K190 WeakPolarHBondContact O-CB 3.45Å; N187-K190 PolarHBondContact O-N 3.35Å; P188-K190 VanDerWaalsContact C-N 3.35Å; P188-K190 PolarHBondContact O-N 3.28Å
191	F	86.4	Confident	88	Confident	39 Å²	39	62.9 Å²	62.9	17%	0.171	32%	0.318	C	S	.	.	H	α-helix	trans	-76.2	-38.4	178.2	-62	-81.4	0	0	0	112	E183 F184 N187 P188 E189 Q193 I194 G195 A196 L198	E183-F191 HydrophobicContact CB-CZ 4.5Å; E183-F191 HydrophobicContact CG-CE2 3.87Å; E183-F191 HydrophobicContact CG-CZ 3.68Å; F184-F191 HydrophobicContact CD1-CD1 4.09Å; F184-F191 AromaticContact CD1-CD2 3.84Å; F184-F191 HydrophobicContact CD1-CD2 3.84Å; F184-F191 AromaticContact CD1-CE1 3.8Å; F184-F191 HydrophobicContact CD1-CE1 3.8Å; F184-F191 AromaticContact CD1-CE2 3.55Å; F184-F191 HydrophobicContact CD1-CE2 3.55Å; F184-F191 HydrophobicContact CD1-CG 4.11Å; F184-F191 AromaticContact CD1-CZ 3.51Å; F184-F191 HydrophobicContact CD1-CZ 3.51Å; F184-F191 AromaticContact CE1-CD1 3.91Å; F184-F191 HydrophobicContact CE1-CD1 3.91Å; F184-F191 HydrophobicContact CE1-CD2 4.47Å; F184-F191 AromaticContact CE1-CE1 3.5Å; F184-F191 HydrophobicContact CE1-CE1 3.5Å; F184-F191 VanDerWaalsContact CE1-CE1 3.5Å; F184-F191 HydrophobicContact CE1-CE2 4.13Å; F184-F191 HydrophobicContact CE1-CG 4.37Å; F184-F191 AromaticContact CE1-CZ 3.62Å; F184-F191 HydrophobicContact CE1-CZ 3.62Å; N187-F191 WeakPolarHBondContact O-CD2 3.43Å; P188-F191 PolarHBondContact O-N 2.94Å; E189-F191 VanDerWaalsContact C-N 3.29Å; E189-F191 PolarHBondContact O-N 3.23Å; F191-Q193 VanDerWaalsContact C-N 3.3Å; F191-Q193 PolarHBondContact O-N 3.27Å; F191-I194 PolarHBondContact O-N 3.35Å; F191-G195 PolarHBondContact O-N 3.17Å; F191-A196 HydrophobicContact CB-CB 4.28Å; F191-A196 PolarHBondContact O-N 3.3Å; F191-L198 HydrophobicContact CB-CD2 3.57Å; F191-L198 HydrophobicContact CB-CG 4.34Å; F191-L198 HydrophobicContact CD1-CD2 4.4Å; F191-L198 HydrophobicContact CD2-CD2 4.02Å; F191-L198 HydrophobicContact CG-CD2 3.74Å
192	N	84.4	Confident	88.1	Confident	49 Å²	49	62.6 Å²	62.6	26%	0.262	32%	0.316	S	S	.	.	H	α-helix	trans	-61.8	-36.3	176.5	-74.2	-38.1	0	0	0	112.6	P188 E189 I194 G195	P188-N192 PolarHBondContact O-N 3.26Å; P188-N192 VanDerWaalsContact O-N 3.16Å; P188-N192 PolarHBondContact O-ND2 3.23Å; P188-N192 VanDerWaalsContact O-ND2 3.08Å; E189-N192 PolarHBondContact O-N 2.93Å; N192-I194 VanDerWaalsContact C-N 3.34Å; N192-I194 PolarHBondContact O-N 2.85Å; N192-G195 PolarHBondContact O-N 3.48Å; N192-G195 VanDerWaalsContact O-N 3.11Å
193	Q	86.4	Confident	88.2	Confident	161 Å²	161	62.3 Å²	62.3	75%	0.752	31%	0.314	S	S	*	.	H	α-helix	trans	-64.3	-36.1	177.2	-74.8	175.7	17.8	0	0	112.8	E189 F191 G195	E189-Q193 WeakPolarHBondContact O-CG 3.35Å; E189-Q193 PolarHBondContact O-N 2.9Å; F191-Q193 VanDerWaalsContact C-N 3.3Å; F191-Q193 PolarHBondContact O-N 3.27Å; Q193-G195 PolarHBondContact O-N 3.28Å
194	I	89.3	Confident	88.5	Confident	143 Å²	143	59.7 Å²	59.7	73%	0.733	30%	0.302	S	S	*	.	H	α-helix	trans	-76.8	-16.1	176	-62.3	172.3	0	0	0	111.2	F191 N192	F191-I194 PolarHBondContact O-N 3.35Å; N192-I194 VanDerWaalsContact C-N 3.34Å; N192-I194 PolarHBondContact O-N 2.85Å
195	G	84.1	Confident	88.8	Confident	59 Å²	59	58.4 Å²	58.4	61%	0.608	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.1	15.1	-174.4	0	0	0	0	0	113.5	F191 N192 Q193	F191-G195 PolarHBondContact O-N 3.17Å; N192-G195 PolarHBondContact O-N 3.48Å; N192-G195 VanDerWaalsContact O-N 3.11Å; Q193-G195 PolarHBondContact O-N 3.28Å
196	A	85.3	Confident	89	Confident	42 Å²	42	58.8 Å²	58.8	35%	0.347	30%	0.301	S	S	.	.			trans	-68.9	136.1	173.2	0	0	0	0	0	110	F191	F191-A196 HydrophobicContact CB-CB 4.28Å; F191-A196 PolarHBondContact O-N 3.3Å
197	K	82.4	Confident	89.2	Confident	195 Å²	195	55.5 Å²	55.5	85%	0.848	30%	0.295	S	S	*	.			trans	-88	115	172.9	-68	-178.5	-179.4	177.9	0	108.3
198	L	85.5	Confident	89.4	Confident	11 Å²	11	55.9 Å²	55.9	6%	0.058	30%	0.302	C	S	.	.			trans	-65.4	140.9	175.1	-61.7	178.3	0	0	0	110.5	F184 P188 F191 K200 S299	F184-L198 HydrophobicContact CB-CD2 3.96Å; F184-L198 HydrophobicContact CD1-CD2 3.52Å; F184-L198 HydrophobicContact CD2-CD2 4.4Å; F184-L198 HydrophobicContact CE1-CD2 4.12Å; F184-L198 HydrophobicContact CG-CD2 3.7Å; P188-L198 HydrophobicContact CB-CD1 4.06Å; F191-L198 HydrophobicContact CB-CD2 3.57Å; F191-L198 HydrophobicContact CB-CG 4.34Å; F191-L198 HydrophobicContact CD1-CD2 4.4Å; F191-L198 HydrophobicContact CD2-CD2 4.02Å; F191-L198 HydrophobicContact CG-CD2 3.74Å; L198-K200 PolarHBondContact O-N 3.29Å; L198-S299 PolarHBondContact O-OG 3.2Å
199	P	86.8	Confident	89.8	Confident	15 Å²	15	56.2 Å²	56.2	10%	0.097	31%	0.31	C	S	.	.			trans	-61.1	132	173.9	27.2	-33.4	0	0	0	109.1	F184 D326 V327	F184-P199 HydrophobicContact CD2-CG 3.72Å; F184-P199 HydrophobicContact CE2-CG 3.59Å; P199-D326 WeakPolarHBondContact CB-OD1 3.48Å; P199-V327 HydrophobicContact CB-CG2 3.93Å
200	K	89.3	Confident	90.2	Very high	26 Å²	26	49.9 Å²	49.9	11%	0.113	28%	0.281	C	S	.	.	S	Bend	trans	-81	-31.2	-178.7	-75.8	-179	155.8	-156.4	0	111.6	L198 M294 D295 F297 V305 G323	L198-K200 PolarHBondContact O-N 3.29Å; K200-M294 HydrophobicContact CB-CE 4.12Å; K200-M294 PolarHBondContact NZ-O 3.4Å; K200-D295 PolarHBondContact NZ-O 3.46Å; K200-F297 HydrophobicContact CB-CE2 4.21Å; K200-F297 HydrophobicContact CB-CZ 3.87Å; K200-F297 HydrophobicContact CD-CE2 4.33Å; K200-F297 HydrophobicContact CD-CZ 4.32Å; K200-F297 WeakPolarHBondContact CE-O 3.37Å; K200-F297 HydrophobicContact CG-CE2 3.92Å; K200-F297 HydrophobicContact CG-CZ 4.03Å; K200-F297 PolarHBondContact NZ-O 3.07Å; K200-V305 PolarHBondContact O-N 3.34Å; K200-G323 WeakPolarHBondContact CD-O 3.49Å
201	G	93.3	Very high	90.5	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	140.7	-178.3	0	0	0	0	0	113.5	V305 R324 F325 D326 V327	G201-V305 CarbonylContact C-O 3.54Å; G201-V305 WeakPolarHBondContact CA-O 3.45Å; G201-R324 WeakPolarHBondContact CA-O 3.25Å; G201-R324 PolarHBondContact N-O 3.06Å; G201-F325 WeakPolarHBondContact O-CA 3.45Å; G201-D326 PolarHBondContact O-N 2.92Å; G201-D326 VanDerWaalsContact O-N 3.16Å; G201-V327 PolarHBondContact O-N 3.4Å
202	V	95.2	Very high	90.9	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	129.4	178.4	-175	0	0	0	0	108.2	V181 V305 L306 G307 V327 I329	V181-V202 HydrophobicContact CG2-CG2 4.07Å; V202-V305 PolarHBondContact N-O 3.03Å; V202-L306 HydrophobicContact CB-CD2 3.56Å; V202-L306 HydrophobicContact CG1-CD2 4.32Å; V202-L306 HydrophobicContact CG2-CD2 4.03Å; V202-L306 CarbonylContact O-C 3.59Å; V202-L306 VanDerWaalsContact O-CA 3.32Å; V202-L306 WeakPolarHBondContact O-CA 3.37Å; V202-G307 PolarHBondContact O-N 2.76Å; V202-V327 CarbonylContact C-O 3.57Å; V202-V327 WeakPolarHBondContact CA-O 3.29Å; V202-V327 HydrophobicContact CB-CB 4.39Å; V202-V327 HydrophobicContact CG1-CB 4.09Å; V202-V327 HydrophobicContact CG1-CG1 3.98Å; V202-V327 HydrophobicContact CG2-CB 4.13Å; V202-I329 HydrophobicContact CG1-CD1 3.54Å; V202-I329 HydrophobicContact CG1-CG1 3.75Å
203	L	95.6	Very high	91.3	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	116.4	179.2	-173.6	70	0	0	0	110.1	V205 I267 G307 T309 L315 L320 F325 V327 Q328 I329	L203-V205 HydrophobicContact CD2-CG2 3.77Å; L203-V205 HydrophobicContact CG-CG2 3.79Å; L203-I267 HydrophobicContact CD1-CG2 3.85Å; L203-G307 CarbonylContact C-O 3.58Å; L203-G307 WeakPolarHBondContact CA-O 3.43Å; L203-T309 HydrophobicContact CD1-CG2 3.95Å; L203-T309 HydrophobicContact CD2-CG2 4.14Å; L203-T309 HydrophobicContact CG-CG2 4.13Å; L203-L315 HydrophobicContact CD1-CD2 4.48Å; L203-L315 HydrophobicContact CD2-CD2 3.92Å; L203-L320 HydrophobicContact CD2-CD2 3.66Å; L203-F325 HydrophobicContact CB-CB 4.14Å; L203-F325 HydrophobicContact CB-CD1 4.14Å; L203-F325 HydrophobicContact CB-CG 4.32Å; L203-V327 PolarHBondContact N-O 3.48Å; L203-Q328 HydrophobicContact CB-CG 4.24Å; L203-Q328 HydrophobicContact CD2-CG 4.35Å; L203-Q328 WeakPolarHBondContact O-CA 3.38Å; L203-I329 PolarHBondContact O-N 3.33Å
204	L	96.8	Very high	91.7	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	112.4	170.7	-57.3	-177.8	0	0	0	109.5	L178 K212 F263 G307 A308 T309 I329 V331	L178-L204 HydrophobicContact CD2-CD2 4.4Å; L204-K212 HydrophobicContact CB-CD 4.21Å; L204-K212 HydrophobicContact CB-CG 4.38Å; L204-K212 HydrophobicContact CD1-CB 4.35Å; L204-F263 HydrophobicContact CD1-CE2 4.39Å; L204-G307 PolarHBondContact N-O 3.26Å; L204-A308 HydrophobicContact CB-CB 4.47Å; L204-A308 WeakPolarHBondContact O-CA 3.45Å; L204-T309 PolarHBondContact O-N 3.12Å; L204-I329 WeakPolarHBondContact CA-O 3.41Å; L204-I329 HydrophobicContact CD2-CB 4.06Å; L204-I329 HydrophobicContact CD2-CG2 4.47Å; L204-V331 HydrophobicContact CB-CG2 4.37Å; L204-V331 HydrophobicContact CD2-CG2 4.36Å
205	V	95.8	Very high	92	Very high	11 Å²	11	33.3 Å²	33.3	7%	0.067	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	127.4	-178.1	-178.4	0	0	0	0	109.5	L203 T309 A312 I329 H330 V331	L203-V205 HydrophobicContact CD2-CG2 3.77Å; L203-V205 HydrophobicContact CG-CG2 3.79Å; V205-T309 HydrophobicContact CG2-CG2 3.92Å; V205-A312 HydrophobicContact CG1-CB 3.69Å; V205-A312 HydrophobicContact CG2-CB 3.96Å; V205-I329 PolarHBondContact N-O 3.18Å; V205-H330 CarbonylContact O-C 3.56Å; V205-H330 VanDerWaalsContact O-CA 3.29Å; V205-H330 WeakPolarHBondContact O-CA 3.27Å; V205-V331 PolarHBondContact O-N 3.48Å
206	G	94.6	Very high	92.5	Very high	10 Å²	10	30.5 Å²	30.5	10%	0.103	18%	0.184	C	C	.	.			trans	172.1	169.5	174	0	0	0	0	0	112.9	K212 T309 N310 V331	G206-K212 PolarHBondContact O-NZ 2.86Å; G206-T309 PolarHBondContact N-O 3.36Å; G206-N310 WeakPolarHBondContact O-CA 3.43Å; G206-N310 PolarHBondContact O-OD1 2.62Å; G206-V331 WeakPolarHBondContact CA-O 3.25Å
207	P	94.1	Very high	93	Very high	49 Å²	49	32 Å²	32	32%	0.318	18%	0.183	S	C	.	.			trans	-59.2	161.1	-178.8	21.5	-28.2	0	0	0	112.3	V210 K212 V331 P333	P207-V210 HydrophobicContact CG-CG1 3.73Å; P207-V210 WeakPolarHBondContact O-CG2 3.45Å; P207-K212 PolarHBondContact O-NZ 2.96Å; P207-V331 WeakPolarHBondContact CD-O 3.38Å; P207-P333 HydrophobicContact CG-CG 3.82Å
208	P	93.6	Very high	93.5	Very high	86 Å²	86	22.8 Å²	22.8	56%	0.558	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.3	152.9	174.9	27.9	-35.1	0	0	0	110.6	V210 T369	P208-V210 VanDerWaalsContact C-N 3.33Å; P208-V210 PolarHBondContact O-N 3.35Å; P208-T369 WeakPolarHBondContact O-CG2 3.44Å
209	G	93.5	Very high	94	Very high	31 Å²	31	22.2 Å²	22.2	32%	0.32	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.1	-0.9	173.9	0	0	0	0	0	117	G211 G370 A371	G209-G211 VanDerWaalsContact C-N 3.27Å; G209-G211 PolarHBondContact O-N 3.39Å; G209-G370 PolarHBondContact O-N 3.15Å; G209-A371 PolarHBondContact O-N 3.44Å
210	V	93.8	Very high	94.4	Very high	10 Å²	10	21.5 Å²	21.5	6%	0.061	14%	0.135	C	C	.	.	S	Bend	trans	-78.2	-5.1	175.5	-58.8	0	0	0	0	114.6	P207 P208 K212 V331 T369	P207-V210 HydrophobicContact CG-CG1 3.73Å; P207-V210 WeakPolarHBondContact O-CG2 3.45Å; P208-V210 VanDerWaalsContact C-N 3.33Å; P208-V210 PolarHBondContact O-N 3.35Å; V210-K212 HydrophobicContact CG2-CG 3.81Å; V210-V331 HydrophobicContact CB-CG1 3.99Å; V210-V331 HydrophobicContact CG2-CB 3.95Å; V210-V331 HydrophobicContact CG2-CG1 3.53Å; V210-T369 HydrophobicContact CG1-CG2 4.02Å
211	G	93.5	Very high	94.6	Very high	26 Å²	26	20.5 Å²	20.5	27%	0.268	13%	0.131	S	C	.	.			trans	90.4	28.5	176.7	0	0	0	0	0	115.6	G209 T213 L214 L215	G209-G211 VanDerWaalsContact C-N 3.27Å; G209-G211 PolarHBondContact O-N 3.39Å; G211-T213 PolarHBondContact O-N 2.69Å; G211-L214 WeakPolarHBondContact O-CB 3.35Å; G211-L214 PolarHBondContact O-N 2.72Å; G211-L214 VanDerWaalsContact O-N 3.07Å; G211-L215 PolarHBondContact O-N 3.12Å
212	K	95.3	Very high	94.7	Very high	14 Å²	14	23.2 Å²	23.2	6%	0.061	14%	0.144	C	C	.	.	H	α-helix	trans	-52.8	-48.2	176	-62.5	-173.7	-70.2	-83.4	0	113	L204 G206 P207 V210 L214 L215 A216 A308 N310 V331	L204-K212 HydrophobicContact CB-CD 4.21Å; L204-K212 HydrophobicContact CB-CG 4.38Å; L204-K212 HydrophobicContact CD1-CB 4.35Å; G206-K212 PolarHBondContact O-NZ 2.86Å; P207-K212 PolarHBondContact O-NZ 2.96Å; V210-K212 HydrophobicContact CG2-CG 3.81Å; K212-L214 VanDerWaalsContact C-N 3.32Å; K212-L214 PolarHBondContact O-N 2.89Å; K212-L215 WeakPolarHBondContact O-CB 3.39Å; K212-L215 PolarHBondContact O-N 3.24Å; K212-A216 PolarHBondContact O-N 3.35Å; K212-A308 HydrophobicContact CB-CB 4.14Å; K212-A308 HydrophobicContact CD-CB 4.06Å; K212-N310 PolarHBondContact NZ-OD1 2.8Å; K212-V331 HydrophobicContact CG-CB 4.5Å; K212-V331 HydrophobicContact CG-CG2 4.44Å
213	T	94	Very high	94.6	Very high	44 Å²	44	23.5 Å²	23.5	27%	0.27	15%	0.146	S	C	.	.	H	α-helix	trans	-65	-35.5	177	-38.1	0	0	0	0	112.1	G211 K217 Y229 F263 D265	G211-T213 PolarHBondContact O-N 2.69Å; T213-K217 WeakPolarHBondContact O-CG 3.33Å; T213-K217 PolarHBondContact O-N 3.42Å; T213-Y229 HydrophobicContact CG2-CE2 4.01Å; T213-F263 HydrophobicContact CG2-CD1 4.46Å; T213-F263 HydrophobicContact CG2-CE1 3.8Å; T213-F263 HydrophobicContact CG2-CZ 4.39Å; T213-D265 PolarHBondContact OG1-OD2 3.14Å
214	L	94	Very high	94.4	Very high	71 Å²	71	31 Å²	31	37%	0.372	18%	0.181	S	C	.	.	H	α-helix	trans	-70.6	-41.2	177.3	-172.3	70.8	0	0	0	111.3	V163 V168 G211 K212 K217 A218	V163-L214 HydrophobicContact CG1-CD1 4.01Å; V168-L214 HydrophobicContact CG2-CD2 4.12Å; V168-L214 HydrophobicContact CG2-CG 4.01Å; G211-L214 WeakPolarHBondContact O-CB 3.35Å; G211-L214 PolarHBondContact O-N 2.72Å; G211-L214 VanDerWaalsContact O-N 3.07Å; K212-L214 VanDerWaalsContact C-N 3.32Å; K212-L214 PolarHBondContact O-N 2.89Å; L214-K217 PolarHBondContact O-N 2.85Å; L214-A218 WeakPolarHBondContact O-CB 3.05Å; L214-A218 PolarHBondContact O-N 2.96Å
215	L	95.1	Very high	94.2	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-58.4	-46.3	173.4	-81.1	165.1	0	0	0	111.2	V168 V174 L178 G211 K212 K217 A218 V219 V331	V168-L215 HydrophobicContact CB-CD2 4.49Å; V168-L215 HydrophobicContact CG1-CD2 3.69Å; V168-L215 HydrophobicContact CG1-CG 4.13Å; V168-L215 HydrophobicContact CG2-CD2 4.46Å; V174-L215 HydrophobicContact CG1-CD1 3.95Å; V174-L215 HydrophobicContact CG1-CD2 4.45Å; L178-L215 HydrophobicContact CD1-CB 4.33Å; L178-L215 HydrophobicContact CD1-CD2 4.06Å; G211-L215 PolarHBondContact O-N 3.12Å; K212-L215 WeakPolarHBondContact O-CB 3.39Å; K212-L215 PolarHBondContact O-N 3.24Å; L215-K217 PolarHBondContact O-N 3.1Å; L215-A218 WeakPolarHBondContact O-CB 3.32Å; L215-A218 PolarHBondContact O-N 3.06Å; L215-A218 VanDerWaalsContact O-N 3.12Å; L215-V219 WeakPolarHBondContact O-CG2 3.37Å; L215-V219 PolarHBondContact O-N 2.51Å; L215-V331 HydrophobicContact CD1-CG1 3.89Å; L215-V331 HydrophobicContact CD1-CG2 4.2Å
216	A	95.1	Very high	94.2	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-61.1	-42.7	178	0	0	0	0	0	112.7	K212 A218 V219 S220 F227 L261 F263 L306	K212-A216 PolarHBondContact O-N 3.35Å; A216-A218 VanDerWaalsContact C-N 3.3Å; A216-A218 PolarHBondContact O-N 3.21Å; A216-V219 PolarHBondContact O-N 2.91Å; A216-S220 PolarHBondContact O-N 2.92Å; A216-S220 VanDerWaalsContact O-N 3.16Å; A216-S220 PolarHBondContact O-OG 2.59Å; A216-F227 HydrophobicContact CB-CE2 4.07Å; A216-F227 HydrophobicContact CB-CZ 4.43Å; A216-L261 WeakPolarHBondContact O-CD2 3.47Å; A216-F263 HydrophobicContact CB-CB 4.31Å; A216-F263 HydrophobicContact CB-CD1 4.5Å; A216-F263 HydrophobicContact CB-CD2 3.19Å; A216-F263 HydrophobicContact CB-CE2 3.5Å; A216-F263 VanDerWaalsContact CB-CE2 3.5Å; A216-F263 HydrophobicContact CB-CG 3.76Å; A216-F263 HydrophobicContact CB-CZ 4.26Å; A216-L306 HydrophobicContact CB-CD1 3.86Å
217	K	95	Very high	94.2	Very high	74 Å²	74	32 Å²	32	32%	0.322	19%	0.186	S	C	.	.	H	α-helix	trans	-63.1	-36.8	173.4	-71.6	-177.6	177.9	-168.5	0	112.5	T161 V163 T213 L214 L215 S220 G221 F227	T161-K217 HydrophobicContact CG2-CB 4.25Å; T161-K217 HydrophobicContact CG2-CG 4.16Å; T161-K217 PolarHBondContact OG1-O 3.45Å; V163-K217 HydrophobicContact CB-CB 4.27Å; T213-K217 WeakPolarHBondContact O-CG 3.33Å; T213-K217 PolarHBondContact O-N 3.42Å; L214-K217 PolarHBondContact O-N 2.85Å; L215-K217 PolarHBondContact O-N 3.1Å; K217-S220 PolarHBondContact O-N 2.99Å; K217-S220 PolarHBondContact O-OG 3.14Å; K217-G221 PolarHBondContact O-N 3.06Å; K217-F227 HydrophobicContact CG-CD1 4.32Å; K217-F227 HydrophobicContact CG-CE1 3.74Å; K217-F227 HydrophobicContact CG-CE2 4.28Å; K217-F227 HydrophobicContact CG-CZ 3.73Å
218	A	94.6	Very high	94.3	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-68.9	-35.1	177.3	0	0	0	0	0	112.2	V163 F165 V168 L214 L215 A216 E222	V163-A218 HydrophobicContact CG1-CB 4.16Å; V163-A218 WeakPolarHBondContact O-CA 3.43Å; F165-A218 HydrophobicContact CD1-CB 3.61Å; F165-A218 HydrophobicContact CE1-CB 4.04Å; V168-A218 HydrophobicContact CG2-CB 3.63Å; L214-A218 WeakPolarHBondContact O-CB 3.05Å; L214-A218 PolarHBondContact O-N 2.96Å; L215-A218 WeakPolarHBondContact O-CB 3.32Å; L215-A218 PolarHBondContact O-N 3.06Å; L215-A218 VanDerWaalsContact O-N 3.12Å; A216-A218 VanDerWaalsContact C-N 3.3Å; A216-A218 PolarHBondContact O-N 3.21Å; A218-E222 VanDerWaalsContact O-CB 3.24Å; A218-E222 WeakPolarHBondContact O-CB 3.46Å; A218-E222 PolarHBondContact O-N 3.45Å
219	V	95.4	Very high	94.3	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-63.3	-46.3	173	174	0	0	0	0	110.9	F165 L178 V181 V182 L185 L215 A216 A223 L261	F165-V219 HydrophobicContact CE1-CB 4.47Å; F165-V219 HydrophobicContact CE1-CG2 3.71Å; F165-V219 HydrophobicContact CZ-CG2 3.82Å; L178-V219 HydrophobicContact CB-CG2 4Å; L178-V219 HydrophobicContact CD1-CG2 3.93Å; L178-V219 HydrophobicContact CD2-CG2 4.2Å; L178-V219 HydrophobicContact CG-CG2 4.28Å; V181-V219 HydrophobicContact CG1-CG1 4.14Å; V182-V219 HydrophobicContact CG2-CB 4.46Å; V182-V219 HydrophobicContact CG2-CG1 3.93Å; L185-V219 HydrophobicContact CD1-CG1 4.03Å; L215-V219 WeakPolarHBondContact O-CG2 3.37Å; L215-V219 PolarHBondContact O-N 2.51Å; A216-V219 PolarHBondContact O-N 2.91Å; V219-A223 VanDerWaalsContact O-CB 3.26Å; V219-A223 WeakPolarHBondContact O-CB 3.25Å; V219-A223 PolarHBondContact O-N 2.67Å; V219-L261 HydrophobicContact CB-CD2 4.01Å; V219-L261 HydrophobicContact CG1-CD2 3.86Å
220	S	94.5	Very high	94.3	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-65.8	-41.7	177.8	50.5	0	0	0	0	112.5	T161 A216 K217 A223 Q224 V225 F227	T161-S220 PolarHBondContact OG1-OG 3Å; A216-S220 PolarHBondContact O-N 2.92Å; A216-S220 VanDerWaalsContact O-N 3.16Å; A216-S220 PolarHBondContact O-OG 2.59Å; K217-S220 PolarHBondContact O-N 2.99Å; K217-S220 PolarHBondContact O-OG 3.14Å; S220-A223 CarbonylContact O-C 3.47Å; S220-A223 PolarHBondContact O-N 3.22Å; S220-Q224 WeakPolarHBondContact O-CA 3.44Å; S220-Q224 PolarHBondContact O-N 2.94Å; S220-V225 PolarHBondContact O-N 3.35Å; S220-V225 VanDerWaalsContact O-N 3.16Å; S220-F227 WeakPolarHBondContact OG-CD2 3.47Å
221	G	94.7	Very high	94.2	Very high	4 Å²	4	28.4 Å²	28.4	4%	0.041	15%	0.149	C	C	.	.	H	α-helix	trans	-70.1	-35	178.3	0	0	0	0	0	113.1	T161 V163 K217 Q224	T161-G221 WeakPolarHBondContact O-CA 3.3Å; T161-G221 WeakPolarHBondContact OG1-CA 3.39Å; T161-G221 PolarHBondContact OG1-N 3.47Å; T161-G221 VanDerWaalsContact OG1-N 3.12Å; V163-G221 WeakPolarHBondContact O-CA 3.48Å; K217-G221 PolarHBondContact O-N 3.06Å; G221-Q224 PolarHBondContact O-N 2.83Å; G221-Q224 PolarHBondContact O-NE2 3.21Å
222	E	94.1	Very high	93.9	Very high	57 Å²	57	27.2 Å²	27.2	27%	0.266	14%	0.136	S	C	.	.	H	α-helix	trans	-68	-44.4	171.5	-169.5	64.1	-137.9	0	0	110.7	F165 V182 R186 A218 Q224	F165-E222 HydrophobicContact CD2-CB 4.26Å; F165-E222 HydrophobicContact CD2-CG 3.95Å; F165-E222 HydrophobicContact CE2-CB 4.31Å; F165-E222 HydrophobicContact CE2-CG 4.09Å; V182-E222 HydrophobicContact CG1-CB 4.22Å; V182-E222 HydrophobicContact CG1-CG 3.75Å; V182-E222 HydrophobicContact CG2-CB 4.08Å; V182-E222 HydrophobicContact CG2-CG 4.18Å; R186-E222 IonicContact CZ-OE1 2.64Å; R186-E222 PolarHBondContact NE-O 2.93Å; R186-E222 PolarHBondContact NH2-O 3.21Å; R186-E222 IonicContact NH2-OE1 3.65Å; R186-E222 PolarHBondContact NH2-OE1 3.49Å; A218-E222 VanDerWaalsContact O-CB 3.24Å; A218-E222 WeakPolarHBondContact O-CB 3.46Å; A218-E222 PolarHBondContact O-N 3.45Å; E222-Q224 PolarHBondContact O-N 2.64Å
223	A	92.8	Very high	93.4	Very high	6 Å²	6	29.6 Å²	29.6	5%	0.05	16%	0.155	C	C	.	.	H	α-helix	trans	-71.6	-15	177.1	0	0	0	0	0	114	V182 L185 R186 V219 S220 V225	V182-A223 HydrophobicContact CG1-CB 4.2Å; L185-A223 HydrophobicContact CB-CB 3.66Å; L185-A223 HydrophobicContact CD1-CB 3.92Å; L185-A223 HydrophobicContact CG-CB 4.45Å; R186-A223 HydrophobicContact CG-CB 4.38Å; V219-A223 VanDerWaalsContact O-CB 3.26Å; V219-A223 WeakPolarHBondContact O-CB 3.25Å; V219-A223 PolarHBondContact O-N 2.67Å; S220-A223 CarbonylContact O-C 3.47Å; S220-A223 PolarHBondContact O-N 3.22Å; A223-V225 VanDerWaalsContact C-N 3.26Å; A223-V225 HydrophobicContact CB-CG1 4.18Å; A223-V225 HydrophobicContact CB-CG2 3.99Å; A223-V225 PolarHBondContact O-N 2.95Å
224	Q	92.5	Very high	93	Very high	157 Å²	157	28.8 Å²	28.8	73%	0.734	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.6	40.4	-174.3	-63.4	-71.5	-34	0	0	112.4	S220 G221 E222	S220-Q224 WeakPolarHBondContact O-CA 3.44Å; S220-Q224 PolarHBondContact O-N 2.94Å; G221-Q224 PolarHBondContact O-N 2.83Å; G221-Q224 PolarHBondContact O-NE2 3.21Å; E222-Q224 PolarHBondContact O-N 2.64Å
225	V	93.2	Very high	92.6	Very high	9 Å²	9	25.6 Å²	25.6	6%	0.055	13%	0.134	C	C	.	.			trans	-113.1	151.7	177.3	-60	0	0	0	0	110.8	L185 S220 A223 F227 P259 L261	L185-V225 HydrophobicContact CB-CG1 4.23Å; L185-V225 HydrophobicContact CB-CG2 4.5Å; L185-V225 HydrophobicContact CD1-CG2 4.1Å; L185-V225 HydrophobicContact CD2-CG2 4.43Å; S220-V225 PolarHBondContact O-N 3.35Å; S220-V225 VanDerWaalsContact O-N 3.16Å; A223-V225 VanDerWaalsContact C-N 3.26Å; A223-V225 HydrophobicContact CB-CG1 4.18Å; A223-V225 HydrophobicContact CB-CG2 3.99Å; A223-V225 PolarHBondContact O-N 2.95Å; V225-F227 PolarHBondContact O-N 3.26Å; V225-P259 HydrophobicContact CG1-CG 4.42Å; V225-L261 HydrophobicContact CG2-CB 4.14Å
226	P	94.8	Very high	92	Very high	30 Å²	30	29.3 Å²	29.3	20%	0.195	15%	0.153	C	C	.	.			trans	-58.8	138.6	177.3	-21.8	32.9	0	0	0	112.4	A158 P259 C260 L261	A158-P226 HydrophobicContact CB-CB 3.75Å; P226-P259 VanDerWaalsContact CD-O 3.27Å; P226-P259 WeakPolarHBondContact CD-O 3.34Å; P226-C260 HydrophobicContact CB-CB 4.3Å; P226-C260 WeakPolarHBondContact O-CB 3.35Å; P226-L261 PolarHBondContact O-N 3.22Å
227	F	95.1	Very high	91.1	Very high	3 Å²	3	32.3 Å²	32.3	1%	0.013	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	120.3	179.9	-176.4	-108.6	0	0	0	110.7	E159 T161 A216 K217 S220 V225 Y229 L261 F263	E159-F227 PolarHBondContact N-O 3.32Å; E159-F227 VanDerWaalsContact N-O 3.12Å; E159-F227 WeakPolarHBondContact O-CB 3.34Å; E159-F227 PolarHBondContact O-N 3.12Å; T161-F227 HydrophobicContact CG2-CB 3.67Å; T161-F227 HydrophobicContact CG2-CD1 3.9Å; T161-F227 HydrophobicContact CG2-CG 3.85Å; A216-F227 HydrophobicContact CB-CE2 4.07Å; A216-F227 HydrophobicContact CB-CZ 4.43Å; K217-F227 HydrophobicContact CG-CD1 4.32Å; K217-F227 HydrophobicContact CG-CE1 3.74Å; K217-F227 HydrophobicContact CG-CE2 4.28Å; K217-F227 HydrophobicContact CG-CZ 3.73Å; S220-F227 WeakPolarHBondContact OG-CD2 3.47Å; V225-F227 PolarHBondContact O-N 3.26Å; F227-Y229 HydrophobicContact CE1-CD2 4.19Å; F227-Y229 HydrophobicContact CE1-CG 4.41Å; F227-Y229 HydrophobicContact CZ-CD2 4.34Å; F227-L261 HydrophobicContact CD2-CD2 4.17Å; F227-L261 HydrophobicContact CE2-CD2 4.4Å; F227-F263 HydrophobicContact CE2-CB 3.54Å; F227-F263 HydrophobicContact CE2-CG 4.25Å; F227-F263 HydrophobicContact CZ-CB 3.61Å; F227-F263 HydrophobicContact CZ-CD1 4.19Å; F227-F263 HydrophobicContact CZ-CG 4.06Å
228	L	95.1	Very high	90.2	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	109.7	174.2	-69.7	174.5	0	0	0	109.5	A158 L250 T253 A254 L261 V262 F263	A158-L228 HydrophobicContact CB-CD2 3.75Å; A158-L228 HydrophobicContact CB-CG 4.41Å; L228-L250 HydrophobicContact CB-CD1 4.48Å; L228-T253 HydrophobicContact CD1-CG2 4.26Å; L228-T253 HydrophobicContact CD2-CG2 3.88Å; L228-A254 VanDerWaalsContact CD1-CA 3.47Å; L228-A254 HydrophobicContact CD1-CB 3.75Å; L228-L261 PolarHBondContact N-O 3.28Å; L228-V262 HydrophobicContact CB-CG2 4.3Å; L228-V262 HydrophobicContact CD1-CG2 4.1Å; L228-F263 PolarHBondContact O-N 3.03Å
229	Y	94.6	Very high	89.3	Confident	78 Å²	78	40.5 Å²	40.5	31%	0.306	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	132.8	178	178.2	-96	0	0	0	111.3	T213 F227 F263 D265	T213-Y229 HydrophobicContact CG2-CE2 4.01Å; F227-Y229 HydrophobicContact CE1-CD2 4.19Å; F227-Y229 HydrophobicContact CE1-CG 4.41Å; F227-Y229 HydrophobicContact CZ-CD2 4.34Å; Y229-F263 AromaticContact CD2-CD1 3.65Å; Y229-F263 HydrophobicContact CD2-CD1 3.65Å; Y229-F263 HydrophobicContact CD2-CE1 4.23Å; Y229-F263 AromaticContact CE2-CD1 3.8Å; Y229-F263 HydrophobicContact CE2-CD1 3.8Å; Y229-F263 AromaticContact CE2-CE1 3.92Å; Y229-F263 HydrophobicContact CE2-CE1 3.92Å; Y229-D265 HydrophobicContact CE2-CB 4.26Å
230	A	93.2	Very high	88.3	Confident	1 Å²	1	45 Å²	45	1%	0.008	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	143.3	165.8	0	0	0	0	0	110.5	F235 L250 F263 I264 D265	A230-F235 HydrophobicContact CB-CE2 3.96Å; A230-F235 HydrophobicContact CB-CZ 3.64Å; A230-L250 HydrophobicContact CB-CD1 4.35Å; A230-L250 HydrophobicContact CB-CD2 4.17Å; A230-F263 PolarHBondContact N-O 3.15Å; A230-I264 CarbonylContact O-C 3.53Å; A230-I264 VanDerWaalsContact O-CA 3.3Å; A230-I264 WeakPolarHBondContact O-CA 3.4Å; A230-D265 PolarHBondContact O-N 3.2Å
231	S	91.7	Very high	87.7	Confident	23 Å²	23	46 Å²	46	16%	0.161	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	138	168.5	175.1	0	0	0	0	109.4	S233 S234	S231-S233 PolarHBondContact O-N 2.87Å; S231-S233 PolarHBondContact OG-OG 3.26Å; S231-S234 VanDerWaalsContact O-CB 3.25Å; S231-S234 WeakPolarHBondContact O-CB 3.5Å; S231-S234 PolarHBondContact O-N 3.19Å; S231-S234 PolarHBondContact O-OG 3.16Å
232	G	86.3	Confident	87.3	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-57.5	-37.1	177.8	0	0	0	0	0	112.3	S234 F235 D265 S269	G232-S234 PolarHBondContact O-N 3.43Å; G232-S234 VanDerWaalsContact O-N 3.14Å; G232-F235 WeakPolarHBondContact O-CB 3.42Å; G232-F235 PolarHBondContact O-N 3.08Å; G232-D265 WeakPolarHBondContact CA-O 3.26Å; G232-D265 PolarHBondContact N-O 3.24Å; G232-S269 WeakPolarHBondContact CA-OG 3.27Å; G232-S269 PolarHBondContact O-OG 3.39Å
233	S	86	Confident	86.9	Confident	65 Å²	65	45.7 Å²	45.7	46%	0.455	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-57.3	-27.8	174.5	65.7	0	0	0	0	113.1	S231 F235 D236 S269	S231-S233 PolarHBondContact O-N 2.87Å; S231-S233 PolarHBondContact OG-OG 3.26Å; S233-F235 PolarHBondContact O-N 2.79Å; S233-D236 PolarHBondContact O-N 3.35Å; S233-S269 PolarHBondContact N-OG 3.14Å
234	S	86	Confident	86.6	Confident	27 Å²	27	45.5 Å²	45.5	19%	0.189	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-70.5	-9.8	176.5	77.8	0	0	0	0	113.5	S231 G232 R246	S231-S234 VanDerWaalsContact O-CB 3.25Å; S231-S234 WeakPolarHBondContact O-CB 3.5Å; S231-S234 PolarHBondContact O-N 3.19Å; S231-S234 PolarHBondContact O-OG 3.16Å; G232-S234 PolarHBondContact O-N 3.43Å; G232-S234 VanDerWaalsContact O-N 3.14Å; S234-R246 WeakPolarHBondContact O-CD 3.25Å; S234-R246 PolarHBondContact O-NH1 2.72Å
235	F	85.8	Confident	86.5	Confident	4 Å²	4	40.3 Å²	40.3	2%	0.018	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-104.7	-11.1	176.7	-56.2	-55.2	0	0	0	112.6	I154 A230 G232 S233 E237 G243 R246 I247 L250 I264 V270 T286	I154-F235 HydrophobicContact CG2-CE1 3.84Å; I154-F235 HydrophobicContact CG2-CZ 4.36Å; A230-F235 HydrophobicContact CB-CE2 3.96Å; A230-F235 HydrophobicContact CB-CZ 3.64Å; G232-F235 WeakPolarHBondContact O-CB 3.42Å; G232-F235 PolarHBondContact O-N 3.08Å; S233-F235 PolarHBondContact O-N 2.79Å; F235-E237 PolarHBondContact O-N 3.16Å; F235-G243 WeakPolarHBondContact O-CA 3.37Å; F235-R246 HydrophobicContact CD1-CB 3.72Å; F235-R246 HydrophobicContact CE1-CB 3.9Å; F235-I247 HydrophobicContact CD1-CG1 3.89Å; F235-I247 HydrophobicContact CE1-CG1 4.1Å; F235-I247 HydrophobicContact CG-CG1 4.2Å; F235-L250 HydrophobicContact CZ-CD2 3.96Å; F235-I264 HydrophobicContact CE2-CG2 4.23Å; F235-V270 HydrophobicContact CB-CG1 3.4Å; F235-V270 VanDerWaalsContact CB-CG1 3.4Å; F235-V270 HydrophobicContact CD2-CG1 4.45Å; F235-V270 HydrophobicContact CG-CG1 4.42Å; F235-T286 HydrophobicContact CB-CG2 3.99Å
236	D	81.2	Confident	86.3	Confident	77 Å²	77	41.3 Å²	41.3	41%	0.412	24%	0.238	S	C	.	.			trans	-84.5	87.1	175.3	-170.6	25.2	0	0	0	109.9	S233 H280	S233-D236 PolarHBondContact O-N 3.35Å; D236-H280 IonicContact OD1-CE1 3.96Å
237	E	77.7	Confident	86.1	Confident	64 Å²	64	40 Å²	40	30%	0.299	23%	0.23	S	C	.	.			trans	-116.3	139.9	-176.1	-75.5	-72.1	179	0	0	111.2	F235 L239 L242 R246	F235-E237 PolarHBondContact O-N 3.16Å; E237-L239 PolarHBondContact O-N 3.48Å; E237-L242 HydrophobicContact CB-CB 4.13Å; E237-L242 HydrophobicContact CG-CB 4.39Å; E237-R246 IonicContact OE1-CZ 2.93Å; E237-R246 IonicContact OE1-NH1 3.12Å; E237-R246 PolarHBondContact OE1-NH1 2.86Å; E237-R246 IonicContact OE1-NH2 2.96Å; E237-R246 PolarHBondContact OE1-NH2 2.91Å
238	V	74.8	Confident	86	Confident	130 Å²	130	45.4 Å²	45.4	79%	0.788	25%	0.25	S	C	*	.	S	Bend	trans	-66.9	-29.3	179.8	-177	0	0	0	0	111.6
239	L	75.5	Confident	85.8	Confident	116 Å²	116	49 Å²	49	61%	0.607	27%	0.267	S	S	*	.	S	Bend	trans	-84.1	127.4	-178	-66	172.6	0	0	0	111.5	E237 G241 L242	E237-L239 PolarHBondContact O-N 3.48Å; L239-G241 PolarHBondContact O-N 2.97Å; L239-L242 HydrophobicContact CB-CD1 3.6Å; L239-L242 HydrophobicContact CB-CG 3.84Å; L239-L242 HydrophobicContact CD1-CD1 3.63Å; L239-L242 HydrophobicContact CG-CD1 4.2Å; L239-L242 PolarHBondContact O-N 3.35Å
240	V	75.9	Confident	85.7	Confident	93 Å²	93	45.7 Å²	45.7	56%	0.564	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	128.9	-177.5	-168.7	0	0	0	0	111.5	L242 F282	V240-L242 PolarHBondContact O-N 3.26Å; V240-F282 HydrophobicContact CB-CD1 4.22Å; V240-F282 HydrophobicContact CB-CE1 4.26Å; V240-F282 HydrophobicContact CG1-CD1 4Å; V240-F282 HydrophobicContact CG1-CE1 4.22Å; V240-F282 HydrophobicContact CG2-CD1 3.61Å; V240-F282 HydrophobicContact CG2-CE1 3.22Å; V240-F282 HydrophobicContact CG2-CE2 4.47Å; V240-F282 HydrophobicContact CG2-CG 4.39Å; V240-F282 HydrophobicContact CG2-CZ 3.71Å
241	G	81	Confident	85.6	Confident	23 Å²	23	45.7 Å²	45.7	24%	0.237	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.3	-8.3	173.7	0	0	0	0	0	115.6	L239 S245	L239-G241 PolarHBondContact O-N 2.97Å; G241-S245 WeakPolarHBondContact O-CB 3.33Å; G241-S245 PolarHBondContact O-N 3.27Å
242	L	85.3	Confident	85.6	Confident	52 Å²	52	48 Å²	48	27%	0.272	27%	0.268	S	S	.	.	H	α-helix	trans	-63.3	-53.2	173.3	-72.8	-168.9	0	0	0	110.7	E237 L239 V240 A244 S245 R246	E237-L242 HydrophobicContact CB-CB 4.13Å; E237-L242 HydrophobicContact CG-CB 4.39Å; L239-L242 HydrophobicContact CB-CD1 3.6Å; L239-L242 HydrophobicContact CB-CG 3.84Å; L239-L242 HydrophobicContact CD1-CD1 3.63Å; L239-L242 HydrophobicContact CG-CD1 4.2Å; L239-L242 PolarHBondContact O-N 3.35Å; V240-L242 PolarHBondContact O-N 3.26Å; L242-A244 VanDerWaalsContact C-N 3.28Å; L242-A244 PolarHBondContact O-N 3.16Å; L242-S245 WeakPolarHBondContact O-CA 3.43Å; L242-S245 WeakPolarHBondContact O-CB 3.44Å; L242-S245 PolarHBondContact O-N 2.9Å; L242-R246 VanDerWaalsContact O-CG 3.31Å; L242-R246 WeakPolarHBondContact O-CG 3.3Å; L242-R246 PolarHBondContact O-N 2.86Å
243	G	86.5	Confident	85.9	Confident	2 Å²	2	50.4 Å²	50.4	2%	0.021	28%	0.282	C	S	.	.	H	α-helix	trans	-52.6	-44.3	177.1	0	0	0	0	0	113.1	F235 S245 R246 I247	F235-G243 WeakPolarHBondContact O-CA 3.37Å; G243-S245 PolarHBondContact O-N 2.94Å; G243-R246 PolarHBondContact O-N 2.96Å; G243-I247 WeakPolarHBondContact O-CG1 3.25Å; G243-I247 PolarHBondContact O-N 2.94Å
244	A	87.5	Confident	86.2	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.008	26%	0.26	C	S	.	.	H	α-helix	trans	-63.6	-39.9	174.5	0	0	0	0	0	113.1	L242 R246 I247 R248 Q285 Q289	L242-A244 VanDerWaalsContact C-N 3.28Å; L242-A244 PolarHBondContact O-N 3.16Å; A244-R246 VanDerWaalsContact C-N 3.35Å; A244-I247 PolarHBondContact O-N 3.41Å; A244-R248 WeakPolarHBondContact O-CG 3.4Å; A244-R248 PolarHBondContact O-N 3.3Å; A244-R248 VanDerWaalsContact O-N 3.14Å; A244-Q285 HydrophobicContact CB-CG 4.45Å; A244-Q289 HydrophobicContact CB-CB 3.82Å; A244-Q289 HydrophobicContact CB-CG 3.95Å; A244-Q289 WeakPolarHBondContact O-CG 3.43Å
245	S	89.7	Confident	86.4	Confident	48 Å²	48	50.1 Å²	50.1	34%	0.336	27%	0.269	S	S	.	.	H	α-helix	trans	-63.4	-41.3	174.9	-170.3	0	0	0	0	111.8	G241 L242 G243 R248 Q249	G241-S245 WeakPolarHBondContact O-CB 3.33Å; G241-S245 PolarHBondContact O-N 3.27Å; L242-S245 WeakPolarHBondContact O-CA 3.43Å; L242-S245 WeakPolarHBondContact O-CB 3.44Å; L242-S245 PolarHBondContact O-N 2.9Å; G243-S245 PolarHBondContact O-N 2.94Å; S245-R248 WeakPolarHBondContact O-CB 3.18Å; S245-R248 PolarHBondContact O-N 2.79Å; S245-Q249 WeakPolarHBondContact O-CG 3.47Å; S245-Q249 PolarHBondContact O-N 3.49Å
246	R	88.7	Confident	86.6	Confident	31 Å²	31	56.8 Å²	56.8	12%	0.117	30%	0.3	C	S	.	.	H	α-helix	trans	-62.9	-41.9	178.2	-63.3	-166.8	160.8	165.6	11.6	112	I154 S234 F235 E237 L242 G243 A244 Q249 L250	I154-R246 HydrophobicContact CD1-CB 3.74Å; I154-R246 VanDerWaalsContact CD1-CD 3.47Å; I154-R246 HydrophobicContact CD1-CG 3.29Å; I154-R246 HydrophobicContact CG1-CB 4.34Å; I154-R246 HydrophobicContact CG1-CG 3.96Å; I154-R246 HydrophobicContact CG2-CB 4.45Å; S234-R246 WeakPolarHBondContact O-CD 3.25Å; S234-R246 PolarHBondContact O-NH1 2.72Å; F235-R246 HydrophobicContact CD1-CB 3.72Å; F235-R246 HydrophobicContact CE1-CB 3.9Å; E237-R246 IonicContact OE1-CZ 2.93Å; E237-R246 IonicContact OE1-NH1 3.12Å; E237-R246 PolarHBondContact OE1-NH1 2.86Å; E237-R246 IonicContact OE1-NH2 2.96Å; E237-R246 PolarHBondContact OE1-NH2 2.91Å; L242-R246 VanDerWaalsContact O-CG 3.31Å; L242-R246 WeakPolarHBondContact O-CG 3.3Å; L242-R246 PolarHBondContact O-N 2.86Å; G243-R246 PolarHBondContact O-N 2.96Å; A244-R246 VanDerWaalsContact C-N 3.35Å; R246-Q249 WeakPolarHBondContact O-CB 3.43Å; R246-Q249 PolarHBondContact O-N 3.05Å; R246-L250 PolarHBondContact O-N 2.82Å
247	I	91.5	Very high	87.1	Confident	2 Å²	2	55.8 Å²	55.8	1%	0.01	30%	0.295	C	S	.	.	H	α-helix	trans	-60.2	-46.4	173.6	-70.6	166.5	0	0	0	110.8	F235 G243 A244 Q249 L250 F251 T286 Q289 L290 E293	F235-I247 HydrophobicContact CD1-CG1 3.89Å; F235-I247 HydrophobicContact CE1-CG1 4.1Å; F235-I247 HydrophobicContact CG-CG1 4.2Å; G243-I247 WeakPolarHBondContact O-CG1 3.25Å; G243-I247 PolarHBondContact O-N 2.94Å; A244-I247 PolarHBondContact O-N 3.41Å; I247-Q249 VanDerWaalsContact C-N 3.28Å; I247-Q249 PolarHBondContact O-N 2.95Å; I247-L250 WeakPolarHBondContact O-CB 3.2Å; I247-L250 PolarHBondContact O-N 3.33Å; I247-F251 HydrophobicContact CG2-CD2 3.95Å; I247-F251 HydrophobicContact CG2-CE2 4.1Å; I247-F251 WeakPolarHBondContact O-CD2 3.4Å; I247-F251 PolarHBondContact O-N 2.83Å; I247-T286 HydrophobicContact CD1-CG2 3.39Å; I247-T286 VanDerWaalsContact CD1-O 3.27Å; I247-T286 WeakPolarHBondContact CD1-O 3.46Å; I247-Q289 HydrophobicContact CB-CG 4.27Å; I247-Q289 HydrophobicContact CG2-CG 4.07Å; I247-L290 HydrophobicContact CD1-CB 4.02Å; I247-L290 HydrophobicContact CG2-CB 4.49Å; I247-L290 HydrophobicContact CG2-CD1 4.37Å; I247-E293 HydrophobicContact CG2-CB 4.45Å; I247-E293 HydrophobicContact CG2-CG 3.85Å
248	R	91.6	Very high	87.6	Confident	116 Å²	116	55.4 Å²	55.4	44%	0.438	30%	0.299	S	S	.	.	H	α-helix	trans	-58.8	-42	176.7	-71	175.1	-170.8	145.2	3.5	112	A244 S245 T252 Q289 E293	A244-R248 WeakPolarHBondContact O-CG 3.4Å; A244-R248 PolarHBondContact O-N 3.3Å; A244-R248 VanDerWaalsContact O-N 3.14Å; S245-R248 WeakPolarHBondContact O-CB 3.18Å; S245-R248 PolarHBondContact O-N 2.79Å; R248-T252 WeakPolarHBondContact O-CB 3.29Å; R248-T252 PolarHBondContact O-N 2.69Å; R248-T252 PolarHBondContact O-OG1 3.34Å; R248-Q289 HydrophobicContact CG-CG 4.15Å; R248-Q289 VanDerWaalsContact CG-NE2 3.33Å; R248-E293 WeakPolarHBondContact CG-OE1 3.49Å
249	Q	91.5	Very high	88.3	Confident	77 Å²	77	52 Å²	52	36%	0.36	28%	0.28	S	S	.	.	H	α-helix	trans	-62.9	-46.5	177.2	-72.6	170.8	-22.7	0	0	111.1	S245 R246 I247 F251 T252 T253	S245-Q249 WeakPolarHBondContact O-CG 3.47Å; S245-Q249 PolarHBondContact O-N 3.49Å; R246-Q249 WeakPolarHBondContact O-CB 3.43Å; R246-Q249 PolarHBondContact O-N 3.05Å; I247-Q249 VanDerWaalsContact C-N 3.28Å; I247-Q249 PolarHBondContact O-N 2.95Å; Q249-F251 PolarHBondContact O-N 3.44Å; Q249-T252 PolarHBondContact O-N 2.95Å; Q249-T253 PolarHBondContact O-N 3.44Å; Q249-T253 PolarHBondContact O-OG1 3.26Å; Q249-T253 VanDerWaalsContact O-OG1 3.09Å
250	L	92.4	Very high	89.2	Confident	7 Å²	7	46.4 Å²	46.4	4%	0.037	25%	0.251	C	S	.	.	H	α-helix	trans	-54.6	-50.5	176.6	178.8	67.7	0	0	0	111.8	L228 A230 F235 R246 I247 T252 T253 A254 V262 I264	L228-L250 HydrophobicContact CB-CD1 4.48Å; A230-L250 HydrophobicContact CB-CD1 4.35Å; A230-L250 HydrophobicContact CB-CD2 4.17Å; F235-L250 HydrophobicContact CZ-CD2 3.96Å; R246-L250 PolarHBondContact O-N 2.82Å; I247-L250 WeakPolarHBondContact O-CB 3.2Å; I247-L250 PolarHBondContact O-N 3.33Å; L250-T252 VanDerWaalsContact C-N 3.35Å; L250-T252 PolarHBondContact O-N 2.96Å; L250-T253 PolarHBondContact O-N 2.78Å; L250-A254 PolarHBondContact O-N 3.2Å; L250-V262 HydrophobicContact CD1-CG1 4.24Å; L250-V262 HydrophobicContact CD2-CG1 3.83Å; L250-V262 HydrophobicContact CG-CG1 4.14Å; L250-I264 HydrophobicContact CD2-CD1 4.29Å; L250-I264 HydrophobicContact CD2-CG1 4.37Å
251	F	92	Very high	90.1	Very high	1 Å²	1	42 Å²	42	0%	0.004	22%	0.224	C	C	.	.	H	α-helix	trans	-70.5	-29.8	179.8	-82.3	-86.8	0	0	0	113.2	I247 Q249 A254 K255 L290 E293 M294 F297 V305	I247-F251 HydrophobicContact CG2-CD2 3.95Å; I247-F251 HydrophobicContact CG2-CE2 4.1Å; I247-F251 WeakPolarHBondContact O-CD2 3.4Å; I247-F251 PolarHBondContact O-N 2.83Å; Q249-F251 PolarHBondContact O-N 3.44Å; F251-A254 PolarHBondContact O-N 3.28Å; F251-K255 VanDerWaalsContact O-CG 3.32Å; F251-K255 WeakPolarHBondContact O-CG 3.35Å; F251-K255 PolarHBondContact O-N 3.02Å; F251-L290 HydrophobicContact CE2-CD1 3.77Å; F251-L290 HydrophobicContact CZ-CD1 4.15Å; F251-E293 HydrophobicContact CB-CB 4.26Å; F251-E293 HydrophobicContact CB-CG 4.17Å; F251-E293 HydrophobicContact CD1-CB 4Å; F251-E293 HydrophobicContact CD2-CB 3.47Å; F251-E293 VanDerWaalsContact CD2-CB 3.47Å; F251-E293 HydrophobicContact CD2-CG 3.74Å; F251-E293 HydrophobicContact CE1-CB 4.2Å; F251-E293 HydrophobicContact CE2-CB 3.71Å; F251-E293 HydrophobicContact CE2-CG 4.35Å; F251-E293 HydrophobicContact CG-CB 3.63Å; F251-E293 HydrophobicContact CG-CG 3.99Å; F251-E293 HydrophobicContact CZ-CB 4.06Å; F251-M294 HydrophobicContact CE1-SD 4.13Å; F251-M294 HydrophobicContact CZ-CG 4.27Å; F251-M294 HydrophobicContact CZ-SD 3.74Å; F251-F297 HydrophobicContact CD1-CD1 4.13Å; F251-F297 HydrophobicContact CD1-CE1 4.41Å; F251-F297 AromaticContact CE1-CD1 3.84Å; F251-F297 HydrophobicContact CE1-CD1 3.84Å; F251-F297 AromaticContact CE1-CE1 3.68Å; F251-F297 HydrophobicContact CE1-CE1 3.68Å; F251-V305 HydrophobicContact CE1-CG2 4.04Å; F251-V305 HydrophobicContact CZ-CG2 4.14Å
252	T	91.5	Very high	90.7	Very high	73 Å²	73	41 Å²	41	45%	0.448	21%	0.213	S	C	.	.	H	α-helix	trans	-65	-45.1	172.3	-58.5	0	0	0	0	110.6	R248 Q249 L250 A254 K255 Q256	R248-T252 WeakPolarHBondContact O-CB 3.29Å; R248-T252 PolarHBondContact O-N 2.69Å; R248-T252 PolarHBondContact O-OG1 3.34Å; Q249-T252 PolarHBondContact O-N 2.95Å; L250-T252 VanDerWaalsContact C-N 3.35Å; L250-T252 PolarHBondContact O-N 2.96Å; T252-A254 VanDerWaalsContact C-N 3.35Å; T252-K255 PolarHBondContact O-N 3.28Å; T252-Q256 WeakPolarHBondContact O-CG 3.37Å; T252-Q256 PolarHBondContact O-N 2.86Å; T252-Q256 VanDerWaalsContact O-N 3.11Å
253	T	91.5	Very high	91.3	Very high	49 Å²	49	38.5 Å²	38.5	30%	0.301	20%	0.2	S	C	.	.	H	α-helix	trans	-63.8	-39.7	174.9	-56.6	0	0	0	0	111.5	L228 Q249 L250 K255 Q256 N257	L228-T253 HydrophobicContact CD1-CG2 4.26Å; L228-T253 HydrophobicContact CD2-CG2 3.88Å; Q249-T253 PolarHBondContact O-N 3.44Å; Q249-T253 PolarHBondContact O-OG1 3.26Å; Q249-T253 VanDerWaalsContact O-OG1 3.09Å; L250-T253 PolarHBondContact O-N 2.78Å; T253-K255 PolarHBondContact O-N 2.95Å; T253-Q256 PolarHBondContact O-N 3.14Å; T253-N257 PolarHBondContact O-N 3.2Å; T253-N257 VanDerWaalsContact O-N 3.11Å; T253-N257 PolarHBondContact O-ND2 2.96Å
254	A	92	Very high	91.7	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-61.3	-43.6	175.7	0	0	0	0	0	112.3	L228 L250 F251 T252 Q256 N257 S258 C260 V262 I303	L228-A254 VanDerWaalsContact CD1-CA 3.47Å; L228-A254 HydrophobicContact CD1-CB 3.75Å; L250-A254 PolarHBondContact O-N 3.2Å; F251-A254 PolarHBondContact O-N 3.28Å; T252-A254 VanDerWaalsContact C-N 3.35Å; A254-Q256 VanDerWaalsContact C-N 3.3Å; A254-Q256 PolarHBondContact O-N 2.96Å; A254-N257 CarbonylContact O-C 3.4Å; A254-N257 PolarHBondContact O-N 3.23Å; A254-S258 PolarHBondContact O-N 3.01Å; A254-S258 VanDerWaalsContact O-N 3.1Å; A254-C260 PolarHBondContact O-SG 2.96Å; A254-V262 HydrophobicContact CB-CG2 3.64Å; A254-I303 HydrophobicContact CB-CD1 4.22Å; A254-I303 HydrophobicContact CB-CG2 4.24Å
255	K	90.6	Very high	92	Very high	87 Å²	87	39.6 Å²	39.6	38%	0.378	21%	0.205	S	C	.	.	H	α-helix	trans	-63.4	-34.3	175.5	-73.7	172	179.2	170.7	0	112.9	F251 T252 T253 I303	F251-K255 VanDerWaalsContact O-CG 3.32Å; F251-K255 WeakPolarHBondContact O-CG 3.35Å; F251-K255 PolarHBondContact O-N 3.02Å; T252-K255 PolarHBondContact O-N 3.28Å; T253-K255 PolarHBondContact O-N 2.95Å; K255-I303 HydrophobicContact CG-CD1 3.83Å
256	Q	90.7	Very high	92.2	Very high	144 Å²	144	41.4 Å²	41.4	67%	0.673	21%	0.208	S	C	*	.	H	α-helix	trans	-72.6	-27.4	176.9	-71.6	172.8	-2.2	0	0	113.3	T252 T253 A254	T252-Q256 WeakPolarHBondContact O-CG 3.37Å; T252-Q256 PolarHBondContact O-N 2.86Å; T252-Q256 VanDerWaalsContact O-N 3.11Å; T253-Q256 PolarHBondContact O-N 3.14Å; A254-Q256 VanDerWaalsContact C-N 3.3Å; A254-Q256 PolarHBondContact O-N 2.96Å
257	N	90.3	Very high	92.3	Very high	56 Å²	56	39.9 Å²	39.9	30%	0.299	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.9	17.4	-177.5	-65	-79.1	0	0	0	112.9	A158 T253 A254 P259 C260	A158-N257 HydrophobicContact CB-CB 4.28Å; T253-N257 PolarHBondContact O-N 3.2Å; T253-N257 VanDerWaalsContact O-N 3.11Å; T253-N257 PolarHBondContact O-ND2 2.96Å; A254-N257 CarbonylContact O-C 3.4Å; A254-N257 PolarHBondContact O-N 3.23Å; N257-P259 CarbonylContact O-C 3.38Å; N257-C260 HydrophobicContact CB-CB 4.48Å; N257-C260 WeakPolarHBondContact O-CB 3.46Å
258	S	88.6	Confident	92.2	Very high	55 Å²	55	41.2 Å²	41.2	39%	0.385	21%	0.21	S	C	.	.			trans	-62.7	139.6	178.5	157.3	0	0	0	0	111.9	A254 E301	A254-S258 PolarHBondContact O-N 3.01Å; A254-S258 VanDerWaalsContact O-N 3.1Å; S258-E301 WeakPolarHBondContact CB-O 3.37Å; S258-E301 PolarHBondContact OG-O 3.37Å
259	P	90.7	Very high	91.8	Very high	58 Å²	58	37.8 Å²	37.8	38%	0.377	20%	0.204	S	C	.	.	S	Bend	cis	-73.6	137	-5.1	30.6	-34.4	0	0	0	111.7	V225 P226 N257 G302	V225-P259 HydrophobicContact CG1-CG 4.42Å; P226-P259 VanDerWaalsContact CD-O 3.27Å; P226-P259 WeakPolarHBondContact CD-O 3.34Å; N257-P259 CarbonylContact O-C 3.38Å; P259-G302 WeakPolarHBondContact CA-O 3.44Å; P259-G302 WeakPolarHBondContact CB-O 3.33Å
260	C	93	Very high	91.2	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	164.2	-179.8	64.8	0	0	0	0	113	P226 A254 N257 G302 I304	P226-C260 HydrophobicContact CB-CB 4.3Å; P226-C260 WeakPolarHBondContact O-CB 3.35Å; A254-C260 PolarHBondContact O-SG 2.96Å; N257-C260 HydrophobicContact CB-CB 4.48Å; N257-C260 WeakPolarHBondContact O-CB 3.46Å; C260-G302 PolarHBondContact N-O 2.94Å; C260-I304 PolarHBondContact O-N 3.01Å
261	L	94.9	Very high	90.2	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	120.7	174.3	-170.7	63.3	0	0	0	110	L185 A216 V219 V225 P226 F227 L228 I304 L306	L185-L261 HydrophobicContact CD1-CD1 3.99Å; A216-L261 WeakPolarHBondContact O-CD2 3.47Å; V219-L261 HydrophobicContact CB-CD2 4.01Å; V219-L261 HydrophobicContact CG1-CD2 3.86Å; V225-L261 HydrophobicContact CG2-CB 4.14Å; P226-L261 PolarHBondContact O-N 3.22Å; F227-L261 HydrophobicContact CD2-CD2 4.17Å; F227-L261 HydrophobicContact CE2-CD2 4.4Å; L228-L261 PolarHBondContact N-O 3.28Å; L261-I304 HydrophobicContact CD1-CB 4.14Å; L261-I304 HydrophobicContact CD1-CG2 4.31Å; L261-L306 HydrophobicContact CD1-CD1 3.86Å; L261-L306 HydrophobicContact CD1-CD2 4.46Å; L261-L306 HydrophobicContact CD1-CG 3.67Å; L261-L306 HydrophobicContact CD2-CD1 3.82Å; L261-L306 HydrophobicContact CD2-CG 4.5Å; L261-L306 HydrophobicContact CG-CD1 4.16Å; L261-L306 HydrophobicContact CG-CG 4.31Å
262	V	95	Very high	89.2	Confident	1 Å²	1	35 Å²	35	1%	0.006	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	119.7	174	179.8	0	0	0	0	108.6	L228 L250 A254 I264 I303 I304 V305 L306	L228-V262 HydrophobicContact CB-CG2 4.3Å; L228-V262 HydrophobicContact CD1-CG2 4.1Å; L250-V262 HydrophobicContact CD1-CG1 4.24Å; L250-V262 HydrophobicContact CD2-CG1 3.83Å; L250-V262 HydrophobicContact CG-CG1 4.14Å; A254-V262 HydrophobicContact CB-CG2 3.64Å; V262-I264 HydrophobicContact CG1-CG1 4.28Å; V262-I303 HydrophobicContact CG2-CG2 4.11Å; V262-I304 PolarHBondContact N-O 2.94Å; V262-V305 HydrophobicContact CB-CG1 4.46Å; V262-V305 HydrophobicContact CB-CG2 4.24Å; V262-V305 HydrophobicContact CG1-CG1 4.37Å; V262-V305 CarbonylContact O-C 3.58Å; V262-V305 WeakPolarHBondContact O-CA 3.49Å; V262-L306 PolarHBondContact O-N 3.09Å
263	F	96.4	Very high	87.8	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	123.8	175.3	-178.7	-101.8	0	0	0	111.1	L204 T213 A216 F227 L228 Y229 A230 D265 L306 A308	L204-F263 HydrophobicContact CD1-CE2 4.39Å; T213-F263 HydrophobicContact CG2-CD1 4.46Å; T213-F263 HydrophobicContact CG2-CE1 3.8Å; T213-F263 HydrophobicContact CG2-CZ 4.39Å; A216-F263 HydrophobicContact CB-CB 4.31Å; A216-F263 HydrophobicContact CB-CD1 4.5Å; A216-F263 HydrophobicContact CB-CD2 3.19Å; A216-F263 HydrophobicContact CB-CE2 3.5Å; A216-F263 VanDerWaalsContact CB-CE2 3.5Å; A216-F263 HydrophobicContact CB-CG 3.76Å; A216-F263 HydrophobicContact CB-CZ 4.26Å; F227-F263 HydrophobicContact CE2-CB 3.54Å; F227-F263 HydrophobicContact CE2-CG 4.25Å; F227-F263 HydrophobicContact CZ-CB 3.61Å; F227-F263 HydrophobicContact CZ-CD1 4.19Å; F227-F263 HydrophobicContact CZ-CG 4.06Å; L228-F263 PolarHBondContact O-N 3.03Å; Y229-F263 AromaticContact CD2-CD1 3.65Å; Y229-F263 HydrophobicContact CD2-CD1 3.65Å; Y229-F263 HydrophobicContact CD2-CE1 4.23Å; Y229-F263 AromaticContact CE2-CD1 3.8Å; Y229-F263 HydrophobicContact CE2-CD1 3.8Å; Y229-F263 AromaticContact CE2-CE1 3.92Å; Y229-F263 HydrophobicContact CE2-CE1 3.92Å; A230-F263 PolarHBondContact N-O 3.15Å; F263-D265 HydrophobicContact CD1-CB 4.4Å; F263-D265 HydrophobicContact CE1-CB 3.63Å; F263-D265 HydrophobicContact CZ-CB 4.23Å; F263-L306 CarbonylContact C-O 3.6Å; F263-L306 VanDerWaalsContact CA-O 3.31Å; F263-L306 WeakPolarHBondContact CA-O 3.24Å; F263-L306 HydrophobicContact CD2-CB 3.76Å; F263-A308 HydrophobicContact CE2-CB 3.82Å; F263-A308 HydrophobicContact CZ-CB 3.62Å
264	I	94.9	Very high	86.1	Confident	2 Å²	2	39.7 Å²	39.7	1%	0.01	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	104.4	175.6	-56.5	175.6	0	0	0	108.3	A230 F235 L250 V262 I267 L290 V305 L306 G307 A308	A230-I264 CarbonylContact O-C 3.53Å; A230-I264 VanDerWaalsContact O-CA 3.3Å; A230-I264 WeakPolarHBondContact O-CA 3.4Å; F235-I264 HydrophobicContact CE2-CG2 4.23Å; L250-I264 HydrophobicContact CD2-CD1 4.29Å; L250-I264 HydrophobicContact CD2-CG1 4.37Å; V262-I264 HydrophobicContact CG1-CG1 4.28Å; I264-I267 HydrophobicContact CG2-CB 4.24Å; I264-I267 HydrophobicContact CG2-CG1 4.31Å; I264-L290 HydrophobicContact CD1-CD1 4.21Å; I264-V305 HydrophobicContact CD1-CG1 4.06Å; I264-V305 HydrophobicContact CG1-CG1 4.48Å; I264-L306 PolarHBondContact N-O 2.78Å; I264-G307 CarbonylContact O-C 3.55Å; I264-G307 WeakPolarHBondContact O-CA 3.09Å; I264-A308 PolarHBondContact O-N 3.02Å
265	D	94.5	Very high	84.3	Confident	24 Å²	24	44.1 Å²	44.1	13%	0.128	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	154.7	173.9	-143	-21	0	0	0	111.1	T213 Y229 A230 G232 F263 I267	T213-D265 PolarHBondContact OG1-OD2 3.14Å; Y229-D265 HydrophobicContact CE2-CB 4.26Å; A230-D265 PolarHBondContact O-N 3.2Å; G232-D265 WeakPolarHBondContact CA-O 3.26Å; G232-D265 PolarHBondContact N-O 3.24Å; F263-D265 HydrophobicContact CD1-CB 4.4Å; F263-D265 HydrophobicContact CE1-CB 3.63Å; F263-D265 HydrophobicContact CZ-CB 4.23Å; D265-I267 VanDerWaalsContact C-N 3.29Å; D265-I267 PolarHBondContact O-N 2.78Å
266	E	93	Very high	82.3	Confident	86 Å²	86	50.1 Å²	50.1	40%	0.402	26%	0.26	S	S	.	.			trans	46.3	47.8	177.1	-59.1	-176.1	155.3	0	0	114	D268 S269 A308	E266-D268 WeakPolarHBondContact CA-OD1 3.45Å; E266-D268 PolarHBondContact O-N 3.31Å; E266-D268 VanDerWaalsContact O-N 3.09Å; E266-S269 WeakPolarHBondContact O-CB 3.41Å; E266-S269 PolarHBondContact O-N 3.19Å; E266-S269 PolarHBondContact O-OG 3.03Å; E266-A308 WeakPolarHBondContact CA-O 3.34Å; E266-A308 PolarHBondContact N-O 2.94Å; E266-A308 VanDerWaalsContact N-O 3.07Å
267	I	91.4	Very high	80.6	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-20	-177.2	-167.1	169.5	0	0	0	112.9	L203 I264 D265 S269 V270 G271 L290 A308 L315 F325	L203-I267 HydrophobicContact CD1-CG2 3.85Å; I264-I267 HydrophobicContact CG2-CB 4.24Å; I264-I267 HydrophobicContact CG2-CG1 4.31Å; D265-I267 VanDerWaalsContact C-N 3.29Å; D265-I267 PolarHBondContact O-N 2.78Å; I267-S269 PolarHBondContact O-N 3.22Å; I267-V270 HydrophobicContact CG1-CG2 4.35Å; I267-V270 WeakPolarHBondContact O-CG2 3.31Å; I267-V270 PolarHBondContact O-N 3.41Å; I267-G271 WeakPolarHBondContact O-CA 3.35Å; I267-G271 PolarHBondContact O-N 3.03Å; I267-L290 HydrophobicContact CD1-CD2 4.17Å; I267-A308 PolarHBondContact N-O 2.65Å; I267-L315 HydrophobicContact CG2-CD1 4.08Å; I267-F325 HydrophobicContact CD1-CD2 4.23Å; I267-F325 HydrophobicContact CD1-CE1 4.43Å; I267-F325 HydrophobicContact CD1-CE2 3.24Å; I267-F325 HydrophobicContact CD1-CZ 3.36Å
268	D	88.9	Confident	79.1	Confident	30 Å²	30	48.2 Å²	48.2	16%	0.16	26%	0.264	C	S	.	.	H	α-helix	trans	-62.7	-24.7	173.6	54.5	-34.8	0	0	0	113.5	E266 V270 G272	E266-D268 WeakPolarHBondContact CA-OD1 3.45Å; E266-D268 PolarHBondContact O-N 3.31Å; E266-D268 VanDerWaalsContact O-N 3.09Å; D268-V270 PolarHBondContact O-N 3.33Å; D268-G272 PolarHBondContact O-N 2.86Å
269	S	84.3	Confident	77.5	Confident	44 Å²	44	53 Å²	53	31%	0.308	28%	0.28	S	S	.	.	H	α-helix	trans	-60.9	-42.1	174.2	58.9	0	0	0	0	113.1	G232 S233 E266 I267	G232-S269 WeakPolarHBondContact CA-OG 3.27Å; G232-S269 PolarHBondContact O-OG 3.39Å; S233-S269 PolarHBondContact N-OG 3.14Å; E266-S269 WeakPolarHBondContact O-CB 3.41Å; E266-S269 PolarHBondContact O-N 3.19Å; E266-S269 PolarHBondContact O-OG 3.03Å; I267-S269 PolarHBondContact O-N 3.22Å
270	V	79.6	Confident	76	Confident	6 Å²	6	54.6 Å²	54.6	4%	0.036	28%	0.282	C	S	.	.	H	α-helix	trans	-92.9	-30.3	173	-73.7	0	0	0	0	113.2	F235 I267 D268 T286 I287	F235-V270 HydrophobicContact CB-CG1 3.4Å; F235-V270 VanDerWaalsContact CB-CG1 3.4Å; F235-V270 HydrophobicContact CD2-CG1 4.45Å; F235-V270 HydrophobicContact CG-CG1 4.42Å; I267-V270 HydrophobicContact CG1-CG2 4.35Å; I267-V270 WeakPolarHBondContact O-CG2 3.31Å; I267-V270 PolarHBondContact O-N 3.41Å; D268-V270 PolarHBondContact O-N 3.33Å; V270-T286 HydrophobicContact CB-CG2 4.26Å; V270-T286 HydrophobicContact CG1-CG2 3.77Å; V270-I287 WeakPolarHBondContact O-CD1 3.35Å; V270-I287 WeakPolarHBondContact O-CG1 3.43Å
271	G	70.8	Confident	74.7	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-94	4.9	-169.4	0	0	0	0	0	114.7	I267 L315 D316	I267-G271 WeakPolarHBondContact O-CA 3.35Å; I267-G271 PolarHBondContact O-N 3.03Å; G271-L315 CarbonylContact O-C 3.59Å; G271-L315 WeakPolarHBondContact O-CA 3.49Å; G271-D316 PolarHBondContact O-N 2.92Å
272	G	70.3	Confident	73.3	Confident	20 Å²	20	61.1 Å²	61.1	21%	0.206	32%	0.317	C	S	.	.	B	Isolated β-bridge	trans	-54.7	153.7	179.9	0	0	0	0	0	113.5	D268 R274 V314	D268-G272 PolarHBondContact O-N 2.86Å; G272-R274 PolarHBondContact O-N 3.19Å; G272-V314 CarbonylContact C-O 3.58Å; G272-V314 WeakPolarHBondContact CA-O 3.37Å
273	N	62.7	Low	72	Confident	79 Å²	79	62.4 Å²	62.4	42%	0.422	33%	0.328	S	S	.	.			trans	-46.1	135.8	177.1	-82.9	-37.5	0	0	0	109.3	T275 V314	N273-T275 PolarHBondContact O-N 3.11Å; N273-V314 VanDerWaalsContact CG-O 3.28Å; N273-V314 PolarHBondContact N-O 3.49Å; N273-V314 PolarHBondContact ND2-O 3.09Å
274	R	55.5	Low	71	Confident	142 Å²	142	64.7 Å²	64.7	54%	0.536	34%	0.34	S	S	.	.			trans	-56.8	82.7	176.3	-60.1	-177.9	-171.7	-170.7	-7.7	109.8	G272 F276 D316	G272-R274 PolarHBondContact O-N 3.19Å; R274-F276 PolarHBondContact O-N 3.49Å; R274-D316 IonicContact CZ-OD2 3.81Å; R274-D316 IonicContact NE-OD2 3.22Å; R274-D316 PolarHBondContact NE-OD2 3.14Å; R274-D316 VanDerWaalsContact NE-OD2 3.08Å; R274-D316 IonicContact NH2-OD2 2.64Å
275	T	54.1	Low	70.5	Confident	93 Å²	93	68.4 Å²	68.4	57%	0.571	36%	0.358	S	S	*	.			trans	-71.5	120.4	168.9	54.7	0	0	0	0	104.3	N273 S277	N273-T275 PolarHBondContact O-N 3.11Å; T275-S277 PolarHBondContact O-N 2.86Å
276	F	48.2	Very low	70.1	Confident	213 Å²	213	67.8 Å²	67.8	93%	0.934	36%	0.355	S	S	*	.			trans	-66.2	30.4	166.2	-114.3	-88.4	0	0	0	110.6	R274 P278	R274-F276 PolarHBondContact O-N 3.49Å; F276-P278 VanDerWaalsContact O-CD 3.32Å; F276-P278 WeakPolarHBondContact O-CD 3.4Å
277	S	56.1	Low	69.8	Low	44 Å²	44	63.9 Å²	63.9	31%	0.308	34%	0.336	S	S	.	.			trans	-69	119.7	175.8	-176	0	0	0	0	106.8	T275 H279 H280	T275-S277 PolarHBondContact O-N 2.86Å; S277-H279 PolarHBondContact O-N 3.41Å; S277-H280 PolarHBondContact O-N 2.99Å; S277-H280 VanDerWaalsContact O-N 3.14Å
278	P	57	Low	69.6	Low	116 Å²	116	67.9 Å²	67.9	75%	0.753	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-10.9	176.6	22.9	-31.4	0	0	0	112.8	F276	F276-P278 VanDerWaalsContact O-CD 3.32Å; F276-P278 WeakPolarHBondContact O-CD 3.4Å
279	H	56.9	Low	69.7	Low	155 Å²	155	67.7 Å²	67.7	72%	0.718	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-24	177.7	-63.7	-62.3	0	0	0	114.7	S277 P281	S277-H279 PolarHBondContact O-N 3.41Å; H279-P281 VanDerWaalsContact C-CD 3.48Å
280	H	59.1	Low	70.1	Confident	91 Å²	91	65.8 Å²	65.8	42%	0.421	34%	0.343	S	S	.	.			trans	-130	55.9	-180	-83.9	-91.6	0	0	0	113.9	D236 S277 F282	D236-H280 IonicContact OD1-CE1 3.96Å; S277-H280 PolarHBondContact O-N 2.99Å; S277-H280 VanDerWaalsContact O-N 3.14Å; H280-F282 PolarHBondContact O-N 3.12Å; H280-F282 VanDerWaalsContact O-N 3.15Å
281	P	63.9	Low	70.6	Confident	67 Å²	67	66 Å²	66	44%	0.435	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-22.2	172.2	26.7	-33.6	0	0	0	112.6	H279	H279-P281 VanDerWaalsContact C-CD 3.48Å
282	F	66.2	Low	71.6	Confident	71 Å²	71	68.4 Å²	68.4	31%	0.311	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-28.5	-172.2	-45.8	-56.5	0	0	0	114.4	V240 H280 N284 Q285 T286	V240-F282 HydrophobicContact CB-CD1 4.22Å; V240-F282 HydrophobicContact CB-CE1 4.26Å; V240-F282 HydrophobicContact CG1-CD1 4Å; V240-F282 HydrophobicContact CG1-CE1 4.22Å; V240-F282 HydrophobicContact CG2-CD1 3.61Å; V240-F282 HydrophobicContact CG2-CE1 3.22Å; V240-F282 HydrophobicContact CG2-CE2 4.47Å; V240-F282 HydrophobicContact CG2-CG 4.39Å; V240-F282 HydrophobicContact CG2-CZ 3.71Å; H280-F282 PolarHBondContact O-N 3.12Å; H280-F282 VanDerWaalsContact O-N 3.15Å; F282-N284 PolarHBondContact O-N 2.83Å; F282-Q285 WeakPolarHBondContact O-CB 3.32Å; F282-Q285 PolarHBondContact O-N 3.4Å; F282-T286 PolarHBondContact O-N 2.91Å
283	A	68.6	Low	72.6	Confident	28 Å²	28	68.8 Å²	68.8	23%	0.231	36%	0.36	C	S	.	.	H	α-helix	trans	-55	-40	176.1	0	0	0	0	0	110.9	Q285 T286 I287	A283-Q285 VanDerWaalsContact C-N 3.29Å; A283-Q285 PolarHBondContact O-N 2.91Å; A283-T286 PolarHBondContact O-N 3.46Å; A283-I287 WeakPolarHBondContact O-CG1 3.04Å; A283-I287 PolarHBondContact O-N 3.21Å
284	N	75.7	Confident	73.9	Confident	48 Å²	48	65 Å²	65	26%	0.257	34%	0.34	S	S	.	.	H	α-helix	trans	-59.8	-36	176.4	-64.4	-48.1	0	0	0	113.2	F282 N288	F282-N284 PolarHBondContact O-N 2.83Å; N284-N288 WeakPolarHBondContact O-CB 3.42Å; N284-N288 PolarHBondContact O-N 3.07Å; N284-N288 PolarHBondContact O-ND2 3.49Å
285	Q	83.4	Confident	75.5	Confident	79 Å²	79	62.3 Å²	62.3	37%	0.369	34%	0.336	S	S	.	.	H	α-helix	trans	-69.2	-44	178.5	-175.4	-177.3	-4.4	0	0	110.8	A244 F282 A283 N288 Q289	A244-Q285 HydrophobicContact CB-CG 4.45Å; F282-Q285 WeakPolarHBondContact O-CB 3.32Å; F282-Q285 PolarHBondContact O-N 3.4Å; A283-Q285 VanDerWaalsContact C-N 3.29Å; A283-Q285 PolarHBondContact O-N 2.91Å; Q285-N288 PolarHBondContact O-N 3.4Å; Q285-Q289 PolarHBondContact O-N 3.16Å
286	T	86.6	Confident	77	Confident	12 Å²	12	60.2 Å²	60.2	7%	0.074	33%	0.333	C	S	.	.	H	α-helix	trans	-62.2	-45.7	177.3	-59.1	0	0	0	0	111	F235 I247 V270 F282 A283 Q289 L290	F235-T286 HydrophobicContact CB-CG2 3.99Å; I247-T286 HydrophobicContact CD1-CG2 3.39Å; I247-T286 VanDerWaalsContact CD1-O 3.27Å; I247-T286 WeakPolarHBondContact CD1-O 3.46Å; V270-T286 HydrophobicContact CB-CG2 4.26Å; V270-T286 HydrophobicContact CG1-CG2 3.77Å; F282-T286 PolarHBondContact O-N 2.91Å; A283-T286 PolarHBondContact O-N 3.46Å; T286-Q289 PolarHBondContact O-N 3.4Å; T286-L290 PolarHBondContact O-N 2.92Å
287	I	86.3	Confident	78.6	Confident	3 Å²	3	50.2 Å²	50.2	2%	0.015	29%	0.289	C	S	.	.	H	α-helix	trans	-56.9	-53.6	173.2	-65.2	170.2	0	0	0	110.5	V270 A283 Q289 L290 L291	V270-I287 WeakPolarHBondContact O-CD1 3.35Å; V270-I287 WeakPolarHBondContact O-CG1 3.43Å; A283-I287 WeakPolarHBondContact O-CG1 3.04Å; A283-I287 PolarHBondContact O-N 3.21Å; I287-Q289 PolarHBondContact O-N 3.11Å; I287-L290 WeakPolarHBondContact O-CA 3.02Å; I287-L290 WeakPolarHBondContact O-CB 3.44Å; I287-L290 PolarHBondContact O-N 3.46Å; I287-L291 HydrophobicContact CG2-CD1 3.94Å; I287-L291 HydrophobicContact CG2-CG 4.07Å; I287-L291 VanDerWaalsContact O-CG 3.29Å; I287-L291 WeakPolarHBondContact O-CG 3.15Å; I287-L291 PolarHBondContact O-N 3.29Å
288	N	88.4	Confident	79.6	Confident	84 Å²	84	53.9 Å²	53.9	45%	0.449	30%	0.301	S	S	.	.	H	α-helix	trans	-60.4	-32.8	-177.6	-73.8	-36.7	0	0	0	112	N284 Q285 A292	N284-N288 WeakPolarHBondContact O-CB 3.42Å; N284-N288 PolarHBondContact O-N 3.07Å; N284-N288 PolarHBondContact O-ND2 3.49Å; Q285-N288 PolarHBondContact O-N 3.4Å; N288-A292 WeakPolarHBondContact O-CB 3.34Å; N288-A292 PolarHBondContact O-N 3.17Å
289	Q	90.9	Very high	80.2	Confident	27 Å²	27	49.8 Å²	49.8	13%	0.126	28%	0.276	C	S	.	.	H	α-helix	trans	-68.3	-43.9	173.1	-170.9	62.5	42.6	0	0	111.9	A244 I247 R248 Q285 T286 I287 L291 A292 E293	A244-Q289 HydrophobicContact CB-CB 3.82Å; A244-Q289 HydrophobicContact CB-CG 3.95Å; A244-Q289 WeakPolarHBondContact O-CG 3.43Å; I247-Q289 HydrophobicContact CB-CG 4.27Å; I247-Q289 HydrophobicContact CG2-CG 4.07Å; R248-Q289 HydrophobicContact CG-CG 4.15Å; R248-Q289 VanDerWaalsContact CG-NE2 3.33Å; Q285-Q289 PolarHBondContact O-N 3.16Å; T286-Q289 PolarHBondContact O-N 3.4Å; I287-Q289 PolarHBondContact O-N 3.11Å; Q289-L291 VanDerWaalsContact C-N 3.31Å; Q289-L291 PolarHBondContact O-N 2.87Å; Q289-A292 PolarHBondContact O-N 3.48Å; Q289-E293 PolarHBondContact NE2-OE1 2.74Å; Q289-E293 PolarHBondContact O-N 3.12Å
290	L	91.5	Very high	80.8	Confident	4 Å²	4	49.5 Å²	49.5	2%	0.021	27%	0.272	C	S	.	.	H	α-helix	trans	-57.7	-46.2	174.2	-178.3	58.5	0	0	0	111	I247 F251 I264 I267 T286 I287 A292 E293 M294 L319	I247-L290 HydrophobicContact CD1-CB 4.02Å; I247-L290 HydrophobicContact CG2-CB 4.49Å; I247-L290 HydrophobicContact CG2-CD1 4.37Å; F251-L290 HydrophobicContact CE2-CD1 3.77Å; F251-L290 HydrophobicContact CZ-CD1 4.15Å; I264-L290 HydrophobicContact CD1-CD1 4.21Å; I267-L290 HydrophobicContact CD1-CD2 4.17Å; T286-L290 PolarHBondContact O-N 2.92Å; I287-L290 WeakPolarHBondContact O-CA 3.02Å; I287-L290 WeakPolarHBondContact O-CB 3.44Å; I287-L290 PolarHBondContact O-N 3.46Å; L290-A292 VanDerWaalsContact C-N 3.33Å; L290-A292 PolarHBondContact O-N 3.45Å; L290-E293 PolarHBondContact O-N 3.16Å; L290-M294 HydrophobicContact CD1-CG 4.32Å; L290-M294 WeakPolarHBondContact O-CB 3.35Å; L290-M294 VanDerWaalsContact O-CG 3.25Å; L290-M294 WeakPolarHBondContact O-CG 3.18Å; L290-M294 PolarHBondContact O-N 3.03Å; L290-L319 HydrophobicContact CD2-CD2 3.97Å; L290-L319 HydrophobicContact CG-CD2 4.41Å
291	L	90.5	Very high	81.8	Confident	9 Å²	9	48 Å²	48	5%	0.047	27%	0.265	C	S	.	.	H	α-helix	trans	-59	-44.3	176	-64	-177.8	0	0	0	111.8	I287 Q289 M294 D295 A318 L319	I287-L291 HydrophobicContact CG2-CD1 3.94Å; I287-L291 HydrophobicContact CG2-CG 4.07Å; I287-L291 VanDerWaalsContact O-CG 3.29Å; I287-L291 WeakPolarHBondContact O-CG 3.15Å; I287-L291 PolarHBondContact O-N 3.29Å; Q289-L291 VanDerWaalsContact C-N 3.31Å; Q289-L291 PolarHBondContact O-N 2.87Å; L291-M294 PolarHBondContact O-N 2.92Å; L291-D295 WeakPolarHBondContact O-CB 3.2Å; L291-D295 PolarHBondContact O-N 3.33Å; L291-A318 HydrophobicContact CD1-CB 4.05Å; L291-L319 HydrophobicContact CD2-CD2 3.41Å; L291-L319 VanDerWaalsContact CD2-CD2 3.41Å; L291-L319 HydrophobicContact CD2-CG 4Å; L291-L319 HydrophobicContact CG-CD2 4.42Å
292	A	91.4	Very high	82.8	Confident	51 Å²	51	45 Å²	45	42%	0.421	25%	0.247	S	C	.	.	H	α-helix	trans	-65.5	-39.8	179.2	0	0	0	0	0	112.6	N288 Q289 L290 G296	N288-A292 WeakPolarHBondContact O-CB 3.34Å; N288-A292 PolarHBondContact O-N 3.17Å; Q289-A292 PolarHBondContact O-N 3.48Å; L290-A292 VanDerWaalsContact C-N 3.33Å; L290-A292 PolarHBondContact O-N 3.45Å; A292-G296 WeakPolarHBondContact O-CA 3.37Å; A292-G296 PolarHBondContact O-N 2.87Å
293	E	91.9	Very high	84	Confident	29 Å²	29	41.8 Å²	41.8	14%	0.136	23%	0.233	C	C	.	.	H	α-helix	trans	-67.6	-43.1	174.9	-67.4	-54	149.2	0	0	111.6	I247 R248 F251 Q289 L290 D295 G296 F297	I247-E293 HydrophobicContact CG2-CB 4.45Å; I247-E293 HydrophobicContact CG2-CG 3.85Å; R248-E293 WeakPolarHBondContact CG-OE1 3.49Å; F251-E293 HydrophobicContact CB-CB 4.26Å; F251-E293 HydrophobicContact CB-CG 4.17Å; F251-E293 HydrophobicContact CD1-CB 4Å; F251-E293 HydrophobicContact CD2-CB 3.47Å; F251-E293 VanDerWaalsContact CD2-CB 3.47Å; F251-E293 HydrophobicContact CD2-CG 3.74Å; F251-E293 HydrophobicContact CE1-CB 4.2Å; F251-E293 HydrophobicContact CE2-CB 3.71Å; F251-E293 HydrophobicContact CE2-CG 4.35Å; F251-E293 HydrophobicContact CG-CB 3.63Å; F251-E293 HydrophobicContact CG-CG 3.99Å; F251-E293 HydrophobicContact CZ-CB 4.06Å; Q289-E293 PolarHBondContact NE2-OE1 2.74Å; Q289-E293 PolarHBondContact O-N 3.12Å; L290-E293 PolarHBondContact O-N 3.16Å; E293-D295 VanDerWaalsContact C-N 3.35Å; E293-D295 PolarHBondContact O-N 2.92Å; E293-G296 PolarHBondContact O-N 2.88Å; E293-F297 VanDerWaalsContact O-CD1 3.25Å; E293-F297 WeakPolarHBondContact O-CD1 3.12Å; E293-F297 PolarHBondContact O-N 3.14Å
294	M	90.6	Very high	85.1	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-59.8	-42.8	176.2	-71.8	-64.7	-63.3	0	0	112.6	K200 F251 L290 L291 G296 F297 V305 R324	K200-M294 HydrophobicContact CB-CE 4.12Å; K200-M294 PolarHBondContact NZ-O 3.4Å; F251-M294 HydrophobicContact CE1-SD 4.13Å; F251-M294 HydrophobicContact CZ-CG 4.27Å; F251-M294 HydrophobicContact CZ-SD 3.74Å; L290-M294 HydrophobicContact CD1-CG 4.32Å; L290-M294 WeakPolarHBondContact O-CB 3.35Å; L290-M294 VanDerWaalsContact O-CG 3.25Å; L290-M294 WeakPolarHBondContact O-CG 3.18Å; L290-M294 PolarHBondContact O-N 3.03Å; L291-M294 PolarHBondContact O-N 2.92Å; M294-G296 VanDerWaalsContact C-N 3.28Å; M294-G296 PolarHBondContact O-N 3.36Å; M294-F297 HydrophobicContact CE-CE1 4.32Å; M294-F297 HydrophobicContact CE-CZ 4.34Å; M294-F297 HydrophobicContact SD-CE1 3.84Å; M294-F297 HydrophobicContact SD-CZ 4.36Å; M294-V305 HydrophobicContact CE-CB 4.14Å; M294-V305 HydrophobicContact CE-CG2 4.2Å; M294-V305 HydrophobicContact SD-CB 3.97Å; M294-V305 HydrophobicContact SD-CG1 4.21Å; M294-V305 HydrophobicContact SD-CG2 3.62Å; M294-R324 HydrophobicContact CB-CG 4.22Å; M294-R324 WeakPolarHBondContact CE-O 3.31Å
295	D	89.1	Confident	86.1	Confident	84 Å²	84	38.4 Å²	38.4	45%	0.449	21%	0.211	S	C	.	.	H	α-helix	trans	-69.9	-29.9	175.7	-66	-16.6	0	0	0	110.9	K200 L291 E293 R324	K200-D295 PolarHBondContact NZ-O 3.46Å; L291-D295 WeakPolarHBondContact O-CB 3.2Å; L291-D295 PolarHBondContact O-N 3.33Å; E293-D295 VanDerWaalsContact C-N 3.35Å; E293-D295 PolarHBondContact O-N 2.92Å; D295-R324 IonicContact OD1-CZ 2.78Å; D295-R324 IonicContact OD1-NE 3.91Å; D295-R324 PolarHBondContact OD1-NE 3.06Å; D295-R324 VanDerWaalsContact OD1-NE 3.08Å; D295-R324 IonicContact OD1-NH2 3.65Å; D295-R324 IonicContact OD2-CZ 2.78Å; D295-R324 IonicContact OD2-NE 2.64Å; D295-R324 IonicContact OD2-NH2 2.87Å; D295-R324 PolarHBondContact OD2-NH2 2.82Å
296	G	84.9	Confident	86.7	Confident	50 Å²	50	34.6 Å²	34.6	52%	0.515	19%	0.193	S	C	.	.	H	α-helix	trans	-81.4	-22.9	-168.6	0	0	0	0	0	117.5	A292 E293 M294	A292-G296 WeakPolarHBondContact O-CA 3.37Å; A292-G296 PolarHBondContact O-N 2.87Å; E293-G296 PolarHBondContact O-N 2.88Å; M294-G296 VanDerWaalsContact C-N 3.28Å; M294-G296 PolarHBondContact O-N 3.36Å
297	F	81.8	Confident	87.1	Confident	2 Å²	2	34 Å²	34	1%	0.009	19%	0.19	C	C	.	.	S	Bend	trans	-89.9	145.8	174.8	71.5	-96.6	0	0	0	111.9	K200 F251 E293 M294 E301 I303 V305	K200-F297 HydrophobicContact CB-CE2 4.21Å; K200-F297 HydrophobicContact CB-CZ 3.87Å; K200-F297 HydrophobicContact CD-CE2 4.33Å; K200-F297 HydrophobicContact CD-CZ 4.32Å; K200-F297 WeakPolarHBondContact CE-O 3.37Å; K200-F297 HydrophobicContact CG-CE2 3.92Å; K200-F297 HydrophobicContact CG-CZ 4.03Å; K200-F297 PolarHBondContact NZ-O 3.07Å; F251-F297 HydrophobicContact CD1-CD1 4.13Å; F251-F297 HydrophobicContact CD1-CE1 4.41Å; F251-F297 AromaticContact CE1-CD1 3.84Å; F251-F297 HydrophobicContact CE1-CD1 3.84Å; F251-F297 AromaticContact CE1-CE1 3.68Å; F251-F297 HydrophobicContact CE1-CE1 3.68Å; E293-F297 VanDerWaalsContact O-CD1 3.25Å; E293-F297 WeakPolarHBondContact O-CD1 3.12Å; E293-F297 PolarHBondContact O-N 3.14Å; M294-F297 HydrophobicContact CE-CE1 4.32Å; M294-F297 HydrophobicContact CE-CZ 4.34Å; M294-F297 HydrophobicContact SD-CE1 3.84Å; M294-F297 HydrophobicContact SD-CZ 4.36Å; F297-E301 WeakPolarHBondContact CB-OE2 3.32Å; F297-I303 HydrophobicContact CD2-CB 4.41Å; F297-I303 HydrophobicContact CE2-CB 4.34Å; F297-I303 WeakPolarHBondContact CE2-O 3.24Å; F297-V305 HydrophobicContact CE1-CG2 4.33Å; F297-V305 HydrophobicContact CZ-CG2 4.25Å
298	Q	76.6	Confident	87.6	Confident	121 Å²	121	33.9 Å²	33.9	57%	0.565	19%	0.189	S	C	*	.			trans	-82.3	141.3	175.5	-60.7	-170.7	15.9	0	0	110.4	K300 E301	Q298-K300 HydrophobicContact CB-CB 4.46Å; Q298-K300 PolarHBondContact O-N 3Å; Q298-E301 HydrophobicContact CB-CG 4.37Å; Q298-E301 PolarHBondContact N-OE1 3.35Å; Q298-E301 WeakPolarHBondContact O-CB 2.85Å; Q298-E301 PolarHBondContact O-N 3.08Å
299	S	69.3	Low	87.8	Confident	31 Å²	31	30 Å²	30	22%	0.217	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-57.6	-16.5	173.8	-56.3	0	0	0	0	113.3	L198 E301	L198-S299 PolarHBondContact O-OG 3.2Å; S299-E301 VanDerWaalsContact C-N 3.29Å
300	K	71.2	Confident	88	Confident	148 Å²	148	31.4 Å²	31.4	64%	0.643	18%	0.177	S	C	*	.	G	3₁₀ helix	trans	-72.7	-18.3	174.6	-62.7	-177	178.7	-176.4	0	113.8	Q298 G302	Q298-K300 HydrophobicContact CB-CB 4.46Å; Q298-K300 PolarHBondContact O-N 3Å; K300-G302 PolarHBondContact O-N 3.48Å
301	E	78	Confident	87.8	Confident	59 Å²	59	35.5 Å²	35.5	28%	0.276	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	-74	-2.4	179.5	-66.2	171	-145	0	0	112.4	S258 F297 Q298 S299 I303	S258-E301 WeakPolarHBondContact CB-O 3.37Å; S258-E301 PolarHBondContact OG-O 3.37Å; F297-E301 WeakPolarHBondContact CB-OE2 3.32Å; Q298-E301 HydrophobicContact CB-CG 4.37Å; Q298-E301 PolarHBondContact N-OE1 3.35Å; Q298-E301 WeakPolarHBondContact O-CB 2.85Å; Q298-E301 PolarHBondContact O-N 3.08Å; S299-E301 VanDerWaalsContact C-N 3.29Å; E301-I303 HydrophobicContact CB-CD1 4.19Å; E301-I303 HydrophobicContact CB-CG1 4.29Å; E301-I303 PolarHBondContact O-N 2.61Å; E301-I303 VanDerWaalsContact O-N 3.16Å
302	G	85.5	Confident	87.7	Confident	5 Å²	5	35.9 Å²	35.9	5%	0.052	20%	0.2	C	C	.	.			trans	62	26.8	175.8	0	0	0	0	0	114.2	P259 C260 K300	P259-G302 WeakPolarHBondContact CA-O 3.44Å; P259-G302 WeakPolarHBondContact CB-O 3.33Å; C260-G302 PolarHBondContact N-O 2.94Å; K300-G302 PolarHBondContact O-N 3.48Å
303	I	91.5	Very high	87.5	Confident	4 Å²	4	40 Å²	40	2%	0.021	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	124.3	175	-56.9	170	0	0	0	107.7	A254 K255 V262 F297 E301	A254-I303 HydrophobicContact CB-CD1 4.22Å; A254-I303 HydrophobicContact CB-CG2 4.24Å; K255-I303 HydrophobicContact CG-CD1 3.83Å; V262-I303 HydrophobicContact CG2-CG2 4.11Å; F297-I303 HydrophobicContact CD2-CB 4.41Å; F297-I303 HydrophobicContact CE2-CB 4.34Å; F297-I303 WeakPolarHBondContact CE2-O 3.24Å; E301-I303 HydrophobicContact CB-CD1 4.19Å; E301-I303 HydrophobicContact CB-CG1 4.29Å; E301-I303 PolarHBondContact O-N 2.61Å; E301-I303 VanDerWaalsContact O-N 3.16Å
304	I	93	Very high	87.3	Confident	4 Å²	4	41.2 Å²	41.2	2%	0.021	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	134	172.1	-57.9	-174.7	0	0	0	108.8	V181 F184 L185 C260 L261 V262 L306	V181-I304 HydrophobicContact CG1-CD1 3.9Å; V181-I304 HydrophobicContact CG1-CG2 4.12Å; F184-I304 HydrophobicContact CB-CD1 3.86Å; L185-I304 HydrophobicContact CD1-CD1 4.46Å; L185-I304 HydrophobicContact CD2-CB 4.05Å; L185-I304 HydrophobicContact CD2-CD1 3.72Å; L185-I304 HydrophobicContact CD2-CG1 3.71Å; L185-I304 HydrophobicContact CG-CD1 3.72Å; L185-I304 HydrophobicContact CG-CG1 4.28Å; C260-I304 PolarHBondContact O-N 3.01Å; L261-I304 HydrophobicContact CD1-CB 4.14Å; L261-I304 HydrophobicContact CD1-CG2 4.31Å; V262-I304 PolarHBondContact N-O 2.94Å; I304-L306 HydrophobicContact CG2-CD2 4.44Å
305	V	95	Very high	87.1	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	114.5	178.9	-173.5	0	0	0	0	110.4	K200 G201 V202 F251 V262 I264 M294 F297 F325	K200-V305 PolarHBondContact O-N 3.34Å; G201-V305 CarbonylContact C-O 3.54Å; G201-V305 WeakPolarHBondContact CA-O 3.45Å; V202-V305 PolarHBondContact N-O 3.03Å; F251-V305 HydrophobicContact CE1-CG2 4.04Å; F251-V305 HydrophobicContact CZ-CG2 4.14Å; V262-V305 HydrophobicContact CB-CG1 4.46Å; V262-V305 HydrophobicContact CB-CG2 4.24Å; V262-V305 HydrophobicContact CG1-CG1 4.37Å; V262-V305 CarbonylContact O-C 3.58Å; V262-V305 WeakPolarHBondContact O-CA 3.49Å; I264-V305 HydrophobicContact CD1-CG1 4.06Å; I264-V305 HydrophobicContact CG1-CG1 4.48Å; M294-V305 HydrophobicContact CE-CB 4.14Å; M294-V305 HydrophobicContact CE-CG2 4.2Å; M294-V305 HydrophobicContact SD-CB 3.97Å; M294-V305 HydrophobicContact SD-CG1 4.21Å; M294-V305 HydrophobicContact SD-CG2 3.62Å; F297-V305 HydrophobicContact CE1-CG2 4.33Å; F297-V305 HydrophobicContact CZ-CG2 4.25Å; V305-F325 HydrophobicContact CG1-CE1 4.14Å; V305-F325 HydrophobicContact CG1-CZ 4.04Å
306	L	96	Very high	87	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	120.7	169.9	-62.9	-172.5	0	0	0	109.7	V202 A216 L261 V262 F263 I264 I304	V202-L306 HydrophobicContact CB-CD2 3.56Å; V202-L306 HydrophobicContact CG1-CD2 4.32Å; V202-L306 HydrophobicContact CG2-CD2 4.03Å; V202-L306 CarbonylContact O-C 3.59Å; V202-L306 VanDerWaalsContact O-CA 3.32Å; V202-L306 WeakPolarHBondContact O-CA 3.37Å; A216-L306 HydrophobicContact CB-CD1 3.86Å; L261-L306 HydrophobicContact CD1-CD1 3.86Å; L261-L306 HydrophobicContact CD1-CD2 4.46Å; L261-L306 HydrophobicContact CD1-CG 3.67Å; L261-L306 HydrophobicContact CD2-CD1 3.82Å; L261-L306 HydrophobicContact CD2-CG 4.5Å; L261-L306 HydrophobicContact CG-CD1 4.16Å; L261-L306 HydrophobicContact CG-CG 4.31Å; V262-L306 PolarHBondContact O-N 3.09Å; F263-L306 CarbonylContact C-O 3.6Å; F263-L306 VanDerWaalsContact CA-O 3.31Å; F263-L306 WeakPolarHBondContact CA-O 3.24Å; F263-L306 HydrophobicContact CD2-CB 3.76Å; I264-L306 PolarHBondContact N-O 2.78Å; I304-L306 HydrophobicContact CG2-CD2 4.44Å
307	G	95.7	Very high	87.3	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	143	170.2	0	0	0	0	0	110.2	V202 L203 L204 I264	V202-G307 PolarHBondContact O-N 2.76Å; L203-G307 CarbonylContact C-O 3.58Å; L203-G307 WeakPolarHBondContact CA-O 3.43Å; L204-G307 PolarHBondContact N-O 3.26Å; I264-G307 CarbonylContact O-C 3.55Å; I264-G307 WeakPolarHBondContact O-CA 3.09Å
308	A	96	Very high	87.6	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	136.3	169.3	0	0	0	0	0	111	L204 K212 F263 I264 E266 I267	L204-A308 HydrophobicContact CB-CB 4.47Å; L204-A308 WeakPolarHBondContact O-CA 3.45Å; K212-A308 HydrophobicContact CB-CB 4.14Å; K212-A308 HydrophobicContact CD-CB 4.06Å; F263-A308 HydrophobicContact CE2-CB 3.82Å; F263-A308 HydrophobicContact CZ-CB 3.62Å; I264-A308 PolarHBondContact O-N 3.02Å; E266-A308 WeakPolarHBondContact CA-O 3.34Å; E266-A308 PolarHBondContact N-O 2.94Å; E266-A308 VanDerWaalsContact N-O 3.07Å; I267-A308 PolarHBondContact N-O 2.65Å
309	T	94.4	Very high	88.2	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.006	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	147.6	174	179.1	0	0	0	0	111	L203 L204 V205 G206 Q311	L203-T309 HydrophobicContact CD1-CG2 3.95Å; L203-T309 HydrophobicContact CD2-CG2 4.14Å; L203-T309 HydrophobicContact CG-CG2 4.13Å; L204-T309 PolarHBondContact O-N 3.12Å; V205-T309 HydrophobicContact CG2-CG2 3.92Å; G206-T309 PolarHBondContact N-O 3.36Å; T309-Q311 PolarHBondContact OG1-N 3.08Å; T309-Q311 PolarHBondContact OG1-O 2.78Å
310	N	93.9	Very high	89.3	Confident	58 Å²	58	39 Å²	39	31%	0.31	19%	0.191	S	C	.	.	S	Bend	trans	-86.8	-18.9	168.9	-59.7	-44.8	0	0	0	112.3	G206 K212	G206-N310 WeakPolarHBondContact O-CA 3.43Å; G206-N310 PolarHBondContact O-OD1 2.62Å; K212-N310 PolarHBondContact NZ-OD1 2.8Å
311	Q	88.3	Confident	90.3	Very high	89 Å²	89	39.5 Å²	39.5	42%	0.416	19%	0.189	S	C	.	.			trans	-136.5	99.9	-172.9	-66.7	173	101.5	0	0	109.5	T309 V314	T309-Q311 PolarHBondContact OG1-N 3.08Å; T309-Q311 PolarHBondContact OG1-O 2.78Å; Q311-V314 HydrophobicContact CB-CB 4.36Å; Q311-V314 HydrophobicContact CB-CG2 4.07Å
312	A	88	Confident	90.8	Very high	18 Å²	18	42.5 Å²	42.5	15%	0.149	21%	0.213	C	C	.	.	S	Bend	trans	-77.7	-28.7	179.4	0	0	0	0	0	112.1	V205 V314 L315	V205-A312 HydrophobicContact CG1-CB 3.69Å; V205-A312 HydrophobicContact CG2-CB 3.96Å; A312-V314 VanDerWaalsContact C-N 3.31Å; A312-V314 PolarHBondContact O-N 3.25Å; A312-L315 WeakPolarHBondContact O-CB 3.4Å; A312-L315 PolarHBondContact O-N 2.86Å
313	E	87.5	Confident	90.9	Very high	136 Å²	136	43.4 Å²	43.4	64%	0.636	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-25.3	-178	63	-75.8	174.6	0	0	114
314	V	86.6	Confident	90.9	Very high	55 Å²	55	44.8 Å²	44.8	33%	0.333	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-14.5	177	-175	0	0	0	0	111.3	G272 N273 Q311 A312	G272-V314 CarbonylContact C-O 3.58Å; G272-V314 WeakPolarHBondContact CA-O 3.37Å; N273-V314 VanDerWaalsContact CG-O 3.28Å; N273-V314 PolarHBondContact N-O 3.49Å; N273-V314 PolarHBondContact ND2-O 3.09Å; Q311-V314 HydrophobicContact CB-CB 4.36Å; Q311-V314 HydrophobicContact CB-CG2 4.07Å; A312-V314 VanDerWaalsContact C-N 3.31Å; A312-V314 PolarHBondContact O-N 3.25Å
315	L	87.5	Confident	90.9	Very high	3 Å²	3	44.6 Å²	44.6	2%	0.016	23%	0.226	C	C	.	.	B	Isolated β-bridge	trans	-75	141.5	-175.3	-160.2	73.1	0	0	0	112.6	L203 I267 G271 A312 K317 L319 L320	L203-L315 HydrophobicContact CD1-CD2 4.48Å; L203-L315 HydrophobicContact CD2-CD2 3.92Å; I267-L315 HydrophobicContact CG2-CD1 4.08Å; G271-L315 CarbonylContact O-C 3.59Å; G271-L315 WeakPolarHBondContact O-CA 3.49Å; A312-L315 WeakPolarHBondContact O-CB 3.4Å; A312-L315 PolarHBondContact O-N 2.86Å; L315-K317 PolarHBondContact O-N 2.98Å; L315-L319 HydrophobicContact CD1-CD1 3.81Å; L315-L319 HydrophobicContact CD2-CB 4.24Å; L315-L319 HydrophobicContact CD2-CD1 4.26Å; L315-L319 HydrophobicContact CG-CB 4.49Å; L315-L319 HydrophobicContact CG-CD1 3.89Å; L315-L320 HydrophobicContact CD2-CD2 3.84Å; L315-L320 HydrophobicContact CD2-CG 4.43Å
316	D	87.6	Confident	90.6	Very high	16 Å²	16	47.8 Å²	47.8	9%	0.086	24%	0.243	C	C	.	.			trans	-59.8	120.5	174.6	-172.9	-23.4	0	0	0	109.5	G271 R274 A318 L319	G271-D316 PolarHBondContact O-N 2.92Å; R274-D316 IonicContact CZ-OD2 3.81Å; R274-D316 IonicContact NE-OD2 3.22Å; R274-D316 PolarHBondContact NE-OD2 3.14Å; R274-D316 VanDerWaalsContact NE-OD2 3.08Å; R274-D316 IonicContact NH2-OD2 2.64Å; D316-A318 PolarHBondContact O-N 3.41Å; D316-A318 VanDerWaalsContact OD1-CB 3.25Å; D316-A318 WeakPolarHBondContact OD1-CB 3.38Å; D316-A318 PolarHBondContact OD1-N 3.26Å; D316-L319 WeakPolarHBondContact O-CB 3.47Å; D316-L319 PolarHBondContact O-N 3.22Å
317	K	89.2	Confident	90.4	Very high	168 Å²	168	50.4 Å²	50.4	73%	0.73	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-18.9	178	-63.2	-177.2	-180	-179.4	0	113.4	L315 L319 L320	L315-K317 PolarHBondContact O-N 2.98Å; K317-L319 VanDerWaalsContact C-N 3.3Å; K317-L320 PolarHBondContact O-N 3.48Å
318	A	88.9	Confident	90.3	Very high	9 Å²	9	54.1 Å²	54.1	7%	0.074	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-32.2	172.5	0	0	0	0	0	112.8	L291 D316 L320 R324	L291-A318 HydrophobicContact CD1-CB 4.05Å; D316-A318 PolarHBondContact O-N 3.41Å; D316-A318 VanDerWaalsContact OD1-CB 3.25Å; D316-A318 WeakPolarHBondContact OD1-CB 3.38Å; D316-A318 PolarHBondContact OD1-N 3.26Å; A318-L320 VanDerWaalsContact C-N 3.32Å; A318-R324 WeakPolarHBondContact O-CD 3.37Å; A318-R324 PolarHBondContact O-NH1 3.21Å
319	L	90.4	Very high	90.3	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-29.8	177.4	-74.2	165.9	0	0	0	112.2	L290 L291 L315 D316 K317 R321 R324 F325	L290-L319 HydrophobicContact CD2-CD2 3.97Å; L290-L319 HydrophobicContact CG-CD2 4.41Å; L291-L319 HydrophobicContact CD2-CD2 3.41Å; L291-L319 VanDerWaalsContact CD2-CD2 3.41Å; L291-L319 HydrophobicContact CD2-CG 4Å; L291-L319 HydrophobicContact CG-CD2 4.42Å; L315-L319 HydrophobicContact CD1-CD1 3.81Å; L315-L319 HydrophobicContact CD2-CB 4.24Å; L315-L319 HydrophobicContact CD2-CD1 4.26Å; L315-L319 HydrophobicContact CG-CB 4.49Å; L315-L319 HydrophobicContact CG-CD1 3.89Å; D316-L319 WeakPolarHBondContact O-CB 3.47Å; D316-L319 PolarHBondContact O-N 3.22Å; K317-L319 VanDerWaalsContact C-N 3.3Å; L319-R321 VanDerWaalsContact C-N 3.29Å; L319-R321 PolarHBondContact O-N 3.03Å; L319-R324 WeakPolarHBondContact O-CB 3.41Å; L319-F325 HydrophobicContact CB-CD2 4.2Å; L319-F325 HydrophobicContact CD2-CD2 4.31Å; L319-F325 HydrophobicContact CD2-CE2 4.19Å; L319-F325 WeakPolarHBondContact O-CB 3.36Å; L319-F325 PolarHBondContact O-N 3.45Å
320	L	91.6	Very high	90.3	Very high	46 Å²	46	59.8 Å²	59.8	24%	0.241	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	4.9	-177.4	-55.2	-178.6	0	0	0	114	L203 L315 K317 A318	L203-L320 HydrophobicContact CD2-CD2 3.66Å; L315-L320 HydrophobicContact CD2-CD2 3.84Å; L315-L320 HydrophobicContact CD2-CG 4.43Å; K317-L320 PolarHBondContact O-N 3.48Å; A318-L320 VanDerWaalsContact C-N 3.32Å
321	R	91.6	Very high	90.3	Very high	159 Å²	159	57.1 Å²	57.1	60%	0.6	29%	0.288	S	S	*	.	S	Bend	trans	-77.2	150.6	180	-70	-177.5	179.7	-178	-1.1	110.9	L319 G323 R324	L319-R321 VanDerWaalsContact C-N 3.29Å; L319-R321 PolarHBondContact O-N 3.03Å; R321-G323 PolarHBondContact O-N 3.44Å; R321-R324 PolarHBondContact O-N 2.97Å; R321-R324 VanDerWaalsContact O-N 3.14Å
322	P	88.9	Confident	90.5	Very high	122 Å²	122	56.5 Å²	56.5	79%	0.792	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.9	136.3	175.7	-28	35.2	0	0	0	112.8
323	G	87.5	Confident	90.8	Very high	23 Å²	23	58.1 Å²	58.1	24%	0.237	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.6	0.7	-175	0	0	0	0	0	115.3	K200 R321	K200-G323 WeakPolarHBondContact CD-O 3.49Å; R321-G323 PolarHBondContact O-N 3.44Å
324	R	92	Very high	91.1	Very high	34 Å²	34	52 Å²	52	13%	0.128	28%	0.275	C	S	.	.	S	Bend	trans	-119.5	-107.9	174.6	-65.1	162.2	178.2	-170.9	-3.6	108.9	G201 M294 D295 A318 L319 R321 D326	G201-R324 WeakPolarHBondContact CA-O 3.25Å; G201-R324 PolarHBondContact N-O 3.06Å; M294-R324 HydrophobicContact CB-CG 4.22Å; M294-R324 WeakPolarHBondContact CE-O 3.31Å; D295-R324 IonicContact OD1-CZ 2.78Å; D295-R324 IonicContact OD1-NE 3.91Å; D295-R324 PolarHBondContact OD1-NE 3.06Å; D295-R324 VanDerWaalsContact OD1-NE 3.08Å; D295-R324 IonicContact OD1-NH2 3.65Å; D295-R324 IonicContact OD2-CZ 2.78Å; D295-R324 IonicContact OD2-NE 2.64Å; D295-R324 IonicContact OD2-NH2 2.87Å; D295-R324 PolarHBondContact OD2-NH2 2.82Å; A318-R324 WeakPolarHBondContact O-CD 3.37Å; A318-R324 PolarHBondContact O-NH1 3.21Å; L319-R324 WeakPolarHBondContact O-CB 3.41Å; R321-R324 PolarHBondContact O-N 2.97Å; R321-R324 VanDerWaalsContact O-N 3.14Å; R324-D326 PolarHBondContact O-N 3.31Å
325	F	92.9	Very high	91.3	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.283	C	S	.	.	S	Bend	trans	-91	79.6	164.2	-66.4	-73.8	0	0	0	108.9	G201 L203 I267 V305 L319	G201-F325 WeakPolarHBondContact O-CA 3.45Å; L203-F325 HydrophobicContact CB-CB 4.14Å; L203-F325 HydrophobicContact CB-CD1 4.14Å; L203-F325 HydrophobicContact CB-CG 4.32Å; I267-F325 HydrophobicContact CD1-CD2 4.23Å; I267-F325 HydrophobicContact CD1-CE1 4.43Å; I267-F325 HydrophobicContact CD1-CE2 3.24Å; I267-F325 HydrophobicContact CD1-CZ 3.36Å; V305-F325 HydrophobicContact CG1-CE1 4.14Å; V305-F325 HydrophobicContact CG1-CZ 4.04Å; L319-F325 HydrophobicContact CB-CD2 4.2Å; L319-F325 HydrophobicContact CD2-CD2 4.31Å; L319-F325 HydrophobicContact CD2-CE2 4.19Å; L319-F325 WeakPolarHBondContact O-CB 3.36Å; L319-F325 PolarHBondContact O-N 3.45Å
326	D	88.3	Confident	91.6	Very high	66 Å²	66	55.9 Å²	55.9	35%	0.353	29%	0.293	S	S	.	.			trans	-84.4	-21.6	-175.5	53.2	-6.6	0	0	0	113.3	P199 G201 R324	P199-D326 WeakPolarHBondContact CB-OD1 3.48Å; G201-D326 PolarHBondContact O-N 2.92Å; G201-D326 VanDerWaalsContact O-N 3.16Å; R324-D326 PolarHBondContact O-N 3.31Å
327	V	92.3	Very high	91.8	Very high	55 Å²	55	62.2 Å²	62.2	33%	0.333	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	133.5	173.1	-175.7	0	0	0	0	109.5	P199 G201 V202 L203 I329	P199-V327 HydrophobicContact CB-CG2 3.93Å; G201-V327 PolarHBondContact O-N 3.4Å; V202-V327 CarbonylContact C-O 3.57Å; V202-V327 WeakPolarHBondContact CA-O 3.29Å; V202-V327 HydrophobicContact CB-CB 4.39Å; V202-V327 HydrophobicContact CG1-CB 4.09Å; V202-V327 HydrophobicContact CG1-CG1 3.98Å; V202-V327 HydrophobicContact CG2-CB 4.13Å; L203-V327 PolarHBondContact N-O 3.48Å; V327-I329 HydrophobicContact CG1-CD1 4.4Å; V327-I329 HydrophobicContact CG1-CG1 4Å
328	Q	93.6	Very high	92.1	Very high	79 Å²	79	54.3 Å²	54.3	37%	0.369	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	126.3	173.5	-61.7	-179.3	39.3	0	0	108.7	L203	L203-Q328 HydrophobicContact CB-CG 4.24Å; L203-Q328 HydrophobicContact CD2-CG 4.35Å; L203-Q328 WeakPolarHBondContact O-CA 3.38Å
329	I	94.9	Very high	92.4	Very high	3 Å²	3	54.1 Å²	54.1	2%	0.015	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	118.7	-179.5	-54.9	-176.9	0	0	0	107.8	V174 E177 L178 V202 L203 L204 V205 V327	V174-I329 HydrophobicContact CB-CG2 4.49Å; V174-I329 HydrophobicContact CG1-CG2 3.87Å; V174-I329 HydrophobicContact CG2-CG2 4.39Å; E177-I329 HydrophobicContact CB-CD1 3.95Å; E177-I329 WeakPolarHBondContact OE2-CG1 3.34Å; E177-I329 WeakPolarHBondContact OE2-CG2 3.45Å; L178-I329 HydrophobicContact CD2-CD1 3.69Å; L178-I329 HydrophobicContact CG-CD1 4.18Å; V202-I329 HydrophobicContact CG1-CD1 3.54Å; V202-I329 HydrophobicContact CG1-CG1 3.75Å; L203-I329 PolarHBondContact O-N 3.33Å; L204-I329 WeakPolarHBondContact CA-O 3.41Å; L204-I329 HydrophobicContact CD2-CB 4.06Å; L204-I329 HydrophobicContact CD2-CG2 4.47Å; V205-I329 PolarHBondContact N-O 3.18Å; V327-I329 HydrophobicContact CG1-CD1 4.4Å; V327-I329 HydrophobicContact CG1-CG1 4Å
330	H	94.9	Very high	92.6	Very high	117 Å²	117	55.9 Å²	55.9	54%	0.542	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	117	178	-71.4	-75.7	0	0	0	110.5	V205	V205-H330 CarbonylContact O-C 3.56Å; V205-H330 VanDerWaalsContact O-CA 3.29Å; V205-H330 WeakPolarHBondContact O-CA 3.27Å
331	V	94.8	Very high	92.8	Very high	1 Å²	1	55.1 Å²	55.1	1%	0.006	30%	0.295	C	S	.	.			trans	-97.6	93.4	176.6	-167.7	0	0	0	0	109	V174 L204 V205 G206 P207 V210 K212 L215	V174-V331 HydrophobicContact CG1-CG2 4.06Å; V174-V331 HydrophobicContact CG2-CG1 4.45Å; V174-V331 HydrophobicContact CG2-CG2 4.39Å; L204-V331 HydrophobicContact CB-CG2 4.37Å; L204-V331 HydrophobicContact CD2-CG2 4.36Å; V205-V331 PolarHBondContact O-N 3.48Å; G206-V331 WeakPolarHBondContact CA-O 3.25Å; P207-V331 WeakPolarHBondContact CD-O 3.38Å; V210-V331 HydrophobicContact CB-CG1 3.99Å; V210-V331 HydrophobicContact CG2-CB 3.95Å; V210-V331 HydrophobicContact CG2-CG1 3.53Å; K212-V331 HydrophobicContact CG-CB 4.5Å; K212-V331 HydrophobicContact CG-CG2 4.44Å; L215-V331 HydrophobicContact CD1-CG1 3.89Å; L215-V331 HydrophobicContact CD1-CG2 4.2Å
332	S	92.5	Very high	92.9	Very high	77 Å²	77	48 Å²	48	54%	0.538	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-77.1	159.6	177.8	-63.6	0	0	0	0	112.2
333	P	93	Very high	93.3	Very high	51 Å²	51	42.2 Å²	42.2	33%	0.331	23%	0.232	S	C	.	.	P	Polyproline II helix	trans	-53.3	150	165.8	-24.2	34.5	0	0	0	111.9	P207	P207-P333 HydrophobicContact CG-CG 3.82Å
334	P	93.5	Very high	93.7	Very high	9 Å²	9	43.7 Å²	43.7	6%	0.058	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-61.5	139.6	-174.4	25.3	-36.4	0	0	0	113.4	R339 L342 Y368	P334-R339 HydrophobicContact CB-CG 3.97Å; P334-R339 HydrophobicContact CG-CG 3.76Å; P334-R339 PolarHBondContact O-NH1 2.82Å; P334-R339 VanDerWaalsContact O-NH1 3.12Å; P334-L342 HydrophobicContact CB-CD1 3.8Å; P334-L342 HydrophobicContact CG-CD1 3.72Å; P334-Y368 VanDerWaalsContact CD-O 3.29Å; P334-Y368 WeakPolarHBondContact CD-O 3.14Å; P334-Y368 WeakPolarHBondContact CG-O 3.48Å
335	T	92.2	Very high	93.7	Very high	81 Å²	81	44.6 Å²	44.6	50%	0.497	24%	0.241	S	C	.	.	P	Polyproline II helix	trans	-65	170.7	169.5	63.1	0	0	0	0	111.2	E337 G338 R339	T335-E337 VanDerWaalsContact C-N 3.32Å; T335-E337 PolarHBondContact O-N 3.36Å; T335-G338 CarbonylContact O-C 3.44Å; T335-G338 WeakPolarHBondContact O-CA 3.32Å; T335-G338 PolarHBondContact O-N 3.45Å; T335-G338 PolarHBondContact OG1-N 3.07Å; T335-R339 WeakPolarHBondContact O-CG 3.11Å; T335-R339 PolarHBondContact O-N 2.87Å
336	Y	93.1	Very high	93.8	Very high	57 Å²	57	46.1 Å²	46.1	22%	0.224	25%	0.247	C	C	.	.	H	α-helix	trans	-47.8	-51.2	175.6	175.5	-106	0	0	0	113.3	G338 R339 I340 E359 A362 H363	Y336-G338 VanDerWaalsContact C-N 3.34Å; Y336-G338 PolarHBondContact O-N 3.13Å; Y336-R339 PolarHBondContact O-N 3.4Å; Y336-I340 HydrophobicContact CD1-CD1 4.03Å; Y336-I340 HydrophobicContact CE1-CD1 3.42Å; Y336-I340 VanDerWaalsContact CE1-CD1 3.42Å; Y336-I340 HydrophobicContact CE2-CD1 4.1Å; Y336-I340 VanDerWaalsContact CZ-CD1 3.46Å; Y336-I340 PolarHBondContact O-N 3.44Å; Y336-E359 WeakPolarHBondContact OH-CB 3.37Å; Y336-A362 HydrophobicContact CD2-CB 4.03Å; Y336-A362 HydrophobicContact CE2-CB 3.75Å; Y336-H363 AromaticContact CD2-CE1 3.88Å; Y336-H363 AromaticContact CE2-CD2 3.94Å; Y336-H363 AromaticContact CE2-CE1 3.31Å; Y336-H363 WeakPolarHBondContact CE2-CE1 3.18Å; Y336-H363 AromaticContact CE2-ND1 3.69Å; Y336-H363 AromaticContact CE2-NE2 3.49Å; Y336-H363 WeakPolarHBondContact CE2-NE2 3.43Å; Y336-H363 AromaticContact CZ-CE1 3.82Å; Y336-H363 AromaticContact CZ-NE2 3.73Å; Y336-H363 PolarHBondContact OH-NE2 3.05Å
337	E	92.6	Very high	94.2	Very high	149 Å²	149	43.4 Å²	43.4	70%	0.696	23%	0.232	S	C	*	.	H	α-helix	trans	-62.5	-41.2	177.7	-63.3	-179.1	173.5	0	0	111.7	T335 R339 I340 A341	T335-E337 VanDerWaalsContact C-N 3.32Å; T335-E337 PolarHBondContact O-N 3.36Å; E337-R339 VanDerWaalsContact C-N 3.34Å; E337-R339 PolarHBondContact O-N 2.83Å; E337-I340 WeakPolarHBondContact O-CB 3.41Å; E337-I340 PolarHBondContact O-N 3.43Å; E337-A341 PolarHBondContact O-N 3.4Å
338	G	93.8	Very high	94.2	Very high	3 Å²	3	49 Å²	49	3%	0.031	25%	0.252	C	S	.	.	H	α-helix	trans	-62.7	-38.1	175.4	0	0	0	0	0	113.3	G170 T335 Y336 A341 L342	G170-G338 VanDerWaalsContact CA-CA 3.4Å; T335-G338 CarbonylContact O-C 3.44Å; T335-G338 WeakPolarHBondContact O-CA 3.32Å; T335-G338 PolarHBondContact O-N 3.45Å; T335-G338 PolarHBondContact OG1-N 3.07Å; Y336-G338 VanDerWaalsContact C-N 3.34Å; Y336-G338 PolarHBondContact O-N 3.13Å; G338-A341 PolarHBondContact O-N 3.38Å; G338-L342 WeakPolarHBondContact O-CB 3.32Å; G338-L342 VanDerWaalsContact O-CG 3.31Å; G338-L342 WeakPolarHBondContact O-CG 3.41Å; G338-L342 PolarHBondContact O-N 3.01Å
339	R	95.1	Very high	94.2	Very high	4 Å²	4	52.3 Å²	52.3	2%	0.015	27%	0.266	C	S	.	.	H	α-helix	trans	-67.2	-40.5	175.1	-66.8	-166.9	-54.6	-86.7	3.9	111.4	P334 T335 Y336 E337 A341 L342 L343 A362 T365 I373 D464	P334-R339 HydrophobicContact CB-CG 3.97Å; P334-R339 HydrophobicContact CG-CG 3.76Å; P334-R339 PolarHBondContact O-NH1 2.82Å; P334-R339 VanDerWaalsContact O-NH1 3.12Å; T335-R339 WeakPolarHBondContact O-CG 3.11Å; T335-R339 PolarHBondContact O-N 2.87Å; Y336-R339 PolarHBondContact O-N 3.4Å; E337-R339 VanDerWaalsContact C-N 3.34Å; E337-R339 PolarHBondContact O-N 2.83Å; R339-A341 VanDerWaalsContact C-N 3.33Å; R339-A341 PolarHBondContact O-N 3.4Å; R339-L342 PolarHBondContact O-N 3.13Å; R339-L343 VanDerWaalsContact O-CB 3.29Å; R339-L343 WeakPolarHBondContact O-CB 3.45Å; R339-L343 VanDerWaalsContact O-CG 3.23Å; R339-L343 WeakPolarHBondContact O-CG 3.46Å; R339-L343 PolarHBondContact O-N 3.25Å; R339-A362 HydrophobicContact CB-CB 4.37Å; R339-A362 PolarHBondContact NE-O 2.73Å; R339-A362 PolarHBondContact NH2-O 3.29Å; R339-T365 WeakPolarHBondContact CD-O 3.39Å; R339-T365 PolarHBondContact NE-O 2.99Å; R339-I373 HydrophobicContact CB-CD1 4.14Å; R339-I373 HydrophobicContact CG-CD1 3.95Å; R339-D464 IonicContact CZ-OD1 3.84Å; R339-D464 IonicContact CZ-OD2 3.08Å; R339-D464 VanDerWaalsContact CZ-OD2 3.28Å; R339-D464 IonicContact NH1-OD2 2.8Å; R339-D464 PolarHBondContact NH1-OD2 3.16Å; R339-D464 IonicContact NH2-OD1 3.45Å; R339-D464 PolarHBondContact NH2-OD1 3.03Å; R339-D464 IonicContact NH2-OD2 3.04Å; R339-D464 PolarHBondContact NH2-OD2 2.99Å
340	I	95.4	Very high	94.2	Very high	38 Å²	38	54.1 Å²	54.1	20%	0.195	28%	0.277	C	S	.	.	H	α-helix	trans	-58.9	-46.4	172.5	-70.3	174.7	0	0	0	110.5	Y336 E337 L343 N344 I358 E359 A362	Y336-I340 HydrophobicContact CD1-CD1 4.03Å; Y336-I340 HydrophobicContact CE1-CD1 3.42Å; Y336-I340 VanDerWaalsContact CE1-CD1 3.42Å; Y336-I340 HydrophobicContact CE2-CD1 4.1Å; Y336-I340 VanDerWaalsContact CZ-CD1 3.46Å; Y336-I340 PolarHBondContact O-N 3.44Å; E337-I340 WeakPolarHBondContact O-CB 3.41Å; E337-I340 PolarHBondContact O-N 3.43Å; I340-L343 PolarHBondContact O-N 2.94Å; I340-N344 WeakPolarHBondContact CG2-ND2 3.48Å; I340-N344 WeakPolarHBondContact O-CB 3.47Å; I340-N344 PolarHBondContact O-N 2.97Å; I340-N344 PolarHBondContact O-ND2 2.88Å; I340-I358 HydrophobicContact CG1-CG2 4.4Å; I340-I358 HydrophobicContact CG2-CG2 4.17Å; I340-E359 HydrophobicContact CD1-CG 4.49Å; I340-A362 HydrophobicContact CG1-CB 3.72Å
341	A	94.9	Very high	94.2	Very high	29 Å²	29	56.1 Å²	56.1	24%	0.24	28%	0.284	C	S	.	.	H	α-helix	trans	-62.5	-44.1	179	0	0	0	0	0	111.9	Q169 E337 G338 R339 N344 L345	Q169-A341 HydrophobicContact CB-CB 4.16Å; E337-A341 PolarHBondContact O-N 3.4Å; G338-A341 PolarHBondContact O-N 3.38Å; R339-A341 VanDerWaalsContact C-N 3.33Å; R339-A341 PolarHBondContact O-N 3.4Å; A341-N344 PolarHBondContact O-N 3.23Å; A341-L345 WeakPolarHBondContact O-CB 3.35Å; A341-L345 PolarHBondContact O-N 3.2Å
342	L	95.4	Very high	94.1	Very high	11 Å²	11	58.8 Å²	58.8	6%	0.058	30%	0.3	C	S	.	.	H	α-helix	trans	-65.6	-44.2	176.9	-74.5	164.7	0	0	0	112.4	Q169 P334 G338 R339 N344 L345 Y346 I373	Q169-L342 HydrophobicContact CB-CD2 4.02Å; Q169-L342 HydrophobicContact CB-CG 4.25Å; P334-L342 HydrophobicContact CB-CD1 3.8Å; P334-L342 HydrophobicContact CG-CD1 3.72Å; G338-L342 WeakPolarHBondContact O-CB 3.32Å; G338-L342 VanDerWaalsContact O-CG 3.31Å; G338-L342 WeakPolarHBondContact O-CG 3.41Å; G338-L342 PolarHBondContact O-N 3.01Å; R339-L342 PolarHBondContact O-N 3.13Å; L342-N344 VanDerWaalsContact C-N 3.34Å; L342-N344 PolarHBondContact O-N 2.75Å; L342-L345 WeakPolarHBondContact O-CB 3.42Å; L342-L345 PolarHBondContact O-N 2.94Å; L342-Y346 HydrophobicContact CD2-CE2 4.07Å; L342-Y346 WeakPolarHBondContact O-CD2 3.34Å; L342-Y346 PolarHBondContact O-N 2.7Å; L342-I373 HydrophobicContact CB-CD1 4.04Å; L342-I373 HydrophobicContact CB-CG2 4.31Å; L342-I373 HydrophobicContact CD1-CD1 4.09Å
343	L	96.3	Very high	94	Very high	0 Å²	0	56 Å²	56	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-59.1	-47.4	175.2	-77.3	167.8	0	0	0	110.5	R339 I340 L345 Y346 L347 I358 L361 A362 I373 V377	R339-L343 VanDerWaalsContact O-CB 3.29Å; R339-L343 WeakPolarHBondContact O-CB 3.45Å; R339-L343 VanDerWaalsContact O-CG 3.23Å; R339-L343 WeakPolarHBondContact O-CG 3.46Å; R339-L343 PolarHBondContact O-N 3.25Å; I340-L343 PolarHBondContact O-N 2.94Å; L343-L345 VanDerWaalsContact C-N 3.33Å; L343-L345 PolarHBondContact O-N 2.84Å; L343-Y346 PolarHBondContact O-N 3.48Å; L343-L347 HydrophobicContact CB-CD1 4.46Å; L343-L347 WeakPolarHBondContact O-CB 3.46Å; L343-L347 WeakPolarHBondContact O-CD1 3.46Å; L343-L347 WeakPolarHBondContact O-CG 3.43Å; L343-L347 PolarHBondContact O-N 3.22Å; L343-I358 HydrophobicContact CB-CG2 3.98Å; L343-I358 HydrophobicContact CD1-CG2 4.13Å; L343-L361 HydrophobicContact CD1-CB 4.19Å; L343-L361 HydrophobicContact CD1-CD2 4.28Å; L343-L361 HydrophobicContact CD1-CG 4.1Å; L343-L361 HydrophobicContact CD2-CD2 3.63Å; L343-L361 HydrophobicContact CD2-CG 4.12Å; L343-A362 HydrophobicContact CD1-CB 3.98Å; L343-I373 HydrophobicContact CD2-CG2 3.66Å; L343-I373 HydrophobicContact CG-CG2 3.99Å; L343-V377 HydrophobicContact CD2-CG2 4.47Å
344	N	95.2	Very high	93.7	Very high	54 Å²	54	60.1 Å²	60.1	29%	0.289	31%	0.313	S	S	.	.	H	α-helix	trans	-58.7	-43.4	174.8	-84.5	-60.7	0	0	0	112.5	I340 A341 L342 K348 I358	I340-N344 WeakPolarHBondContact CG2-ND2 3.48Å; I340-N344 WeakPolarHBondContact O-CB 3.47Å; I340-N344 PolarHBondContact O-N 2.97Å; I340-N344 PolarHBondContact O-ND2 2.88Å; A341-N344 PolarHBondContact O-N 3.23Å; L342-N344 VanDerWaalsContact C-N 3.34Å; L342-N344 PolarHBondContact O-N 2.75Å; N344-K348 WeakPolarHBondContact O-CB 3.28Å; N344-K348 WeakPolarHBondContact O-CD 3.32Å; N344-K348 WeakPolarHBondContact O-CG 3.42Å; N344-K348 PolarHBondContact O-N 3.29Å; N344-K348 VanDerWaalsContact O-N 3.08Å; N344-I358 VanDerWaalsContact OD1-CD1 3.23Å; N344-I358 WeakPolarHBondContact OD1-CD1 3.42Å
345	L	93.6	Very high	93.3	Very high	52 Å²	52	64.8 Å²	64.8	27%	0.272	34%	0.338	S	S	.	.	H	α-helix	trans	-60.6	-47.8	179.3	178.4	66.5	0	0	0	111.8	Q169 A341 L342 L343	Q169-L345 HydrophobicContact CG-CD2 4.1Å; A341-L345 WeakPolarHBondContact O-CB 3.35Å; A341-L345 PolarHBondContact O-N 3.2Å; L342-L345 WeakPolarHBondContact O-CB 3.42Å; L342-L345 PolarHBondContact O-N 2.94Å; L343-L345 VanDerWaalsContact C-N 3.33Å; L343-L345 PolarHBondContact O-N 2.84Å
346	Y	94.9	Very high	93.3	Very high	32 Å²	32	62.4 Å²	62.4	13%	0.125	32%	0.322	C	S	.	.	H	α-helix	trans	-78.7	-35.1	-177.5	-68.3	-61.2	0	0	0	112.8	L342 L343 K348 K349 I373 Q374	L342-Y346 HydrophobicContact CD2-CE2 4.07Å; L342-Y346 WeakPolarHBondContact O-CD2 3.34Å; L342-Y346 PolarHBondContact O-N 2.7Å; L343-Y346 PolarHBondContact O-N 3.48Å; Y346-K348 VanDerWaalsContact C-N 3.28Å; Y346-K348 PolarHBondContact O-N 3.42Å; Y346-K349 HydrophobicContact CD1-CD 4.38Å; Y346-K349 WeakPolarHBondContact O-CB 3.47Å; Y346-K349 PolarHBondContact O-N 3.08Å; Y346-K349 VanDerWaalsContact O-N 3.08Å; Y346-I373 HydrophobicContact CD2-CG2 3.98Å; Y346-Q374 HydrophobicContact CD1-CB 4.15Å; Y346-Q374 HydrophobicContact CD1-CG 3.88Å; Y346-Q374 HydrophobicContact CD2-CB 4.22Å; Y346-Q374 HydrophobicContact CE1-CB 3.75Å; Y346-Q374 HydrophobicContact CE1-CG 3.53Å; Y346-Q374 HydrophobicContact CE2-CB 3.82Å; Y346-Q374 HydrophobicContact CG-CB 4.38Å
347	L	95.4	Very high	93.3	Very high	9 Å²	9	63.3 Å²	63.3	5%	0.047	33%	0.331	C	S	.	.	H	α-helix	trans	-64.3	-33	174.8	-73.3	171.1	0	0	0	111.8	L343 K349 V350 T352 I356 I358 V377 L397	L343-L347 HydrophobicContact CB-CD1 4.46Å; L343-L347 WeakPolarHBondContact O-CB 3.46Å; L343-L347 WeakPolarHBondContact O-CD1 3.46Å; L343-L347 WeakPolarHBondContact O-CG 3.43Å; L343-L347 PolarHBondContact O-N 3.22Å; L347-K349 PolarHBondContact O-N 2.87Å; L347-V350 HydrophobicContact CD2-CG2 4.43Å; L347-V350 WeakPolarHBondContact O-CG2 3.29Å; L347-V350 PolarHBondContact O-N 3.03Å; L347-V350 VanDerWaalsContact O-N 3.17Å; L347-T352 HydrophobicContact CB-CG2 4.1Å; L347-T352 HydrophobicContact CD2-CG2 3.83Å; L347-I356 HydrophobicContact CD1-CG2 4.06Å; L347-I356 HydrophobicContact CD2-CD1 4.17Å; L347-I358 HydrophobicContact CD1-CD1 4.46Å; L347-I358 HydrophobicContact CD1-CG1 4.04Å; L347-V377 HydrophobicContact CD2-CG1 4.13Å; L347-V377 HydrophobicContact CD2-CG2 4.21Å; L347-V377 HydrophobicContact CG-CG2 4.34Å; L347-L397 HydrophobicContact CD2-CD1 4.23Å; L347-L397 HydrophobicContact CD2-CD2 4.28Å
348	K	93.6	Very high	93.4	Very high	173 Å²	173	58.1 Å²	58.1	75%	0.752	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-22.8	172.6	-78.3	171.5	-176.6	-178.9	0	113.9	N344 Y346 V350	N344-K348 WeakPolarHBondContact O-CB 3.28Å; N344-K348 WeakPolarHBondContact O-CD 3.32Å; N344-K348 WeakPolarHBondContact O-CG 3.42Å; N344-K348 PolarHBondContact O-N 3.29Å; N344-K348 VanDerWaalsContact O-N 3.08Å; Y346-K348 VanDerWaalsContact C-N 3.28Å; Y346-K348 PolarHBondContact O-N 3.42Å; K348-V350 VanDerWaalsContact C-N 3.3Å
349	K	93.7	Very high	93.3	Very high	149 Å²	149	63.8 Å²	63.8	65%	0.648	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-8.2	178.9	-61.8	-178.6	-179	-179.1	0	112.9	Y346 L347	Y346-K349 HydrophobicContact CD1-CD 4.38Å; Y346-K349 WeakPolarHBondContact O-CB 3.47Å; Y346-K349 PolarHBondContact O-N 3.08Å; Y346-K349 VanDerWaalsContact O-N 3.08Å; L347-K349 PolarHBondContact O-N 2.87Å
350	V	94.6	Very high	93.2	Very high	40 Å²	40	67.2 Å²	67.2	24%	0.242	35%	0.348	C	S	.	.	S	Bend	trans	-124.9	157.4	-179.1	-62.5	0	0	0	0	110.6	L347 K348 T352 V377 A381 V392	L347-V350 HydrophobicContact CD2-CG2 4.43Å; L347-V350 WeakPolarHBondContact O-CG2 3.29Å; L347-V350 PolarHBondContact O-N 3.03Å; L347-V350 VanDerWaalsContact O-N 3.17Å; K348-V350 VanDerWaalsContact C-N 3.3Å; V350-T352 HydrophobicContact CG2-CG2 3.95Å; V350-T352 PolarHBondContact O-N 3.46Å; V350-V377 HydrophobicContact CG1-CG1 4.31Å; V350-V377 HydrophobicContact CG2-CG1 3.83Å; V350-A381 HydrophobicContact CG1-CB 4.01Å; V350-V392 HydrophobicContact CG2-CG2 4.44Å
351	K	93.9	Very high	93.1	Very high	159 Å²	159	65.4 Å²	65.4	69%	0.691	34%	0.339	S	S	*	.			trans	-76.3	112.2	174.8	-67.1	-176.9	-179.3	179.1	0	109.1	F391 V392	K351-F391 HydrophobicContact CB-CD1 4.08Å; K351-V392 PolarHBondContact O-N 2.69Å
352	T	93.6	Very high	93	Very high	58 Å²	58	64 Å²	64	36%	0.356	33%	0.327	S	S	.	.	B	Isolated β-bridge	trans	-106.3	148	-177.9	50.4	0	0	0	0	112.3	L347 V350 I356	L347-T352 HydrophobicContact CB-CG2 4.1Å; L347-T352 HydrophobicContact CD2-CG2 3.83Å; V350-T352 HydrophobicContact CG2-CG2 3.95Å; V350-T352 PolarHBondContact O-N 3.46Å; T352-I356 HydrophobicContact CG2-CD1 3.52Å
353	G	89.5	Confident	92.9	Very high	18 Å²	18	65.2 Å²	65.2	19%	0.186	33%	0.332	C	S	.	.			trans	-83.1	168.4	170.1	0	0	0	0	0	112	N355 V392	G353-N355 PolarHBondContact O-N 3.34Å; G353-V392 PolarHBondContact N-O 3.41Å
354	S	86.7	Confident	92.6	Very high	137 Å²	137	65.3 Å²	65.3	96%	0.958	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-10.2	-179.7	54.6	0	0	0	0	114.6	I356	S354-I356 PolarHBondContact O-N 3.42Å
355	N	85.7	Confident	92.5	Very high	108 Å²	108	62.8 Å²	62.8	58%	0.578	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	23.3	-173.6	-167	16.9	0	0	0	113.7	G353 M394	G353-N355 PolarHBondContact O-N 3.34Å; N355-M394 WeakPolarHBondContact O-CB 3.44Å
356	I	91.9	Very high	92.4	Very high	31 Å²	31	63.5 Å²	63.5	16%	0.159	33%	0.326	C	S	.	.			trans	-94.7	113.9	-178.8	-57.7	-178.9	0	0	0	110	L347 T352 S354 I358 M394 L397	L347-I356 HydrophobicContact CD1-CG2 4.06Å; L347-I356 HydrophobicContact CD2-CD1 4.17Å; T352-I356 HydrophobicContact CG2-CD1 3.52Å; S354-I356 PolarHBondContact O-N 3.42Å; I356-I358 HydrophobicContact CG2-CG1 4.11Å; I356-M394 HydrophobicContact CG2-SD 4.22Å; I356-L397 HydrophobicContact CD1-CD1 4.04Å; I356-L397 HydrophobicContact CG1-CD1 4.28Å; I356-L397 HydrophobicContact CG2-CD1 3.87Å
357	D	93.3	Very high	92.2	Very high	76 Å²	76	64.5 Å²	64.5	41%	0.406	35%	0.346	S	S	.	.			trans	-92.1	100	170.6	-175.5	-17.1	0	0	0	109.6	E359 K360 L361 M394	D357-E359 PolarHBondContact OD1-N 3.17Å; D357-K360 HydrophobicContact CB-CB 4.01Å; D357-K360 PolarHBondContact OD1-N 3.24Å; D357-K360 WeakPolarHBondContact OD2-CB 3.39Å; D357-L361 PolarHBondContact O-N 2.84Å; D357-L361 VanDerWaalsContact O-N 3.17Å; D357-M394 WeakPolarHBondContact O-CE 3.48Å
358	I	94.7	Very high	92.1	Very high	40 Å²	40	65.6 Å²	65.6	21%	0.205	35%	0.35	C	S	.	.	H	α-helix	trans	-70.5	-35.4	-176.6	-62.6	162.3	0	0	0	111.1	I340 L343 N344 L347 I356 L361 A362	I340-I358 HydrophobicContact CG1-CG2 4.4Å; I340-I358 HydrophobicContact CG2-CG2 4.17Å; L343-I358 HydrophobicContact CB-CG2 3.98Å; L343-I358 HydrophobicContact CD1-CG2 4.13Å; N344-I358 VanDerWaalsContact OD1-CD1 3.23Å; N344-I358 WeakPolarHBondContact OD1-CD1 3.42Å; L347-I358 HydrophobicContact CD1-CD1 4.46Å; L347-I358 HydrophobicContact CD1-CG1 4.04Å; I356-I358 HydrophobicContact CG2-CG1 4.11Å; I358-L361 PolarHBondContact O-N 3.08Å; I358-A362 WeakPolarHBondContact O-CB 3.23Å; I358-A362 PolarHBondContact O-N 2.83Å
359	E	92.9	Very high	92.2	Very high	121 Å²	121	57.9 Å²	57.9	57%	0.565	32%	0.318	S	S	*	.	H	α-helix	trans	-65.5	-48.7	-179.7	-65.3	-176.1	-179.1	0	0	109.9	Y336 I340 D357 L361 A362 H363	Y336-E359 WeakPolarHBondContact OH-CB 3.37Å; I340-E359 HydrophobicContact CD1-CG 4.49Å; D357-E359 PolarHBondContact OD1-N 3.17Å; E359-L361 VanDerWaalsContact C-N 3.26Å; E359-L361 PolarHBondContact O-N 3.42Å; E359-A362 PolarHBondContact O-N 3.39Å; E359-A362 VanDerWaalsContact O-N 3.11Å; E359-H363 PolarHBondContact O-CD2 3.38Å; E359-H363 PolarHBondContact O-N 3.48Å
360	K	91.9	Very high	92.2	Very high	77 Å²	77	51.3 Å²	51.3	34%	0.335	29%	0.292	S	S	.	.	H	α-helix	trans	-60.8	-36	175.9	-164.8	-179.9	-173.6	168.9	0	112.3	D357 G364 W398 L460	D357-K360 HydrophobicContact CB-CB 4.01Å; D357-K360 PolarHBondContact OD1-N 3.24Å; D357-K360 WeakPolarHBondContact OD2-CB 3.39Å; K360-G364 PolarHBondContact O-N 2.99Å; K360-W398 HydrophobicContact CD-CZ2 4.39Å; K360-W398 HydrophobicContact CG-CZ2 4.06Å; K360-L460 HydrophobicContact CG-CD2 3.75Å
361	L	93.3	Very high	92.2	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-69.7	-40.9	174.9	-169.3	57.7	0	0	0	112	L343 D357 I358 E359 H363 G364 T365 L376 M394 L397 W398	L343-L361 HydrophobicContact CD1-CB 4.19Å; L343-L361 HydrophobicContact CD1-CD2 4.28Å; L343-L361 HydrophobicContact CD1-CG 4.1Å; L343-L361 HydrophobicContact CD2-CD2 3.63Å; L343-L361 HydrophobicContact CD2-CG 4.12Å; D357-L361 PolarHBondContact O-N 2.84Å; D357-L361 VanDerWaalsContact O-N 3.17Å; I358-L361 PolarHBondContact O-N 3.08Å; E359-L361 VanDerWaalsContact C-N 3.26Å; E359-L361 PolarHBondContact O-N 3.42Å; L361-H363 VanDerWaalsContact C-N 3.29Å; L361-H363 PolarHBondContact O-N 2.95Å; L361-G364 CarbonylContact O-C 3.55Å; L361-G364 WeakPolarHBondContact O-CA 3.39Å; L361-G364 PolarHBondContact O-N 3.16Å; L361-T365 HydrophobicContact CD1-CG2 4.36Å; L361-T365 HydrophobicContact CG-CG2 4.48Å; L361-T365 WeakPolarHBondContact O-CG2 3.5Å; L361-T365 PolarHBondContact O-N 3.44Å; L361-T365 VanDerWaalsContact O-N 3.13Å; L361-T365 PolarHBondContact O-OG1 2.9Å; L361-L376 HydrophobicContact CD1-CD2 4.31Å; L361-M394 HydrophobicContact CB-CE 3.93Å; L361-M394 HydrophobicContact CD1-CE 4.35Å; L361-L397 HydrophobicContact CD1-CB 4.44Å; L361-L397 HydrophobicContact CD2-CB 4.21Å; L361-L397 HydrophobicContact CD2-CD1 3.96Å; L361-L397 HydrophobicContact CD2-CD2 4.15Å; L361-L397 HydrophobicContact CD2-CG 4.33Å; L361-W398 HydrophobicContact CD1-CH2 4.29Å; L361-W398 HydrophobicContact CD1-CZ3 4.29Å
362	A	94	Very high	92.3	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-63.2	-34.5	178.5	0	0	0	0	0	112.6	Y336 R339 I340 L343 I358 E359 G364 T365	Y336-A362 HydrophobicContact CD2-CB 4.03Å; Y336-A362 HydrophobicContact CE2-CB 3.75Å; R339-A362 HydrophobicContact CB-CB 4.37Å; R339-A362 PolarHBondContact NE-O 2.73Å; R339-A362 PolarHBondContact NH2-O 3.29Å; I340-A362 HydrophobicContact CG1-CB 3.72Å; L343-A362 HydrophobicContact CD1-CB 3.98Å; I358-A362 WeakPolarHBondContact O-CB 3.23Å; I358-A362 PolarHBondContact O-N 2.83Å; E359-A362 PolarHBondContact O-N 3.39Å; E359-A362 VanDerWaalsContact O-N 3.11Å; A362-G364 VanDerWaalsContact C-N 3.28Å; A362-T365 PolarHBondContact O-OG1 3.06Å
363	H	92	Very high	92.5	Very high	35 Å²	35	43.8 Å²	43.8	16%	0.162	26%	0.262	C	S	.	.	H	α-helix	trans	-67	-28.8	168.4	-71.3	-56.4	0	0	0	112.7	Y336 E359 L361 V366 L460 Q461 E462	Y336-H363 AromaticContact CD2-CE1 3.88Å; Y336-H363 AromaticContact CE2-CD2 3.94Å; Y336-H363 AromaticContact CE2-CE1 3.31Å; Y336-H363 WeakPolarHBondContact CE2-CE1 3.18Å; Y336-H363 AromaticContact CE2-ND1 3.69Å; Y336-H363 AromaticContact CE2-NE2 3.49Å; Y336-H363 WeakPolarHBondContact CE2-NE2 3.43Å; Y336-H363 AromaticContact CZ-CE1 3.82Å; Y336-H363 AromaticContact CZ-NE2 3.73Å; Y336-H363 PolarHBondContact OH-NE2 3.05Å; E359-H363 PolarHBondContact O-CD2 3.38Å; E359-H363 PolarHBondContact O-N 3.48Å; L361-H363 VanDerWaalsContact C-N 3.29Å; L361-H363 PolarHBondContact O-N 2.95Å; H363-V366 WeakPolarHBondContact O-CG2 3.16Å; H363-L460 HydrophobicContact CB-CD1 3.56Å; H363-L460 HydrophobicContact CB-CD2 4.4Å; H363-L460 HydrophobicContact CB-CG 3.96Å; H363-L460 VanDerWaalsContact O-CD1 3.29Å; H363-L460 WeakPolarHBondContact O-CD1 3.18Å; H363-Q461 WeakPolarHBondContact CB-O 3.15Å; H363-Q461 PolarHBondContact ND1-O 3.42Å; H363-E462 VanDerWaalsContact CE1-C 3.49Å; H363-E462 PolarHBondContact CE1-O 2.64Å; H363-E462 PolarHBondContact ND1-O 3.3Å; H363-E462 PolarHBondContact NE2-O 2.92Å
364	G	91.3	Very high	92.8	Very high	3 Å²	3	47.7 Å²	47.7	3%	0.031	28%	0.275	C	S	.	.	H	α-helix	trans	-80.3	-17.3	-179.1	0	0	0	0	0	113.8	K360 L361 A362 R401	K360-G364 PolarHBondContact O-N 2.99Å; L361-G364 CarbonylContact O-C 3.55Å; L361-G364 WeakPolarHBondContact O-CA 3.39Å; L361-G364 PolarHBondContact O-N 3.16Å; A362-G364 VanDerWaalsContact C-N 3.28Å; G364-R401 PolarHBondContact O-NE 2.77Å; G364-R401 PolarHBondContact O-NH2 3.5Å
365	T	92.7	Very high	93.2	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.6	32.8	-174.1	60.8	0	0	0	0	112.4	R339 L361 A362 G367 Y368 L376	R339-T365 WeakPolarHBondContact CD-O 3.39Å; R339-T365 PolarHBondContact NE-O 2.99Å; L361-T365 HydrophobicContact CD1-CG2 4.36Å; L361-T365 HydrophobicContact CG-CG2 4.48Å; L361-T365 WeakPolarHBondContact O-CG2 3.5Å; L361-T365 PolarHBondContact O-N 3.44Å; L361-T365 VanDerWaalsContact O-N 3.13Å; L361-T365 PolarHBondContact O-OG1 2.9Å; A362-T365 PolarHBondContact O-OG1 3.06Å; T365-G367 PolarHBondContact O-N 2.92Å; T365-Y368 HydrophobicContact CG2-CD1 3.98Å; T365-Y368 HydrophobicContact CG2-CE1 4.09Å; T365-Y368 HydrophobicContact CG2-CG 4.29Å; T365-Y368 VanDerWaalsContact O-CB 3.28Å; T365-Y368 WeakPolarHBondContact O-CB 3.29Å; T365-Y368 PolarHBondContact O-N 3.16Å; T365-Y368 VanDerWaalsContact O-N 3.14Å; T365-L376 HydrophobicContact CG2-CD2 3.68Å
366	V	90.9	Very high	93.8	Very high	67 Å²	67	38.8 Å²	38.8	41%	0.406	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	133.4	174.4	-178.6	0	0	0	0	109.8	H363 Y368	H363-V366 WeakPolarHBondContact O-CG2 3.16Å; V366-Y368 VanDerWaalsContact C-N 3.27Å; V366-Y368 PolarHBondContact O-N 3.37Å
367	G	89.9	Confident	94.1	Very high	53 Å²	53	37.5 Å²	37.5	55%	0.546	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.8	-4.4	-177.9	0	0	0	0	0	115.2	T365	T365-G367 PolarHBondContact O-N 2.92Å
368	Y	94.3	Very high	94.2	Very high	32 Å²	32	37.9 Å²	37.9	13%	0.125	21%	0.212	C	C	.	.			trans	-71.7	140	177.8	-79.4	-137	0	0	0	110.7	P334 T365 V366 D372 L404	P334-Y368 VanDerWaalsContact CD-O 3.29Å; P334-Y368 WeakPolarHBondContact CD-O 3.14Å; P334-Y368 WeakPolarHBondContact CG-O 3.48Å; T365-Y368 HydrophobicContact CG2-CD1 3.98Å; T365-Y368 HydrophobicContact CG2-CE1 4.09Å; T365-Y368 HydrophobicContact CG2-CG 4.29Å; T365-Y368 VanDerWaalsContact O-CB 3.28Å; T365-Y368 WeakPolarHBondContact O-CB 3.29Å; T365-Y368 PolarHBondContact O-N 3.16Å; T365-Y368 VanDerWaalsContact O-N 3.14Å; V366-Y368 VanDerWaalsContact C-N 3.27Å; V366-Y368 PolarHBondContact O-N 3.37Å; Y368-D372 HydrophobicContact CD1-CB 3.68Å; Y368-D372 HydrophobicContact CE1-CB 4.44Å; Y368-D372 HydrophobicContact CG-CB 4.05Å; Y368-L404 HydrophobicContact CD1-CD2 4.45Å; Y368-L404 HydrophobicContact CE1-CD2 3.61Å
369	T	95.1	Very high	94.3	Very high	12 Å²	12	37.9 Å²	37.9	7%	0.074	21%	0.211	C	C	.	.			trans	-85.5	170	173.1	70.6	0	0	0	0	111.5	P208 V210 A371 D372 I373	P208-T369 WeakPolarHBondContact O-CG2 3.44Å; V210-T369 HydrophobicContact CG1-CG2 4.02Å; T369-A371 PolarHBondContact O-N 2.98Å; T369-D372 WeakPolarHBondContact CB-OD2 3.31Å; T369-D372 WeakPolarHBondContact CG2-OD2 3.44Å; T369-D372 PolarHBondContact N-OD2 2.96Å; T369-D372 PolarHBondContact O-N 3.24Å; T369-D372 VanDerWaalsContact O-N 3.1Å; T369-D372 PolarHBondContact OG1-N 2.96Å; T369-D372 PolarHBondContact OG1-OD2 3.4Å; T369-I373 WeakPolarHBondContact O-CG1 3.45Å; T369-I373 PolarHBondContact O-N 3.29Å
370	G	94.1	Very high	94.5	Very high	10 Å²	10	32.1 Å²	32.1	10%	0.103	18%	0.184	C	C	.	.	H	α-helix	trans	-58.7	-35.6	176.1	0	0	0	0	0	112.8	G209 Q374	G209-G370 PolarHBondContact O-N 3.15Å; G370-Q374 WeakPolarHBondContact O-CB 3.34Å; G370-Q374 PolarHBondContact O-N 3.01Å
371	A	95	Very high	94.7	Very high	42 Å²	42	29.5 Å²	29.5	35%	0.347	18%	0.177	S	C	.	.	H	α-helix	trans	-67.5	-39.8	173.9	0	0	0	0	0	112.5	G209 T369 Q374 N375	G209-A371 PolarHBondContact O-N 3.44Å; T369-A371 PolarHBondContact O-N 2.98Å; A371-Q374 PolarHBondContact O-N 3.35Å; A371-N375 WeakPolarHBondContact O-CB 3.35Å; A371-N375 PolarHBondContact O-N 3.47Å
372	D	95.8	Very high	94.8	Very high	58 Å²	58	32.7 Å²	32.7	31%	0.31	19%	0.193	S	C	.	.	H	α-helix	trans	-65.8	-41.8	177.7	-59.3	-46.5	0	0	0	111.4	Y368 T369 N375 L376	Y368-D372 HydrophobicContact CD1-CB 3.68Å; Y368-D372 HydrophobicContact CE1-CB 4.44Å; Y368-D372 HydrophobicContact CG-CB 4.05Å; T369-D372 WeakPolarHBondContact CB-OD2 3.31Å; T369-D372 WeakPolarHBondContact CG2-OD2 3.44Å; T369-D372 PolarHBondContact N-OD2 2.96Å; T369-D372 PolarHBondContact O-N 3.24Å; T369-D372 VanDerWaalsContact O-N 3.1Å; T369-D372 PolarHBondContact OG1-N 2.96Å; T369-D372 PolarHBondContact OG1-OD2 3.4Å; D372-N375 PolarHBondContact O-N 3.49Å; D372-L376 WeakPolarHBondContact O-CB 3.48Å; D372-L376 PolarHBondContact O-N 3.07Å
373	I	96.7	Very high	94.8	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-64.6	-42.6	176.1	-65	174.6	0	0	0	110.7	R339 L342 L343 Y346 T369 N375 L376 V377	R339-I373 HydrophobicContact CB-CD1 4.14Å; R339-I373 HydrophobicContact CG-CD1 3.95Å; L342-I373 HydrophobicContact CB-CD1 4.04Å; L342-I373 HydrophobicContact CB-CG2 4.31Å; L342-I373 HydrophobicContact CD1-CD1 4.09Å; L343-I373 HydrophobicContact CD2-CG2 3.66Å; L343-I373 HydrophobicContact CG-CG2 3.99Å; Y346-I373 HydrophobicContact CD2-CG2 3.98Å; T369-I373 WeakPolarHBondContact O-CG1 3.45Å; T369-I373 PolarHBondContact O-N 3.29Å; I373-N375 VanDerWaalsContact C-N 3.33Å; I373-N375 PolarHBondContact O-N 3.46Å; I373-L376 WeakPolarHBondContact O-CB 3.28Å; I373-L376 PolarHBondContact O-N 3.25Å; I373-V377 WeakPolarHBondContact O-CG2 3.29Å; I373-V377 PolarHBondContact O-N 3.36Å; I373-V377 VanDerWaalsContact O-N 3.07Å
374	Q	96.1	Very high	95	Very high	99 Å²	99	31.8 Å²	31.8	46%	0.463	19%	0.192	S	C	.	.	H	α-helix	trans	-58.6	-46.8	174.4	-175.4	178	10.7	0	0	111.3	Y346 G370 A371 V377 N378	Y346-Q374 HydrophobicContact CD1-CB 4.15Å; Y346-Q374 HydrophobicContact CD1-CG 3.88Å; Y346-Q374 HydrophobicContact CD2-CB 4.22Å; Y346-Q374 HydrophobicContact CE1-CB 3.75Å; Y346-Q374 HydrophobicContact CE1-CG 3.53Å; Y346-Q374 HydrophobicContact CE2-CB 3.82Å; Y346-Q374 HydrophobicContact CG-CB 4.38Å; G370-Q374 WeakPolarHBondContact O-CB 3.34Å; G370-Q374 PolarHBondContact O-N 3.01Å; A371-Q374 PolarHBondContact O-N 3.35Å; Q374-V377 PolarHBondContact O-N 3.03Å; Q374-N378 WeakPolarHBondContact O-CB 3.27Å; Q374-N378 PolarHBondContact O-N 3.13Å
375	N	96.5	Very high	95.2	Very high	57 Å²	57	34.8 Å²	34.8	31%	0.305	22%	0.217	S	C	.	.	H	α-helix	trans	-65.2	-41.1	178.9	-172.9	36	0	0	0	111.4	A371 D372 I373 V377 N378 Q379 L404	A371-N375 WeakPolarHBondContact O-CB 3.35Å; A371-N375 PolarHBondContact O-N 3.47Å; D372-N375 PolarHBondContact O-N 3.49Å; I373-N375 VanDerWaalsContact C-N 3.33Å; I373-N375 PolarHBondContact O-N 3.46Å; N375-V377 PolarHBondContact O-N 3.32Å; N375-N378 PolarHBondContact O-N 3.35Å; N375-Q379 WeakPolarHBondContact O-CB 3.48Å; N375-Q379 VanDerWaalsContact O-CG 3.28Å; N375-Q379 WeakPolarHBondContact O-CG 3.29Å; N375-Q379 PolarHBondContact O-N 2.94Å; N375-Q379 PolarHBondContact OD1-NE2 2.93Å; N375-L404 WeakPolarHBondContact ND2-CD1 3.28Å
376	L	97.3	Very high	95.3	Very high	1 Å²	1	41.1 Å²	41.1	1%	0.005	25%	0.25	C	C	.	.	H	α-helix	trans	-55.2	-52.3	175.7	175.7	69.8	0	0	0	111.7	L361 T365 D372 I373 N378 Q379 A380 A400 R401	L361-L376 HydrophobicContact CD1-CD2 4.31Å; T365-L376 HydrophobicContact CG2-CD2 3.68Å; D372-L376 WeakPolarHBondContact O-CB 3.48Å; D372-L376 PolarHBondContact O-N 3.07Å; I373-L376 WeakPolarHBondContact O-CB 3.28Å; I373-L376 PolarHBondContact O-N 3.25Å; L376-N378 VanDerWaalsContact C-N 3.33Å; L376-N378 PolarHBondContact O-N 2.9Å; L376-Q379 PolarHBondContact O-N 3.44Å; L376-A380 PolarHBondContact O-N 3.44Å; L376-A400 HydrophobicContact CD1-CB 3.91Å; L376-R401 VanDerWaalsContact CD1-CA 3.48Å; L376-R401 HydrophobicContact CD1-CB 3.73Å; L376-R401 VanDerWaalsContact CD1-N 3.28Å
377	V	97.5	Very high	95.4	Very high	4 Å²	4	43.6 Å²	43.6	2%	0.024	25%	0.252	C	S	.	.	H	α-helix	trans	-63.9	-40.5	179.5	175.6	0	0	0	0	110.9	L343 L347 V350 I373 Q374 N375 A380 A381 L397	L343-V377 HydrophobicContact CD2-CG2 4.47Å; L347-V377 HydrophobicContact CD2-CG1 4.13Å; L347-V377 HydrophobicContact CD2-CG2 4.21Å; L347-V377 HydrophobicContact CG-CG2 4.34Å; V350-V377 HydrophobicContact CG1-CG1 4.31Å; V350-V377 HydrophobicContact CG2-CG1 3.83Å; I373-V377 WeakPolarHBondContact O-CG2 3.29Å; I373-V377 PolarHBondContact O-N 3.36Å; I373-V377 VanDerWaalsContact O-N 3.07Å; Q374-V377 PolarHBondContact O-N 3.03Å; N375-V377 PolarHBondContact O-N 3.32Å; V377-A380 PolarHBondContact O-N 3.46Å; V377-A381 PolarHBondContact O-N 3.36Å; V377-L397 HydrophobicContact CG2-CD2 4.43Å
378	N	97	Very high	95.6	Very high	84 Å²	84	48 Å²	48	45%	0.449	26%	0.263	S	S	.	.	H	α-helix	trans	-63.6	-44.4	176.8	-175	52.3	0	0	0	112.4	Q374 N375 L376 A380 A381 I382	Q374-N378 WeakPolarHBondContact O-CB 3.27Å; Q374-N378 PolarHBondContact O-N 3.13Å; N375-N378 PolarHBondContact O-N 3.35Å; L376-N378 VanDerWaalsContact C-N 3.33Å; L376-N378 PolarHBondContact O-N 2.9Å; N378-A380 VanDerWaalsContact C-N 3.31Å; N378-A380 PolarHBondContact O-N 3.02Å; N378-A381 PolarHBondContact O-N 2.81Å; N378-I382 VanDerWaalsContact O-CG1 3.31Å; N378-I382 WeakPolarHBondContact O-CG1 3.35Å; N378-I382 PolarHBondContact O-N 2.91Å
379	Q	96.1	Very high	95.6	Very high	40 Å²	40	49.5 Å²	49.5	19%	0.187	27%	0.273	C	S	.	.	H	α-helix	trans	-63.3	-37.8	176.5	-69.7	-59.1	-37.3	0	0	111.8	N375 L376 I382 A383 A400	N375-Q379 WeakPolarHBondContact O-CB 3.48Å; N375-Q379 VanDerWaalsContact O-CG 3.28Å; N375-Q379 WeakPolarHBondContact O-CG 3.29Å; N375-Q379 PolarHBondContact O-N 2.94Å; N375-Q379 PolarHBondContact OD1-NE2 2.93Å; L376-Q379 PolarHBondContact O-N 3.44Å; Q379-I382 PolarHBondContact O-N 3.31Å; Q379-A383 WeakPolarHBondContact O-CB 3.49Å; Q379-A383 PolarHBondContact O-N 3.34Å; Q379-A400 HydrophobicContact CB-CB 3.84Å
380	A	96.8	Very high	95.5	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-65.3	-41.3	174.9	0	0	0	0	0	111.8	L376 V377 N378 A383 A384 V392 H396 L397 A400	L376-A380 PolarHBondContact O-N 3.44Å; V377-A380 PolarHBondContact O-N 3.46Å; N378-A380 VanDerWaalsContact C-N 3.31Å; N378-A380 PolarHBondContact O-N 3.02Å; A380-A383 PolarHBondContact O-N 2.81Å; A380-A384 PolarHBondContact O-N 3.1Å; A380-V392 HydrophobicContact CB-CG1 3.93Å; A380-H396 HydrophobicContact CB-CB 4.2Å; A380-L397 HydrophobicContact CB-CD2 3.6Å; A380-L397 HydrophobicContact CB-CG 4.01Å; A380-A400 HydrophobicContact CB-CB 3.86Å
381	A	96.7	Very high	95.6	Very high	22 Å²	22	58 Å²	58	18%	0.182	32%	0.316	C	S	.	.	H	α-helix	trans	-63.9	-42.2	175.3	0	0	0	0	0	112.4	V350 V377 N378 A383 A384 A385 V392	V350-A381 HydrophobicContact CG1-CB 4.01Å; V377-A381 PolarHBondContact O-N 3.36Å; N378-A381 PolarHBondContact O-N 2.81Å; A381-A383 VanDerWaalsContact C-N 3.34Å; A381-A384 PolarHBondContact O-N 3.3Å; A381-A385 WeakPolarHBondContact O-CB 3.28Å; A381-A385 PolarHBondContact O-N 2.65Å; A381-V392 HydrophobicContact CB-CG2 4.04Å
382	I	95.8	Very high	95.7	Very high	67 Å²	67	56.3 Å²	56.3	34%	0.344	30%	0.302	S	S	.	.	H	α-helix	trans	-62.2	-42.8	174.2	-67.4	165.1	0	0	0	110.5	N378 Q379 A385 L386	N378-I382 VanDerWaalsContact O-CG1 3.31Å; N378-I382 WeakPolarHBondContact O-CG1 3.35Å; N378-I382 PolarHBondContact O-N 2.91Å; Q379-I382 PolarHBondContact O-N 3.31Å; I382-A385 PolarHBondContact O-N 3.41Å; I382-L386 HydrophobicContact CG2-CD1 3.83Å; I382-L386 HydrophobicContact CG2-CG 4.25Å; I382-L386 WeakPolarHBondContact O-CB 3.35Å; I382-L386 VanDerWaalsContact O-CG 3.25Å; I382-L386 WeakPolarHBondContact O-CG 3.1Å; I382-L386 PolarHBondContact O-N 2.74Å
383	A	93.6	Very high	95.6	Very high	14 Å²	14	57 Å²	57	12%	0.116	30%	0.303	C	S	.	.	H	α-helix	trans	-62.6	-45	178.8	0	0	0	0	0	112.3	Q379 A380 A381 L386 R387	Q379-A383 WeakPolarHBondContact O-CB 3.49Å; Q379-A383 PolarHBondContact O-N 3.34Å; A380-A383 PolarHBondContact O-N 2.81Å; A381-A383 VanDerWaalsContact C-N 3.34Å; A383-L386 PolarHBondContact O-N 2.84Å; A383-R387 WeakPolarHBondContact O-CG 3.43Å; A383-R387 PolarHBondContact O-N 3.43Å; A383-R387 VanDerWaalsContact O-N 3.13Å
384	A	95.7	Very high	95.5	Very high	3 Å²	3	57.8 Å²	57.8	3%	0.025	31%	0.307	C	S	.	.	H	α-helix	trans	-61.4	-45.8	175.3	0	0	0	0	0	111.4	A380 A381 L386 R387 N388 D389 V392	A380-A384 PolarHBondContact O-N 3.1Å; A381-A384 PolarHBondContact O-N 3.3Å; A384-L386 PolarHBondContact O-N 3.05Å; A384-R387 PolarHBondContact O-N 3.29Å; A384-R387 VanDerWaalsContact O-N 3.15Å; A384-N388 PolarHBondContact O-N 3.14Å; A384-N388 VanDerWaalsContact O-N 3.16Å; A384-D389 HydrophobicContact CB-CB 4.29Å; A384-D389 PolarHBondContact O-N 2.91Å; A384-V392 HydrophobicContact CB-CG2 4.14Å
385	A	95.6	Very high	95.3	Very high	65 Å²	65	57.1 Å²	57.1	54%	0.537	30%	0.304	S	S	.	.	H	α-helix	trans	-61.7	-40.6	177.4	0	0	0	0	0	112.5	A381 I382 R387 N388	A381-A385 WeakPolarHBondContact O-CB 3.28Å; A381-A385 PolarHBondContact O-N 2.65Å; I382-A385 PolarHBondContact O-N 3.41Å; A385-R387 VanDerWaalsContact C-N 3.27Å; A385-R387 PolarHBondContact O-N 3.33Å; A385-N388 PolarHBondContact O-N 2.9Å; A385-N388 VanDerWaalsContact O-N 3.13Å
386	L	94.2	Very high	95.3	Very high	133 Å²	133	54.4 Å²	54.4	70%	0.696	29%	0.289	S	S	*	.	H	α-helix	trans	-67.1	-26.6	177	-73.6	172.6	0	0	0	113.2	I382 A383 A384 N388	I382-L386 HydrophobicContact CG2-CD1 3.83Å; I382-L386 HydrophobicContact CG2-CG 4.25Å; I382-L386 WeakPolarHBondContact O-CB 3.35Å; I382-L386 VanDerWaalsContact O-CG 3.25Å; I382-L386 WeakPolarHBondContact O-CG 3.1Å; I382-L386 PolarHBondContact O-N 2.74Å; A383-L386 PolarHBondContact O-N 2.84Å; A384-L386 PolarHBondContact O-N 3.05Å; L386-N388 VanDerWaalsContact C-N 3.32Å
387	R	93.4	Very high	95.2	Very high	120 Å²	120	54.3 Å²	54.3	45%	0.453	29%	0.289	S	S	.	.	H	α-helix	trans	-85.9	-4.5	174.3	-70.4	178.5	-178.1	153	8	113.3	A383 A384 A385 D389 H396 D399	A383-R387 WeakPolarHBondContact O-CG 3.43Å; A383-R387 PolarHBondContact O-N 3.43Å; A383-R387 VanDerWaalsContact O-N 3.13Å; A384-R387 PolarHBondContact O-N 3.29Å; A384-R387 VanDerWaalsContact O-N 3.15Å; A385-R387 VanDerWaalsContact C-N 3.27Å; A385-R387 PolarHBondContact O-N 3.33Å; R387-D389 VanDerWaalsContact CB-OD2 3.28Å; R387-D389 WeakPolarHBondContact CB-OD2 3.41Å; R387-D389 PolarHBondContact O-N 2.78Å; R387-H396 PolarHBondContact NH1-CD2 2.92Å; R387-H396 VanDerWaalsContact NH1-CD2 3.33Å; R387-H396 PolarHBondContact NH1-NE2 3.34Å; R387-D399 IonicContact CZ-OD2 3.83Å; R387-D399 IonicContact NH1-OD2 3.08Å; R387-D399 IonicContact NH2-OD2 3.68Å; R387-D399 PolarHBondContact NH2-OD2 2.69Å
388	N	94.5	Very high	95	Very high	146 Å²	146	55.4 Å²	55.4	78%	0.781	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.8	27.9	-169.4	-52.9	-68.3	0	0	0	113.4	A384 A385 L386	A384-N388 PolarHBondContact O-N 3.14Å; A384-N388 VanDerWaalsContact O-N 3.16Å; A385-N388 PolarHBondContact O-N 2.9Å; A385-N388 VanDerWaalsContact O-N 3.13Å; L386-N388 VanDerWaalsContact C-N 3.32Å
389	D	94.4	Very high	94.7	Very high	63 Å²	63	52.9 Å²	52.9	34%	0.337	28%	0.279	S	S	.	.			trans	-77.9	133.3	174.6	-66.9	-38.7	0	0	0	109.8	A384 R387 F391 H396	A384-D389 HydrophobicContact CB-CB 4.29Å; A384-D389 PolarHBondContact O-N 2.91Å; R387-D389 VanDerWaalsContact CB-OD2 3.28Å; R387-D389 WeakPolarHBondContact CB-OD2 3.41Å; R387-D389 PolarHBondContact O-N 2.78Å; D389-F391 VanDerWaalsContact C-N 3.26Å; D389-F391 PolarHBondContact O-N 2.85Å; D389-H396 IonicContact OD2-CE1 2.68Å; D389-H396 PolarHBondContact OD2-CE1 3.2Å; D389-H396 IonicContact OD2-NE2 2.97Å; D389-H396 PolarHBondContact OD2-NE2 3.43Å
390	P	93.5	Very high	94.7	Very high	98 Å²	98	51.2 Å²	51.2	64%	0.636	27%	0.272	S	S	*	.	S	Bend	trans	-71.7	-20.2	-175.2	26.2	-32.9	0	0	0	113.6
391	F	95.9	Very high	94.5	Very high	101 Å²	101	52.2 Å²	52.2	44%	0.443	28%	0.276	S	S	.	.	S	Bend	trans	-137.2	147.9	-176.4	-55.8	-77.4	0	0	0	111	K351 D389	K351-F391 HydrophobicContact CB-CD1 4.08Å; D389-F391 VanDerWaalsContact C-N 3.26Å; D389-F391 PolarHBondContact O-N 2.85Å
392	V	96.2	Very high	94.2	Very high	7 Å²	7	51.5 Å²	51.5	4%	0.042	27%	0.269	C	S	.	.	B	Isolated β-bridge	trans	-74.2	129.1	167.2	-176.1	0	0	0	0	108.5	V350 K351 G353 A380 A381 A384 H396 L397	V350-V392 HydrophobicContact CG2-CG2 4.44Å; K351-V392 PolarHBondContact O-N 2.69Å; G353-V392 PolarHBondContact N-O 3.41Å; A380-V392 HydrophobicContact CB-CG1 3.93Å; A381-V392 HydrophobicContact CB-CG2 4.04Å; A384-V392 HydrophobicContact CB-CG2 4.14Å; V392-H396 HydrophobicContact CG1-CB 4.12Å; V392-L397 HydrophobicContact CG1-CG 4.24Å
393	E	95	Very high	93.9	Very high	73 Å²	73	53.1 Å²	53.1	34%	0.341	27%	0.271	S	S	.	.			trans	-120.2	170.4	-179.6	-65.4	-164	152.4	0	0	110.9	H395 H396 L397	E393-H395 VanDerWaalsContact C-N 3.27Å; E393-H395 PolarHBondContact O-N 3.43Å; E393-H395 IonicContact OE2-CE1 3.17Å; E393-H395 PolarHBondContact OE2-CE1 2.92Å; E393-H395 IonicContact OE2-ND1 2.83Å; E393-H395 PolarHBondContact OE2-ND1 3.21Å; E393-H395 VanDerWaalsContact OE2-ND1 3.07Å; E393-H396 PolarHBondContact N-ND1 3.37Å; E393-H396 VanDerWaalsContact O-CB 3.29Å; E393-H396 WeakPolarHBondContact O-CB 3.4Å; E393-H396 PolarHBondContact O-N 2.93Å; E393-L397 PolarHBondContact O-N 3.24Å
394	M	94.4	Very high	93.7	Very high	17 Å²	17	55.5 Å²	55.5	8%	0.084	28%	0.281	C	S	.	.	H	α-helix	trans	-58.5	-37.4	-177.5	-163	65.2	-173	0	0	113.6	N355 I356 D357 L361 H396 L397 W398	N355-M394 WeakPolarHBondContact O-CB 3.44Å; I356-M394 HydrophobicContact CG2-SD 4.22Å; D357-M394 WeakPolarHBondContact O-CE 3.48Å; L361-M394 HydrophobicContact CB-CE 3.93Å; L361-M394 HydrophobicContact CD1-CE 4.35Å; M394-H396 VanDerWaalsContact C-N 3.26Å; M394-H396 PolarHBondContact O-N 2.81Å; M394-L397 PolarHBondContact O-N 3.4Å; M394-L397 VanDerWaalsContact O-N 3.17Å; M394-L397 HydrophobicContact SD-CD1 4.35Å; M394-W398 HydrophobicContact CE-CD2 4.41Å; M394-W398 HydrophobicContact CE-CH2 4.47Å; M394-W398 HydrophobicContact CE-CZ2 3.41Å; M394-W398 VanDerWaalsContact CE-CZ2 3.41Å; M394-W398 VanDerWaalsContact O-CD1 3.24Å; M394-W398 PolarHBondContact O-N 3.48Å
395	H	92.2	Very high	93.3	Very high	84 Å²	84	59.8 Å²	59.8	39%	0.389	30%	0.302	S	S	.	.	H	α-helix	trans	-65.7	-31.3	179.2	73.2	-94.9	0	0	0	111.9	E393 D399	E393-H395 VanDerWaalsContact C-N 3.27Å; E393-H395 PolarHBondContact O-N 3.43Å; E393-H395 IonicContact OE2-CE1 3.17Å; E393-H395 PolarHBondContact OE2-CE1 2.92Å; E393-H395 IonicContact OE2-ND1 2.83Å; E393-H395 PolarHBondContact OE2-ND1 3.21Å; E393-H395 VanDerWaalsContact OE2-ND1 3.07Å; H395-D399 VanDerWaalsContact O-CB 3.3Å; H395-D399 WeakPolarHBondContact O-CB 3.38Å; H395-D399 PolarHBondContact O-N 3.19Å
396	H	95.1	Very high	92.8	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-66	-40.5	172.3	-65.9	115.1	0	0	0	112.3	A380 R387 D389 V392 E393 M394 D399 A400	A380-H396 HydrophobicContact CB-CB 4.2Å; R387-H396 PolarHBondContact NH1-CD2 2.92Å; R387-H396 VanDerWaalsContact NH1-CD2 3.33Å; R387-H396 PolarHBondContact NH1-NE2 3.34Å; D389-H396 IonicContact OD2-CE1 2.68Å; D389-H396 PolarHBondContact OD2-CE1 3.2Å; D389-H396 IonicContact OD2-NE2 2.97Å; D389-H396 PolarHBondContact OD2-NE2 3.43Å; V392-H396 HydrophobicContact CG1-CB 4.12Å; E393-H396 PolarHBondContact N-ND1 3.37Å; E393-H396 VanDerWaalsContact O-CB 3.29Å; E393-H396 WeakPolarHBondContact O-CB 3.4Å; E393-H396 PolarHBondContact O-N 2.93Å; M394-H396 VanDerWaalsContact C-N 3.26Å; M394-H396 PolarHBondContact O-N 2.81Å; H396-D399 PolarHBondContact O-N 3.45Å; H396-A400 VanDerWaalsContact O-CB 3.27Å; H396-A400 WeakPolarHBondContact O-CB 2.96Å; H396-A400 PolarHBondContact O-N 3.44Å
397	L	96.1	Very high	92.5	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-67.9	-42.5	178.5	-69.5	159.6	0	0	0	111.5	L347 I356 L361 V377 A380 V392 E393 M394 A400 R401	L347-L397 HydrophobicContact CD2-CD1 4.23Å; L347-L397 HydrophobicContact CD2-CD2 4.28Å; I356-L397 HydrophobicContact CD1-CD1 4.04Å; I356-L397 HydrophobicContact CG1-CD1 4.28Å; I356-L397 HydrophobicContact CG2-CD1 3.87Å; L361-L397 HydrophobicContact CD1-CB 4.44Å; L361-L397 HydrophobicContact CD2-CB 4.21Å; L361-L397 HydrophobicContact CD2-CD1 3.96Å; L361-L397 HydrophobicContact CD2-CD2 4.15Å; L361-L397 HydrophobicContact CD2-CG 4.33Å; V377-L397 HydrophobicContact CG2-CD2 4.43Å; A380-L397 HydrophobicContact CB-CD2 3.6Å; A380-L397 HydrophobicContact CB-CG 4.01Å; V392-L397 HydrophobicContact CG1-CG 4.24Å; E393-L397 PolarHBondContact O-N 3.24Å; M394-L397 PolarHBondContact O-N 3.4Å; M394-L397 VanDerWaalsContact O-N 3.17Å; M394-L397 HydrophobicContact SD-CD1 4.35Å; L397-A400 PolarHBondContact O-N 3.29Å; L397-R401 PolarHBondContact O-N 3.33Å
398	W	93.2	Very high	92.2	Very high	26 Å²	26	51.2 Å²	51.2	10%	0.098	27%	0.267	C	S	.	.	H	α-helix	trans	-65.6	-40.9	174.8	-72.7	124.2	0	0	0	112.8	K360 L361 M394 A400 R401 D402 H443	K360-W398 HydrophobicContact CD-CZ2 4.39Å; K360-W398 HydrophobicContact CG-CZ2 4.06Å; L361-W398 HydrophobicContact CD1-CH2 4.29Å; L361-W398 HydrophobicContact CD1-CZ3 4.29Å; M394-W398 HydrophobicContact CE-CD2 4.41Å; M394-W398 HydrophobicContact CE-CH2 4.47Å; M394-W398 HydrophobicContact CE-CZ2 3.41Å; M394-W398 VanDerWaalsContact CE-CZ2 3.41Å; M394-W398 VanDerWaalsContact O-CD1 3.24Å; M394-W398 PolarHBondContact O-N 3.48Å; W398-A400 VanDerWaalsContact C-N 3.34Å; W398-R401 PolarHBondContact O-N 3.17Å; W398-D402 VanDerWaalsContact O-CG 3.25Å; W398-D402 PolarHBondContact O-N 3.18Å; W398-H443 AromaticContact CD2-NE2 3.59Å; W398-H443 AromaticContact CE2-CE1 3.66Å; W398-H443 AromaticContact CE2-NE2 3.54Å; W398-H443 AromaticContact CE3-NE2 3.58Å; W398-H443 AromaticContact CH2-CE1 3.64Å; W398-H443 AromaticContact CH2-NE2 3.57Å; W398-H443 AromaticContact CZ2-CE1 3.4Å; W398-H443 WeakPolarHBondContact CZ2-CE1 3.4Å; W398-H443 AromaticContact CZ2-NE2 3.57Å; W398-H443 AromaticContact CZ3-NE2 3.57Å
399	D	91.3	Very high	91.6	Very high	32 Å²	32	46.5 Å²	46.5	17%	0.171	25%	0.248	C	C	.	.	H	α-helix	trans	-65	-39.2	176.1	-171.4	23.7	0	0	0	111.5	R387 H395 H396 D402 R403 R450	R387-D399 IonicContact CZ-OD2 3.83Å; R387-D399 IonicContact NH1-OD2 3.08Å; R387-D399 IonicContact NH2-OD2 3.68Å; R387-D399 PolarHBondContact NH2-OD2 2.69Å; H395-D399 VanDerWaalsContact O-CB 3.3Å; H395-D399 WeakPolarHBondContact O-CB 3.38Å; H395-D399 PolarHBondContact O-N 3.19Å; H396-D399 PolarHBondContact O-N 3.45Å; D399-D402 PolarHBondContact O-N 3.42Å; D399-R403 VanDerWaalsContact O-CB 3.28Å; D399-R403 WeakPolarHBondContact O-CB 3.33Å; D399-R403 PolarHBondContact O-N 3.04Å; D399-R450 IonicContact OD1-CZ 2.85Å; D399-R450 IonicContact OD1-NH1 3.89Å; D399-R450 PolarHBondContact OD1-NH1 3.09Å; D399-R450 IonicContact OD1-NH2 3.91Å; D399-R450 PolarHBondContact OD1-NH2 3.09Å
400	A	94.5	Very high	91	Very high	4 Å²	4	49 Å²	49	3%	0.033	26%	0.255	C	S	.	.	H	α-helix	trans	-63.7	-40.3	174	0	0	0	0	0	112.6	L376 Q379 A380 H396 L397 W398 R403 L404	L376-A400 HydrophobicContact CD1-CB 3.91Å; Q379-A400 HydrophobicContact CB-CB 3.84Å; A380-A400 HydrophobicContact CB-CB 3.86Å; H396-A400 VanDerWaalsContact O-CB 3.27Å; H396-A400 WeakPolarHBondContact O-CB 2.96Å; H396-A400 PolarHBondContact O-N 3.44Å; L397-A400 PolarHBondContact O-N 3.29Å; W398-A400 VanDerWaalsContact C-N 3.34Å; A400-R403 PolarHBondContact O-N 3.5Å; A400-L404 PolarHBondContact O-N 3.32Å
401	R	93.3	Very high	89.7	Confident	22 Å²	22	56.1 Å²	56.1	8%	0.083	27%	0.27	C	S	.	.	H	α-helix	trans	-62.1	-50.3	174.5	-178.5	-170.7	176.4	-125.5	7.6	111.1	G364 L376 L397 W398 R403 L404 I405 S458	G364-R401 PolarHBondContact O-NE 2.77Å; G364-R401 PolarHBondContact O-NH2 3.5Å; L376-R401 VanDerWaalsContact CD1-CA 3.48Å; L376-R401 HydrophobicContact CD1-CB 3.73Å; L376-R401 VanDerWaalsContact CD1-N 3.28Å; L397-R401 PolarHBondContact O-N 3.33Å; W398-R401 PolarHBondContact O-N 3.17Å; R401-R403 PolarHBondContact O-N 2.95Å; R401-L404 PolarHBondContact O-N 3Å; R401-I405 HydrophobicContact CG-CD1 3.94Å; R401-I405 WeakPolarHBondContact O-CG1 3.36Å; R401-I405 PolarHBondContact O-N 3.31Å; R401-S458 PolarHBondContact NH1-OG 3.48Å
402	D	90.2	Very high	88.3	Confident	7 Å²	7	61.7 Å²	61.7	4%	0.037	29%	0.288	C	S	.	.	H	α-helix	trans	-59.2	-38.9	178.4	-64.5	-6.7	0	0	0	111	W398 D399 I405 M406 K444 R450	W398-D402 VanDerWaalsContact O-CG 3.25Å; W398-D402 PolarHBondContact O-N 3.18Å; D399-D402 PolarHBondContact O-N 3.42Å; D402-I405 PolarHBondContact O-N 2.86Å; D402-M406 HydrophobicContact CB-CE 4.29Å; D402-M406 PolarHBondContact O-N 2.78Å; D402-K444 WeakPolarHBondContact OD1-CE 3.5Å; D402-K444 IonicContact OD1-NZ 3.83Å; D402-K444 PolarHBondContact OD1-NZ 2.92Å; D402-K444 WeakPolarHBondContact OD2-CE 3.23Å; D402-K444 IonicContact OD2-NZ 3.98Å; D402-K444 PolarHBondContact OD2-NZ 3.39Å; D402-R450 IonicContact OD2-NH2 3.03Å
403	R	90.2	Very high	86.6	Confident	100 Å²	100	66.3 Å²	66.3	38%	0.377	32%	0.318	S	S	.	.	H	α-helix	trans	-65.3	-36.9	175.8	-178.8	178.3	179.2	-174.6	-2	113	D399 A400 R401 I405 G407	D399-R403 VanDerWaalsContact O-CB 3.28Å; D399-R403 WeakPolarHBondContact O-CB 3.33Å; D399-R403 PolarHBondContact O-N 3.04Å; A400-R403 PolarHBondContact O-N 3.5Å; R401-R403 PolarHBondContact O-N 2.95Å; R403-I405 VanDerWaalsContact C-N 3.33Å; R403-G407 WeakPolarHBondContact CA-O 3.45Å; R403-G407 CarbonylContact O-C 3.57Å; R403-G407 WeakPolarHBondContact O-CA 3.46Å; R403-G407 PolarHBondContact O-N 2.71Å
404	L	89.6	Confident	85.3	Confident	65 Å²	65	65.1 Å²	65.1	34%	0.34	31%	0.313	S	S	.	.	H	α-helix	trans	-68.4	-35.4	176.8	-173.4	62.9	0	0	0	111.6	Y368 N375 A400 R401	Y368-L404 HydrophobicContact CD1-CD2 4.45Å; Y368-L404 HydrophobicContact CE1-CD2 3.61Å; N375-L404 WeakPolarHBondContact ND2-CD1 3.28Å; A400-L404 PolarHBondContact O-N 3.32Å; R401-L404 PolarHBondContact O-N 3Å
405	I	86.9	Confident	84.8	Confident	92 Å²	92	68.3 Å²	68.3	47%	0.472	33%	0.331	S	S	.	.	H	α-helix	trans	-78.7	-46.7	-178.8	-61.7	167.8	0	0	0	111.8	R401 D402 R403	R401-I405 HydrophobicContact CG-CD1 3.94Å; R401-I405 WeakPolarHBondContact O-CG1 3.36Å; R401-I405 PolarHBondContact O-N 3.31Å; D402-I405 PolarHBondContact O-N 2.86Å; R403-I405 VanDerWaalsContact C-N 3.33Å
406	M	85.2	Confident	84.5	Confident	33 Å²	33	71.1 Å²	71.1	16%	0.163	35%	0.349	C	S	.	.	H	α-helix	trans	-116.8	-6.3	-168.6	-58.2	-174.5	-65.6	0	0	114.4	D402 R450 G451 A453 L456	D402-M406 HydrophobicContact CB-CE 4.29Å; D402-M406 PolarHBondContact O-N 2.78Å; M406-R450 HydrophobicContact CB-CB 3.67Å; M406-R450 HydrophobicContact CE-CB 4.11Å; M406-R450 HydrophobicContact CE-CG 4.01Å; M406-R450 CarbonylContact O-C 3.45Å; M406-G451 WeakPolarHBondContact O-CA 3.37Å; M406-G451 PolarHBondContact O-N 2.78Å; M406-A453 HydrophobicContact SD-CB 4.01Å; M406-L456 HydrophobicContact CE-CB 3.72Å; M406-L456 HydrophobicContact CE-CD2 3.44Å; M406-L456 VanDerWaalsContact CE-CD2 3.44Å; M406-L456 HydrophobicContact CE-CG 4.12Å; M406-L456 HydrophobicContact SD-CB 3.78Å; M406-L456 HydrophobicContact SD-CD1 4.11Å; M406-L456 HydrophobicContact SD-CD2 3.77Å; M406-L456 HydrophobicContact SD-CG 4.08Å
407	G	87.4	Confident	84.1	Confident	21 Å²	21	78.4 Å²	78.4	22%	0.216	38%	0.383	C	S	.	.			trans	86.7	-175.3	-172.7	0	0	0	0	0	113.9	R403	R403-G407 WeakPolarHBondContact CA-O 3.45Å; R403-G407 CarbonylContact O-C 3.57Å; R403-G407 WeakPolarHBondContact O-CA 3.46Å; R403-G407 PolarHBondContact O-N 2.71Å
408	P	86.1	Confident	83.8	Confident	85 Å²	85	81.3 Å²	81.3	55%	0.552	40%	0.401	S	S	*	.	S	Bend	trans	-66.6	148	-175.3	28.8	-34.8	0	0	0	112.2
409	A	83.2	Confident	83.6	Confident	47 Å²	47	81.1 Å²	81.1	39%	0.388	40%	0.402	S	S	.	.	B	Isolated β-bridge	trans	-65.6	139	172.7	0	0	0	0	0	111.5	I448 R450	A409-I448 HydrophobicContact CB-CG2 4.1Å; A409-R450 HydrophobicContact CB-CG 4.37Å
410	K	80.8	Confident	83.7	Confident	114 Å²	114	84.4 Å²	84.4	50%	0.496	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-79.6	135.1	174.4	-66.9	179.4	-178.1	166.3	0	109.8	P449 G451	K410-P449 HydrophobicContact CB-CG 4.19Å; K410-P449 HydrophobicContact CD-CB 4.48Å; K410-P449 PolarHBondContact N-O 3.43Å; K410-G451 WeakPolarHBondContact CE-O 3.11Å; K410-G451 PolarHBondContact NZ-O 2.92Å
411	R	67.2	Low	83.7	Confident	249 Å²	249	85.5 Å²	85.5	94%	0.94	42%	0.418	S	S	*	.	S	Bend	trans	-77.2	-25.1	-179.7	-79.1	-174.7	173.1	142.5	-2	114.7	P413	R411-P413 WeakPolarHBondContact O-CD 3.39Å
412	R	65.2	Low	83.7	Confident	218 Å²	218	85 Å²	85	82%	0.823	42%	0.418	S	S	*	.	S	Bend	trans	-86.4	117.2	178.4	-68.9	-175.4	-176.8	173.8	1.3	107.4	L414	R412-L414 PolarHBondContact O-N 2.92Å
413	P	62.2	Low	83.9	Confident	103 Å²	103	84.7 Å²	84.7	67%	0.669	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-54	141.7	166.2	22.8	-30	0	0	0	107.9	R411	R411-P413 WeakPolarHBondContact O-CD 3.39Å
414	L	67.2	Low	84.2	Confident	48 Å²	48	80 Å²	80	25%	0.251	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-59.1	162.1	171.3	-64.3	165.4	0	0	0	108.7	R412 T418 N419 P449	R412-L414 PolarHBondContact O-N 2.92Å; L414-T418 HydrophobicContact CB-CG2 4.17Å; L414-T418 HydrophobicContact CD1-CG2 3.77Å; L414-T418 HydrophobicContact CD2-CG2 4.36Å; L414-T418 HydrophobicContact CG-CG2 4.31Å; L414-N419 HydrophobicContact CB-CB 4.45Å; L414-P449 HydrophobicContact CD1-CB 4.09Å; L414-P449 HydrophobicContact CD1-CG 4.27Å; L414-P449 HydrophobicContact CG-CB 4.38Å; L414-P449 HydrophobicContact CG-CG 4.19Å
415	D	83	Confident	84.6	Confident	84 Å²	84	77.5 Å²	77.5	45%	0.449	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-52.7	147.7	167.9	60.5	-65.6	0	0	0	110.1	Q417 T418 N419	D415-Q417 PolarHBondContact O-N 3.07Å; D415-Q417 WeakPolarHBondContact OD2-CB 3.3Å; D415-T418 PolarHBondContact O-N 3.3Å; D415-T418 WeakPolarHBondContact OD1-CB 3.48Å; D415-T418 PolarHBondContact OD1-OG1 2.88Å; D415-T418 PolarHBondContact OD2-N 3.11Å; D415-T418 PolarHBondContact OD2-OG1 2.89Å; D415-T418 VanDerWaalsContact OD2-OG1 3.07Å; D415-N419 PolarHBondContact O-N 3.35Å
416	D	85.8	Confident	85	Confident	144 Å²	144	73.9 Å²	73.9	77%	0.77	37%	0.366	S	S	*	.	H	α-helix	trans	-53.9	-29.6	-175.6	-65.8	-17.9	0	0	0	112.4	R420	D416-R420 WeakPolarHBondContact O-CB 3.36Å; D416-R420 PolarHBondContact O-N 2.71Å
417	Q	88.1	Confident	85.6	Confident	153 Å²	153	72.3 Å²	72.3	72%	0.715	36%	0.358	S	S	*	.	H	α-helix	trans	-72.7	-49.5	177.4	-58.6	-176.6	15.1	0	0	111.8	D415 N419 R420 V421	D415-Q417 PolarHBondContact O-N 3.07Å; D415-Q417 WeakPolarHBondContact OD2-CB 3.3Å; Q417-N419 VanDerWaalsContact C-N 3.33Å; Q417-N419 PolarHBondContact O-N 2.94Å; Q417-R420 WeakPolarHBondContact O-CB 3.38Å; Q417-R420 PolarHBondContact O-N 3.3Å; Q417-V421 WeakPolarHBondContact O-CG2 3.41Å; Q417-V421 PolarHBondContact O-N 3.35Å
418	T	88.1	Confident	86.1	Confident	60 Å²	60	71.3 Å²	71.3	37%	0.368	35%	0.348	S	S	.	.	H	α-helix	trans	-63.5	-40.2	176.5	-57.2	0	0	0	0	111.6	L414 D415 R420 V421 S422	L414-T418 HydrophobicContact CB-CG2 4.17Å; L414-T418 HydrophobicContact CD1-CG2 3.77Å; L414-T418 HydrophobicContact CD2-CG2 4.36Å; L414-T418 HydrophobicContact CG-CG2 4.31Å; D415-T418 PolarHBondContact O-N 3.3Å; D415-T418 WeakPolarHBondContact OD1-CB 3.48Å; D415-T418 PolarHBondContact OD1-OG1 2.88Å; D415-T418 PolarHBondContact OD2-N 3.11Å; D415-T418 PolarHBondContact OD2-OG1 2.89Å; D415-T418 VanDerWaalsContact OD2-OG1 3.07Å; T418-R420 VanDerWaalsContact C-N 3.28Å; T418-R420 PolarHBondContact O-N 3.46Å; T418-V421 PolarHBondContact O-N 2.89Å; T418-S422 PolarHBondContact O-N 3.04Å
419	N	90.8	Very high	86.6	Confident	23 Å²	23	67.7 Å²	67.7	12%	0.123	32%	0.324	C	S	.	.	H	α-helix	trans	-62.2	-39.8	175.9	-158.5	26.5	0	0	0	111.1	L414 D415 Q417 S422 A423 I447	L414-N419 HydrophobicContact CB-CB 4.45Å; D415-N419 PolarHBondContact O-N 3.35Å; Q417-N419 VanDerWaalsContact C-N 3.33Å; Q417-N419 PolarHBondContact O-N 2.94Å; N419-S422 PolarHBondContact O-N 3.14Å; N419-A423 PolarHBondContact O-N 3.37Å; N419-I447 WeakPolarHBondContact OD1-CD1 3.47Å
420	R	93.3	Very high	87.3	Confident	101 Å²	101	65.4 Å²	65.4	38%	0.381	31%	0.305	S	S	.	.	H	α-helix	trans	-60.4	-48.8	172.4	-173.1	179.8	-175.5	83.4	5	112	D416 Q417 T418 S422 A423 F424 F491 L579	D416-R420 WeakPolarHBondContact O-CB 3.36Å; D416-R420 PolarHBondContact O-N 2.71Å; Q417-R420 WeakPolarHBondContact O-CB 3.38Å; Q417-R420 PolarHBondContact O-N 3.3Å; T418-R420 VanDerWaalsContact C-N 3.28Å; T418-R420 PolarHBondContact O-N 3.46Å; R420-S422 VanDerWaalsContact C-N 3.34Å; R420-S422 PolarHBondContact O-N 3.07Å; R420-A423 PolarHBondContact O-N 2.96Å; R420-F424 HydrophobicContact CG-CD2 3.97Å; R420-F424 HydrophobicContact CG-CE2 3.85Å; R420-F424 VanDerWaalsContact O-CD2 3.27Å; R420-F424 WeakPolarHBondContact O-CD2 3.49Å; R420-F424 PolarHBondContact O-N 3.44Å; R420-F491 HydrophobicContact CG-CE1 4.38Å; R420-F491 HydrophobicContact CG-CZ 4.16Å; R420-L579 HydrophobicContact CB-CD2 4.42Å; R420-L579 HydrophobicContact CG-CD1 4.23Å
421	V	93.6	Very high	88.1	Confident	26 Å²	26	60 Å²	60	16%	0.158	28%	0.281	C	S	.	.	H	α-helix	trans	-57.8	-48.9	177.5	172.7	0	0	0	0	110.6	Q417 T418 A423 F424 H425 E487 F491 T497	Q417-V421 WeakPolarHBondContact O-CG2 3.41Å; Q417-V421 PolarHBondContact O-N 3.35Å; T418-V421 PolarHBondContact O-N 2.89Å; V421-A423 VanDerWaalsContact C-N 3.32Å; V421-A423 PolarHBondContact O-N 3.26Å; V421-F424 PolarHBondContact O-N 3.2Å; V421-H425 WeakPolarHBondContact O-CB 3.27Å; V421-H425 PolarHBondContact O-N 3.4Å; V421-E487 HydrophobicContact CG1-CG 4.17Å; V421-F491 HydrophobicContact CB-CE2 4.4Å; V421-F491 HydrophobicContact CG2-CE2 4.05Å; V421-F491 HydrophobicContact CG2-CZ 4.06Å; V421-T497 HydrophobicContact CG1-CG2 3.58Å; V421-T497 HydrophobicContact CG2-CG2 4.32Å
422	S	93.6	Very high	89.6	Confident	12 Å²	12	48.1 Å²	48.1	8%	0.084	24%	0.237	C	C	.	.	H	α-helix	trans	-58.6	-42.7	179	-178.4	0	0	0	0	111.8	T418 N419 R420 F424 H425 E426 G454	T418-S422 PolarHBondContact O-N 3.04Å; N419-S422 PolarHBondContact O-N 3.14Å; R420-S422 VanDerWaalsContact C-N 3.34Å; R420-S422 PolarHBondContact O-N 3.07Å; S422-F424 PolarHBondContact O-N 3.32Å; S422-H425 WeakPolarHBondContact O-CB 3.31Å; S422-H425 PolarHBondContact O-N 2.85Å; S422-E426 WeakPolarHBondContact O-CB 3.45Å; S422-E426 VanDerWaalsContact O-CG 3.3Å; S422-E426 WeakPolarHBondContact O-CG 3.32Å; S422-E426 PolarHBondContact O-N 3.49Å; S422-G454 PolarHBondContact OG-O 2.76Å
423	A	95.4	Very high	91.1	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-60.3	-41.5	176.9	0	0	0	0	0	113.8	N419 R420 V421 A427 I447 L578 L579	N419-A423 PolarHBondContact O-N 3.37Å; R420-A423 PolarHBondContact O-N 2.96Å; V421-A423 VanDerWaalsContact C-N 3.32Å; V421-A423 PolarHBondContact O-N 3.26Å; A423-A427 WeakPolarHBondContact O-CB 3.47Å; A423-A427 PolarHBondContact O-N 3.02Å; A423-I447 HydrophobicContact CB-CD1 4.3Å; A423-I447 HydrophobicContact CB-CG2 3.97Å; A423-L578 HydrophobicContact CB-CB 4.13Å; A423-L579 HydrophobicContact CB-CD1 4.36Å; A423-L579 HydrophobicContact CB-CD2 3.79Å; A423-L579 HydrophobicContact CB-CG 3.65Å
424	F	96.5	Very high	92.7	Very high	1 Å²	1	35.5 Å²	35.5	0%	0.004	18%	0.181	C	C	.	.	H	α-helix	trans	-72.9	-33.4	176.6	-79.5	-80.7	0	0	0	112.7	R420 V421 S422 G428 V490 F491 H571 K572 A575	R420-F424 HydrophobicContact CG-CD2 3.97Å; R420-F424 HydrophobicContact CG-CE2 3.85Å; R420-F424 VanDerWaalsContact O-CD2 3.27Å; R420-F424 WeakPolarHBondContact O-CD2 3.49Å; R420-F424 PolarHBondContact O-N 3.44Å; V421-F424 PolarHBondContact O-N 3.2Å; S422-F424 PolarHBondContact O-N 3.32Å; F424-G428 PolarHBondContact O-N 3.11Å; F424-G428 VanDerWaalsContact O-N 3.14Å; F424-V490 HydrophobicContact CD1-CB 4.11Å; F424-V490 HydrophobicContact CD1-CG1 3.95Å; F424-V490 HydrophobicContact CD1-CG2 3.62Å; F424-V490 HydrophobicContact CD2-CG1 4.42Å; F424-V490 HydrophobicContact CE1-CB 4.3Å; F424-V490 HydrophobicContact CE1-CG1 3.76Å; F424-V490 HydrophobicContact CE1-CG2 3.77Å; F424-V490 HydrophobicContact CE2-CG1 4.32Å; F424-V490 HydrophobicContact CG-CG1 4.27Å; F424-V490 HydrophobicContact CG-CG2 4.46Å; F424-V490 HydrophobicContact CZ-CG1 3.98Å; F424-F491 HydrophobicContact CB-CE2 3.89Å; F424-F491 HydrophobicContact CB-CZ 4.23Å; F424-F491 HydrophobicContact CD2-CE2 4.17Å; F424-F491 AromaticContact CD2-CZ 3.64Å; F424-F491 HydrophobicContact CD2-CZ 3.64Å; F424-F491 HydrophobicContact CE2-CZ 4.35Å; F424-F491 HydrophobicContact CG-CE2 4.21Å; F424-F491 HydrophobicContact CG-CZ 4.14Å; F424-H571 AromaticContact CD1-CE1 3.63Å; F424-H571 PolarHBondContact O-NE2 3.44Å; F424-K572 HydrophobicContact CE1-CB 4.38Å; F424-K572 HydrophobicContact CE1-CG 4.33Å; F424-K572 HydrophobicContact CZ-CG 4.47Å; F424-A575 HydrophobicContact CB-CB 4.45Å; F424-A575 HydrophobicContact CD1-CB 3.44Å; F424-A575 VanDerWaalsContact CD1-CB 3.44Å; F424-A575 HydrophobicContact CD2-CB 4.03Å; F424-A575 HydrophobicContact CE1-CB 3.54Å; F424-A575 HydrophobicContact CE2-CB 4.07Å; F424-A575 HydrophobicContact CG-CB 3.72Å; F424-A575 HydrophobicContact CZ-CB 3.84Å
425	H	96.6	Very high	94	Very high	14 Å²	14	36.8 Å²	36.8	7%	0.065	19%	0.187	C	C	.	.	H	α-helix	trans	-63.1	-55.6	173.5	-177.2	103.4	0	0	0	111	V421 S422 A427 G428 H429 G483 E487 D503	V421-H425 WeakPolarHBondContact O-CB 3.27Å; V421-H425 PolarHBondContact O-N 3.4Å; S422-H425 WeakPolarHBondContact O-CB 3.31Å; S422-H425 PolarHBondContact O-N 2.85Å; H425-A427 PolarHBondContact O-N 3.24Å; H425-G428 WeakPolarHBondContact O-CA 3.42Å; H425-G428 PolarHBondContact O-N 3.39Å; H425-H429 AromaticContact CD2-CD2 3.55Å; H425-H429 AromaticContact CD2-NE2 3.55Å; H425-H429 AromaticContact CE1-NE2 3.81Å; H425-H429 AromaticContact NE2-CD2 3.6Å; H425-H429 AromaticContact NE2-NE2 3.08Å; H425-H429 PolarHBondContact NE2-NE2 3.01Å; H425-H429 PolarHBondContact O-N 3.04Å; H425-G483 WeakPolarHBondContact O-CA 3.41Å; H425-E487 HydrophobicContact CB-CG 4.1Å; H425-E487 IonicContact CE1-OE1 2.96Å; H425-E487 IonicContact CG-OE1 3.73Å; H425-E487 IonicContact ND1-OE1 2.72Å; H425-E487 PolarHBondContact ND1-OE1 2.71Å; H425-D503 IonicContact CE1-OD2 3.25Å; H425-D503 IonicContact NE2-OD2 3.36Å; H425-D503 PolarHBondContact NE2-OD2 2.93Å
426	E	96.8	Very high	94.7	Very high	15 Å²	15	33.8 Å²	33.8	7%	0.07	17%	0.172	C	C	.	.	H	α-helix	trans	-67	-36.6	-178.9	-63.4	-55.9	156.2	0	0	112.6	S422 G428 H429 A430 V445 I447 L456 T457 L578	S422-E426 WeakPolarHBondContact O-CB 3.45Å; S422-E426 VanDerWaalsContact O-CG 3.3Å; S422-E426 WeakPolarHBondContact O-CG 3.32Å; S422-E426 PolarHBondContact O-N 3.49Å; E426-G428 PolarHBondContact O-N 3.3Å; E426-H429 PolarHBondContact O-N 3.37Å; E426-A430 WeakPolarHBondContact O-CB 3.41Å; E426-A430 PolarHBondContact O-N 3.05Å; E426-V445 HydrophobicContact CB-CG2 3.63Å; E426-I447 HydrophobicContact CG-CG2 4.43Å; E426-L456 PolarHBondContact OE1-N 2.77Å; E426-L456 VanDerWaalsContact OE2-C 3.27Å; E426-T457 PolarHBondContact O-OG1 3.17Å; E426-T457 PolarHBondContact OE2-N 3.38Å; E426-T457 PolarHBondContact OE2-OG1 2.95Å; E426-L578 HydrophobicContact CB-CD1 4.42Å
427	A	97.2	Very high	95	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-60.2	-33.4	170.9	0	0	0	0	0	112	A423 H425 L431 L574 A575 L578	A423-A427 WeakPolarHBondContact O-CB 3.47Å; A423-A427 PolarHBondContact O-N 3.02Å; H425-A427 PolarHBondContact O-N 3.24Å; A427-L431 WeakPolarHBondContact O-CB 3.4Å; A427-L431 PolarHBondContact O-N 3.01Å; A427-L574 HydrophobicContact CB-CB 4.21Å; A427-L574 HydrophobicContact CB-CD2 4.1Å; A427-L574 HydrophobicContact CB-CG 3.95Å; A427-A575 HydrophobicContact CB-CB 3.93Å; A427-L578 HydrophobicContact CB-CD1 4.08Å
428	G	97.4	Very high	95.2	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-62.7	-53.2	175.2	0	0	0	0	0	111.5	F424 H425 E426 A430 L431 V432 G482 H571	F424-G428 PolarHBondContact O-N 3.11Å; F424-G428 VanDerWaalsContact O-N 3.14Å; H425-G428 WeakPolarHBondContact O-CA 3.42Å; H425-G428 PolarHBondContact O-N 3.39Å; E426-G428 PolarHBondContact O-N 3.3Å; G428-A430 PolarHBondContact O-N 2.86Å; G428-L431 PolarHBondContact O-N 3.41Å; G428-V432 VanDerWaalsContact O-CG2 3.25Å; G428-V432 WeakPolarHBondContact O-CG2 3.31Å; G428-V432 PolarHBondContact O-N 3.4Å; G428-V432 VanDerWaalsContact O-N 3.07Å; G428-G482 WeakPolarHBondContact CA-O 3.49Å; G428-H571 PolarHBondContact N-NE2 2.87Å
429	H	97.7	Very high	95.5	Very high	9 Å²	9	26.1 Å²	26.1	4%	0.042	15%	0.146	C	C	.	.	H	α-helix	trans	-56.9	-50.9	175	-71.6	-63.2	0	0	0	112.5	H425 E426 L431 V432 A433 T457 V479 L480 G483 D503	H425-H429 AromaticContact CD2-CD2 3.55Å; H425-H429 AromaticContact CD2-NE2 3.55Å; H425-H429 AromaticContact CE1-NE2 3.81Å; H425-H429 AromaticContact NE2-CD2 3.6Å; H425-H429 AromaticContact NE2-NE2 3.08Å; H425-H429 PolarHBondContact NE2-NE2 3.01Å; H425-H429 PolarHBondContact O-N 3.04Å; E426-H429 PolarHBondContact O-N 3.37Å; H429-L431 PolarHBondContact O-N 3.29Å; H429-V432 PolarHBondContact O-N 3.13Å; H429-A433 WeakPolarHBondContact O-CB 3.13Å; H429-A433 PolarHBondContact O-N 2.98Å; H429-T457 HydrophobicContact CB-CG2 4.03Å; H429-T457 WeakPolarHBondContact CB-OG1 3.42Å; H429-V479 PolarHBondContact CE1-O 2.81Å; H429-V479 PolarHBondContact ND1-O 3.45Å; H429-L480 PolarHBondContact CE1-O 3.12Å; H429-G483 PolarHBondContact CE1-N 2.8Å; H429-G483 VanDerWaalsContact CE1-N 3.35Å; H429-G483 WeakPolarHBondContact NE2-CA 3.29Å; H429-G483 PolarHBondContact NE2-N 3Å; H429-D503 IonicContact CE1-OD1 3.59Å; H429-D503 IonicContact CE1-OD2 3.2Å; H429-D503 IonicContact NE2-OD1 3.95Å; H429-D503 IonicContact NE2-OD2 2.78Å; H429-D503 PolarHBondContact NE2-OD2 2.81Å
430	A	97.7	Very high	95.6	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-62.3	-41.8	-176.5	0	0	0	0	0	112.5	E426 G428 A433 L434 L442 V445 T457 L574	E426-A430 WeakPolarHBondContact O-CB 3.41Å; E426-A430 PolarHBondContact O-N 3.05Å; G428-A430 PolarHBondContact O-N 2.86Å; A430-A433 PolarHBondContact O-N 3.14Å; A430-L434 WeakPolarHBondContact O-CG 3.02Å; A430-L434 PolarHBondContact O-N 3.09Å; A430-L442 HydrophobicContact CB-CD1 4.1Å; A430-L442 HydrophobicContact CB-CD2 4.05Å; A430-V445 HydrophobicContact CB-CB 4.18Å; A430-V445 HydrophobicContact CB-CG1 4.28Å; A430-V445 HydrophobicContact CB-CG2 4.29Å; A430-T457 HydrophobicContact CB-CG2 4.15Å; A430-L574 HydrophobicContact CB-CD2 4.1Å
431	L	97.2	Very high	95.6	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-71	-41.9	-179.4	-173.6	59.6	0	0	0	111.8	A427 G428 H429 A433 L434 L435 L564 Q567 Q570 H571 L593	A427-L431 WeakPolarHBondContact O-CB 3.4Å; A427-L431 PolarHBondContact O-N 3.01Å; G428-L431 PolarHBondContact O-N 3.41Å; H429-L431 PolarHBondContact O-N 3.29Å; L431-A433 VanDerWaalsContact C-N 3.31Å; L431-A433 PolarHBondContact O-N 3.07Å; L431-L434 PolarHBondContact O-N 3.49Å; L431-L435 HydrophobicContact CD1-CD1 3.67Å; L431-L435 HydrophobicContact CD1-CG 4.09Å; L431-L435 HydrophobicContact CD2-CD1 4.48Å; L431-L435 HydrophobicContact CG-CD1 3.73Å; L431-L435 HydrophobicContact CG-CG 4.46Å; L431-L435 WeakPolarHBondContact O-CB 3.42Å; L431-L435 VanDerWaalsContact O-CG 3.29Å; L431-L435 WeakPolarHBondContact O-CG 3.11Å; L431-L435 PolarHBondContact O-N 2.98Å; L431-L435 VanDerWaalsContact O-N 3.13Å; L431-L564 HydrophobicContact CB-CD2 4.16Å; L431-L564 HydrophobicContact CD2-CD2 3.74Å; L431-L564 HydrophobicContact CG-CD2 4.1Å; L431-Q567 HydrophobicContact CD2-CB 4.06Å; L431-Q570 HydrophobicContact CD1-CB 4.38Å; L431-Q570 HydrophobicContact CD2-CB 4.11Å; L431-H571 HydrophobicContact CD2-CB 3.78Å; L431-L593 HydrophobicContact CD1-CD1 4.14Å; L431-L593 HydrophobicContact CD1-CD2 4.26Å
432	V	97.8	Very high	95.7	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-60.9	-43.8	174.5	176.3	0	0	0	0	110.4	G428 H429 L434 L435 T436 D478 V479 V560 L563 L564	G428-V432 VanDerWaalsContact O-CG2 3.25Å; G428-V432 WeakPolarHBondContact O-CG2 3.31Å; G428-V432 PolarHBondContact O-N 3.4Å; G428-V432 VanDerWaalsContact O-N 3.07Å; H429-V432 PolarHBondContact O-N 3.13Å; V432-L434 PolarHBondContact O-N 3.45Å; V432-L435 PolarHBondContact O-N 2.88Å; V432-T436 WeakPolarHBondContact CG1-OG1 3.31Å; V432-T436 VanDerWaalsContact O-CB 3.29Å; V432-T436 WeakPolarHBondContact O-CB 3.46Å; V432-T436 PolarHBondContact O-N 2.59Å; V432-T436 PolarHBondContact O-OG1 2.77Å; V432-D478 HydrophobicContact CG1-CB 4.18Å; V432-D478 WeakPolarHBondContact CG1-O 3.43Å; V432-V479 HydrophobicContact CG1-CG2 4.13Å; V432-V560 HydrophobicContact CG1-CG2 4.31Å; V432-V560 HydrophobicContact CG2-CG1 3.81Å; V432-L563 HydrophobicContact CG2-CD2 4.27Å; V432-L564 HydrophobicContact CG2-CD1 3.9Å; V432-L564 HydrophobicContact CG2-CD2 3.95Å; V432-L564 HydrophobicContact CG2-CG 3.85Å
433	A	96.9	Very high	95.7	Very high	6 Å²	6	22.7 Å²	22.7	5%	0.05	14%	0.135	C	C	.	.	H	α-helix	trans	-63.5	-27.6	179.8	0	0	0	0	0	114.2	H429 A430 L431 S439 F459 V479	H429-A433 WeakPolarHBondContact O-CB 3.13Å; H429-A433 PolarHBondContact O-N 2.98Å; A430-A433 PolarHBondContact O-N 3.14Å; L431-A433 VanDerWaalsContact C-N 3.31Å; L431-A433 PolarHBondContact O-N 3.07Å; A433-S439 WeakPolarHBondContact CA-OG 3.29Å; A433-S439 WeakPolarHBondContact O-CB 3.49Å; A433-S439 PolarHBondContact O-OG 3.17Å; A433-F459 HydrophobicContact CB-CD1 4.23Å; A433-F459 HydrophobicContact CB-CE1 3.48Å; A433-F459 VanDerWaalsContact CB-CE1 3.48Å; A433-F459 HydrophobicContact CB-CZ 4.38Å; A433-V479 HydrophobicContact CB-CG1 4.42Å; A433-V479 HydrophobicContact CB-CG2 3.82Å
434	L	96.1	Very high	95.6	Very high	50 Å²	50	23.4 Å²	23.4	26%	0.262	14%	0.138	S	C	.	.	H	α-helix	trans	-81.9	-29.6	176.2	-73.5	173	0	0	0	113.3	A430 L431 V432 L442 V589 L590 L593	A430-L434 WeakPolarHBondContact O-CG 3.02Å; A430-L434 PolarHBondContact O-N 3.09Å; L431-L434 PolarHBondContact O-N 3.49Å; V432-L434 PolarHBondContact O-N 3.45Å; L434-L442 HydrophobicContact CD1-CD2 3.89Å; L434-L442 HydrophobicContact CD2-CB 3.97Å; L434-L442 HydrophobicContact CD2-CD2 4.18Å; L434-L442 HydrophobicContact CG-CB 4.28Å; L434-L442 HydrophobicContact CG-CD2 3.98Å; L434-V589 HydrophobicContact CD1-CG1 3.56Å; L434-L590 HydrophobicContact CD1-CD2 4.43Å; L434-L590 HydrophobicContact CD2-CD2 4.37Å; L434-L593 HydrophobicContact CD1-CD1 3.84Å
435	L	95.4	Very high	95.5	Very high	74 Å²	74	23.4 Å²	23.4	39%	0.387	14%	0.138	S	C	.	.	H	α-helix	trans	-98.8	-25.1	-172.1	-65.5	176.5	0	0	0	113.5	L431 V432 L563 Q567	L431-L435 HydrophobicContact CD1-CD1 3.67Å; L431-L435 HydrophobicContact CD1-CG 4.09Å; L431-L435 HydrophobicContact CD2-CD1 4.48Å; L431-L435 HydrophobicContact CG-CD1 3.73Å; L431-L435 HydrophobicContact CG-CG 4.46Å; L431-L435 WeakPolarHBondContact O-CB 3.42Å; L431-L435 VanDerWaalsContact O-CG 3.29Å; L431-L435 WeakPolarHBondContact O-CG 3.11Å; L431-L435 PolarHBondContact O-N 2.98Å; L431-L435 VanDerWaalsContact O-N 3.13Å; V432-L435 PolarHBondContact O-N 2.88Å; L435-L563 HydrophobicContact CB-CD1 4.03Å; L435-L563 HydrophobicContact CB-CD2 4.12Å; L435-L563 HydrophobicContact CB-CG 4.4Å; L435-L563 HydrophobicContact CD1-CD2 3.66Å; L435-L563 HydrophobicContact CD1-CG 4.37Å; L435-Q567 HydrophobicContact CD1-CB 4.24Å; L435-Q567 HydrophobicContact CD1-CG 3.7Å
436	T	96	Very high	95.4	Very high	22 Å²	22	22.8 Å²	22.8	14%	0.135	14%	0.135	C	C	.	.	S	Bend	trans	-79.2	122.9	177.7	-58.6	0	0	0	0	110.1	V432 S439 A475 D478	V432-T436 WeakPolarHBondContact CG1-OG1 3.31Å; V432-T436 VanDerWaalsContact O-CB 3.29Å; V432-T436 WeakPolarHBondContact O-CB 3.46Å; V432-T436 PolarHBondContact O-N 2.59Å; V432-T436 PolarHBondContact O-OG1 2.77Å; T436-S439 WeakPolarHBondContact O-CB 3.46Å; T436-S439 PolarHBondContact O-N 3.19Å; T436-A475 HydrophobicContact CG2-CB 3.65Å; T436-D478 HydrophobicContact CG2-CB 4.37Å
437	A	92.7	Very high	95.2	Very high	79 Å²	79	22.2 Å²	22.2	65%	0.653	13%	0.133	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.1	150.3	173.6	0	0	0	0	0	111.1	S439	A437-S439 PolarHBondContact O-N 2.97Å
438	D	92.8	Very high	94.8	Very high	96 Å²	96	24.2 Å²	24.2	51%	0.513	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.9	5.7	-177.4	-55.4	-51.1	0	0	0	115.3	A471 Q472	D438-A471 HydrophobicContact CB-CB 4.34Å; D438-A471 WeakPolarHBondContact OD2-CB 3.05Å; D438-Q472 HydrophobicContact CB-CG 3.86Å; D438-Q472 WeakPolarHBondContact O-CG 3.36Å
439	S	93.5	Very high	94.3	Very high	21 Å²	21	24.8 Å²	24.8	15%	0.147	15%	0.147	C	C	.	.	P	Polyproline II helix	trans	-65.4	149.7	172	178.6	0	0	0	0	111.1	A433 T436 A437	A433-S439 WeakPolarHBondContact CA-OG 3.29Å; A433-S439 WeakPolarHBondContact O-CB 3.49Å; A433-S439 PolarHBondContact O-OG 3.17Å; T436-S439 WeakPolarHBondContact O-CB 3.46Å; T436-S439 PolarHBondContact O-N 3.19Å; A437-S439 PolarHBondContact O-N 2.97Å
440	I	93.1	Very high	93.8	Very high	31 Å²	31	25.1 Å²	25.1	16%	0.159	15%	0.147	C	C	.	.	P	Polyproline II helix	trans	-64.7	130.7	171.5	-54.3	173	0	0	0	108.1	L442 F459 Q461 M468 Q476	I440-L442 PolarHBondContact O-N 3.17Å; I440-F459 HydrophobicContact CB-CB 4.09Å; I440-F459 HydrophobicContact CB-CG 4.49Å; I440-F459 HydrophobicContact CG2-CB 3.62Å; I440-Q461 HydrophobicContact CG2-CG 3.49Å; I440-Q461 VanDerWaalsContact CG2-CG 3.49Å; I440-M468 HydrophobicContact CD1-CE 4.41Å; I440-Q476 HydrophobicContact CD1-CG 4.29Å
441	P	94	Very high	93.1	Very high	40 Å²	40	26.5 Å²	26.5	26%	0.26	16%	0.162	S	C	.	.	P	Polyproline II helix	trans	-57.8	134.6	-177.4	-25.7	33.8	0	0	0	112.9	F459 L460	P441-F459 WeakPolarHBondContact O-CA 3.37Å; P441-L460 PolarHBondContact O-N 2.85Å
442	L	95	Very high	92.4	Very high	3 Å²	3	36.2 Å²	36.2	2%	0.016	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	135.8	171.6	179.9	67.7	0	0	0	110.2	A430 L434 I440 T457 F459 K586 V589	A430-L442 HydrophobicContact CB-CD1 4.1Å; A430-L442 HydrophobicContact CB-CD2 4.05Å; L434-L442 HydrophobicContact CD1-CD2 3.89Å; L434-L442 HydrophobicContact CD2-CB 3.97Å; L434-L442 HydrophobicContact CD2-CD2 4.18Å; L434-L442 HydrophobicContact CG-CB 4.28Å; L434-L442 HydrophobicContact CG-CD2 3.98Å; I440-L442 PolarHBondContact O-N 3.17Å; L442-T457 HydrophobicContact CD1-CG2 3.5Å; L442-F459 HydrophobicContact CD1-CE1 4.49Å; L442-K586 WeakPolarHBondContact O-CB 3.33Å; L442-K586 VanDerWaalsContact O-CD 3.28Å; L442-K586 WeakPolarHBondContact O-CD 3.27Å; L442-K586 WeakPolarHBondContact O-CG 3.18Å; L442-V589 HydrophobicContact CD2-CB 4.22Å; L442-V589 HydrophobicContact CD2-CG1 4.06Å; L442-V589 HydrophobicContact CD2-CG2 4.12Å
443	H	93.1	Very high	91.7	Very high	16 Å²	16	37.9 Å²	37.9	7%	0.074	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	-55.1	174.1	177.3	55.4	0	0	0	112	W398 S458 L460 K586	W398-H443 AromaticContact CD2-NE2 3.59Å; W398-H443 AromaticContact CE2-CE1 3.66Å; W398-H443 AromaticContact CE2-NE2 3.54Å; W398-H443 AromaticContact CE3-NE2 3.58Å; W398-H443 AromaticContact CH2-CE1 3.64Å; W398-H443 AromaticContact CH2-NE2 3.57Å; W398-H443 AromaticContact CZ2-CE1 3.4Å; W398-H443 WeakPolarHBondContact CZ2-CE1 3.4Å; W398-H443 AromaticContact CZ2-NE2 3.57Å; W398-H443 AromaticContact CZ3-NE2 3.57Å; H443-S458 WeakPolarHBondContact CB-O 3.41Å; H443-S458 PolarHBondContact N-O 2.84Å; H443-L460 HydrophobicContact CB-CB 3.69Å; H443-K586 PolarHBondContact O-N 3.36Å
444	K	94.1	Very high	91.1	Very high	15 Å²	15	39 Å²	39	7%	0.065	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160	162.5	177.6	70	-179	176.9	-178	0	110	D402 S458 L584	D402-K444 WeakPolarHBondContact OD1-CE 3.5Å; D402-K444 IonicContact OD1-NZ 3.83Å; D402-K444 PolarHBondContact OD1-NZ 2.92Å; D402-K444 WeakPolarHBondContact OD2-CE 3.23Å; D402-K444 IonicContact OD2-NZ 3.98Å; D402-K444 PolarHBondContact OD2-NZ 3.39Å; K444-S458 PolarHBondContact N-O 3.48Å; K444-S458 PolarHBondContact O-N 3.03Å; K444-L584 CarbonylContact C-O 3.53Å; K444-L584 VanDerWaalsContact CA-O 3.26Å; K444-L584 WeakPolarHBondContact CA-O 3.4Å
445	V	95.3	Very high	90.8	Very high	0 Å²	0	37 Å²	37	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	136.9	174	51.3	0	0	0	0	108.8	E426 A430 L456 L578 T583 L584 V589	E426-V445 HydrophobicContact CB-CG2 3.63Å; A430-V445 HydrophobicContact CB-CB 4.18Å; A430-V445 HydrophobicContact CB-CG1 4.28Å; A430-V445 HydrophobicContact CB-CG2 4.29Å; V445-L456 WeakPolarHBondContact CA-O 3.29Å; V445-L578 HydrophobicContact CB-CD2 4.43Å; V445-L578 HydrophobicContact CG1-CD2 3.86Å; V445-L578 HydrophobicContact CG2-CD1 3.86Å; V445-L578 HydrophobicContact CG2-CD2 4Å; V445-T583 CarbonylContact O-C 3.52Å; V445-T583 WeakPolarHBondContact O-CA 3.3Å; V445-L584 HydrophobicContact CG1-CB 4.09Å; V445-L584 PolarHBondContact N-O 3.31Å; V445-L584 PolarHBondContact O-N 3.48Å; V445-V589 HydrophobicContact CG1-CG2 3.64Å
446	T	92.9	Very high	90.6	Very high	2 Å²	2	35.4 Å²	35.4	1%	0.012	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	146.1	-178.9	-174.6	0	0	0	0	111.3	I448 G455 L456 E582 T583	T446-I448 WeakPolarHBondContact OG1-CB 3.41Å; T446-I448 WeakPolarHBondContact OG1-CG1 3.31Å; T446-I448 PolarHBondContact OG1-N 3.3Å; T446-I448 VanDerWaalsContact OG1-N 3.17Å; T446-G455 CarbonylContact O-C 3.55Å; T446-G455 WeakPolarHBondContact O-CA 3.49Å; T446-L456 HydrophobicContact CG2-CB 4.05Å; T446-L456 PolarHBondContact N-O 2.89Å; T446-L456 PolarHBondContact O-N 3.01Å; T446-E582 CarbonylContact C-O 3.55Å; T446-E582 VanDerWaalsContact CA-O 3.31Å; T446-E582 WeakPolarHBondContact CA-O 3.27Å; T446-E582 PolarHBondContact OG1-O 3Å; T446-T583 WeakPolarHBondContact CB-OG1 3.46Å; T446-T583 PolarHBondContact OG1-OG1 3.03Å
447	I	92.4	Very high	90.5	Very high	2 Å²	2	35 Å²	35	1%	0.01	21%	0.213	C	C	.	.			trans	-106.9	13.6	171.2	65	177.4	0	0	0	111.7	N419 A423 E426 P449 G454 L578 L579 E582	N419-I447 WeakPolarHBondContact OD1-CD1 3.47Å; A423-I447 HydrophobicContact CB-CD1 4.3Å; A423-I447 HydrophobicContact CB-CG2 3.97Å; E426-I447 HydrophobicContact CG-CG2 4.43Å; I447-P449 VanDerWaalsContact O-CD 3.27Å; I447-P449 WeakPolarHBondContact O-CD 3.16Å; I447-G454 CarbonylContact C-O 3.58Å; I447-G454 VanDerWaalsContact O-O 3.1Å; I447-L578 WeakPolarHBondContact CD1-O 3.49Å; I447-L578 HydrophobicContact CG2-CB 4.21Å; I447-L578 HydrophobicContact CG2-CD1 4.48Å; I447-L579 HydrophobicContact CD1-CD2 4.22Å; I447-E582 HydrophobicContact CG1-CB 4.29Å; I447-E582 WeakPolarHBondContact CG1-O 3.31Å; I447-E582 PolarHBondContact N-O 3.26Å
448	I	89.4	Confident	90.4	Very high	43 Å²	43	31.6 Å²	31.6	22%	0.221	19%	0.185	C	C	.	.			trans	-76	116.4	177.3	-61.9	174.3	0	0	0	108.4	A409 T446 R450 E582 T583	A409-I448 HydrophobicContact CB-CG2 4.1Å; T446-I448 WeakPolarHBondContact OG1-CB 3.41Å; T446-I448 WeakPolarHBondContact OG1-CG1 3.31Å; T446-I448 PolarHBondContact OG1-N 3.3Å; T446-I448 VanDerWaalsContact OG1-N 3.17Å; I448-R450 PolarHBondContact O-N 3.28Å; I448-E582 HydrophobicContact CD1-CB 4.46Å; I448-E582 HydrophobicContact CG1-CB 4.12Å; I448-T583 WeakPolarHBondContact CD1-OG1 3.32Å
449	P	88.2	Confident	90.4	Very high	11 Å²	11	29.9 Å²	29.9	7%	0.071	17%	0.173	C	C	.	.			trans	-69.9	133.5	-175.4	27.3	-35.3	0	0	0	112.1	K410 L414 I447 A453	K410-P449 HydrophobicContact CB-CG 4.19Å; K410-P449 HydrophobicContact CD-CB 4.48Å; K410-P449 PolarHBondContact N-O 3.43Å; L414-P449 HydrophobicContact CD1-CB 4.09Å; L414-P449 HydrophobicContact CD1-CG 4.27Å; L414-P449 HydrophobicContact CG-CB 4.38Å; L414-P449 HydrophobicContact CG-CG 4.19Å; I447-P449 VanDerWaalsContact O-CD 3.27Å; I447-P449 WeakPolarHBondContact O-CD 3.16Å; P449-A453 CarbonylContact C-O 3.46Å; P449-A453 VanDerWaalsContact CA-O 3.31Å; P449-A453 WeakPolarHBondContact CA-O 3.5Å
450	R	86.9	Confident	90.3	Very high	16 Å²	16	30 Å²	30	6%	0.06	17%	0.172	C	C	.	.	B	Isolated β-bridge	trans	-135.5	129.8	176.7	-54.1	-154.4	-175.5	-131	-5.5	110.6	D399 D402 M406 A409 I448 E452 A453	D399-R450 IonicContact OD1-CZ 2.85Å; D399-R450 IonicContact OD1-NH1 3.89Å; D399-R450 PolarHBondContact OD1-NH1 3.09Å; D399-R450 IonicContact OD1-NH2 3.91Å; D399-R450 PolarHBondContact OD1-NH2 3.09Å; D402-R450 IonicContact OD2-NH2 3.03Å; M406-R450 HydrophobicContact CB-CB 3.67Å; M406-R450 HydrophobicContact CE-CB 4.11Å; M406-R450 HydrophobicContact CE-CG 4.01Å; M406-R450 CarbonylContact O-C 3.45Å; A409-R450 HydrophobicContact CB-CG 4.37Å; I448-R450 PolarHBondContact O-N 3.28Å; R450-E452 PolarHBondContact O-N 3.01Å; R450-E452 VanDerWaalsContact O-N 3.14Å; R450-A453 PolarHBondContact N-O 2.87Å; R450-A453 WeakPolarHBondContact O-CB 3.26Å; R450-A453 PolarHBondContact O-N 3.43Å
451	G	82.6	Confident	89.9	Confident	29 Å²	29	30.6 Å²	30.6	30%	0.299	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.3	-120.5	-178.2	0	0	0	0	0	111.7	M406 K410	M406-G451 WeakPolarHBondContact O-CA 3.37Å; M406-G451 PolarHBondContact O-N 2.78Å; K410-G451 WeakPolarHBondContact CE-O 3.11Å; K410-G451 PolarHBondContact NZ-O 2.92Å
452	E	82.1	Confident	89.4	Confident	204 Å²	204	35.2 Å²	35.2	95%	0.953	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-12.3	175	-61.7	-172.3	159.9	0	0	113.5	R450	R450-E452 PolarHBondContact O-N 3.01Å; R450-E452 VanDerWaalsContact O-N 3.14Å
453	A	83.6	Confident	88.9	Confident	35 Å²	35	42.6 Å²	42.6	29%	0.289	22%	0.224	S	C	.	.	B	Isolated β-bridge	trans	-81.6	134.3	-178.2	0	0	0	0	0	112	M406 P449 R450	M406-A453 HydrophobicContact SD-CB 4.01Å; P449-A453 CarbonylContact C-O 3.46Å; P449-A453 VanDerWaalsContact CA-O 3.31Å; P449-A453 WeakPolarHBondContact CA-O 3.5Å; R450-A453 PolarHBondContact N-O 2.87Å; R450-A453 WeakPolarHBondContact O-CB 3.26Å; R450-A453 PolarHBondContact O-N 3.43Å
454	G	85	Confident	88.4	Confident	30 Å²	30	44.7 Å²	44.7	31%	0.309	24%	0.236	S	C	.	.	S	Bend	trans	-79.9	-27.3	173.4	0	0	0	0	0	113.5	S422 I447	S422-G454 PolarHBondContact OG-O 2.76Å; I447-G454 CarbonylContact C-O 3.58Å; I447-G454 VanDerWaalsContact O-O 3.1Å
455	G	88.6	Confident	87.9	Confident	8 Å²	8	47.3 Å²	47.3	8%	0.082	25%	0.25	C	S	.	.			trans	-160.6	-177.8	178.1	0	0	0	0	0	110.6	T446	T446-G455 CarbonylContact O-C 3.55Å; T446-G455 WeakPolarHBondContact O-CA 3.49Å
456	L	91	Very high	87.3	Confident	41 Å²	41	52.4 Å²	52.4	22%	0.215	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	129.1	174.1	177.6	68.9	0	0	0	111.5	M406 E426 V445 T446	M406-L456 HydrophobicContact CE-CB 3.72Å; M406-L456 HydrophobicContact CE-CD2 3.44Å; M406-L456 VanDerWaalsContact CE-CD2 3.44Å; M406-L456 HydrophobicContact CE-CG 4.12Å; M406-L456 HydrophobicContact SD-CB 3.78Å; M406-L456 HydrophobicContact SD-CD1 4.11Å; M406-L456 HydrophobicContact SD-CD2 3.77Å; M406-L456 HydrophobicContact SD-CG 4.08Å; E426-L456 PolarHBondContact OE1-N 2.77Å; E426-L456 VanDerWaalsContact OE2-C 3.27Å; V445-L456 WeakPolarHBondContact CA-O 3.29Å; T446-L456 HydrophobicContact CG2-CB 4.05Å; T446-L456 PolarHBondContact N-O 2.89Å; T446-L456 PolarHBondContact O-N 3.01Å
457	T	93.4	Very high	87.1	Confident	12 Å²	12	61 Å²	61	7%	0.074	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	114.4	160.7	-58.6	0	0	0	0	109.5	E426 H429 A430 L442 F459	E426-T457 PolarHBondContact O-OG1 3.17Å; E426-T457 PolarHBondContact OE2-N 3.38Å; E426-T457 PolarHBondContact OE2-OG1 2.95Å; H429-T457 HydrophobicContact CB-CG2 4.03Å; H429-T457 WeakPolarHBondContact CB-OG1 3.42Å; A430-T457 HydrophobicContact CB-CG2 4.15Å; L442-T457 HydrophobicContact CD1-CG2 3.5Å; T457-F459 HydrophobicContact CG2-CE1 3.75Å; T457-F459 HydrophobicContact CG2-CE2 4.39Å; T457-F459 HydrophobicContact CG2-CZ 3.57Å
458	S	91.9	Very high	87.1	Confident	9 Å²	9	63.7 Å²	63.7	6%	0.063	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	141.1	-179	-164.1	0	0	0	0	110.9	R401 H443 K444	R401-S458 PolarHBondContact NH1-OG 3.48Å; H443-S458 WeakPolarHBondContact CB-O 3.41Å; H443-S458 PolarHBondContact N-O 2.84Å; K444-S458 PolarHBondContact N-O 3.48Å; K444-S458 PolarHBondContact O-N 3.03Å
459	F	92.6	Very high	87.3	Confident	60 Å²	60	65.2 Å²	65.2	26%	0.263	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	151.5	178.2	-50.5	-74.3	0	0	0	110.7	A433 I440 P441 L442 T457 V479	A433-F459 HydrophobicContact CB-CD1 4.23Å; A433-F459 HydrophobicContact CB-CE1 3.48Å; A433-F459 VanDerWaalsContact CB-CE1 3.48Å; A433-F459 HydrophobicContact CB-CZ 4.38Å; I440-F459 HydrophobicContact CB-CB 4.09Å; I440-F459 HydrophobicContact CB-CG 4.49Å; I440-F459 HydrophobicContact CG2-CB 3.62Å; P441-F459 WeakPolarHBondContact O-CA 3.37Å; L442-F459 HydrophobicContact CD1-CE1 4.49Å; T457-F459 HydrophobicContact CG2-CE1 3.75Å; T457-F459 HydrophobicContact CG2-CE2 4.39Å; T457-F459 HydrophobicContact CG2-CZ 3.57Å; F459-V479 HydrophobicContact CE1-CG1 4.04Å; F459-V479 HydrophobicContact CE2-CG1 4.14Å; F459-V479 HydrophobicContact CZ-CG1 3.42Å; F459-V479 VanDerWaalsContact CZ-CG1 3.42Å
460	L	90.7	Very high	87.7	Confident	24 Å²	24	70.6 Å²	70.6	13%	0.126	37%	0.367	C	S	.	.			trans	-138.3	116	178.3	-172.3	70	0	0	0	109.4	K360 H363 P441 H443	K360-L460 HydrophobicContact CG-CD2 3.75Å; H363-L460 HydrophobicContact CB-CD1 3.56Å; H363-L460 HydrophobicContact CB-CD2 4.4Å; H363-L460 HydrophobicContact CB-CG 3.96Å; H363-L460 VanDerWaalsContact O-CD1 3.29Å; H363-L460 WeakPolarHBondContact O-CD1 3.18Å; P441-L460 PolarHBondContact O-N 2.85Å; H443-L460 HydrophobicContact CB-CB 3.69Å
461	Q	85.3	Confident	88.1	Confident	42 Å²	42	71.9 Å²	71.9	20%	0.196	38%	0.381	C	S	.	.			trans	-78	143.9	174.2	-68.8	173.4	-4.9	0	0	110	H363 I440 K463	H363-Q461 WeakPolarHBondContact CB-O 3.15Å; H363-Q461 PolarHBondContact ND1-O 3.42Å; I440-Q461 HydrophobicContact CG2-CG 3.49Å; I440-Q461 VanDerWaalsContact CG2-CG 3.49Å; Q461-K463 VanDerWaalsContact C-N 3.28Å; Q461-K463 WeakPolarHBondContact CB-O 3.33Å
462	E	83.1	Confident	88.8	Confident	138 Å²	138	72.7 Å²	72.7	65%	0.645	38%	0.377	S	S	*	.	S	Bend	trans	-77.1	-17.1	175.1	-64	178.2	179.8	0	0	112.7	H363	H363-E462 VanDerWaalsContact CE1-C 3.49Å; H363-E462 PolarHBondContact CE1-O 2.64Å; H363-E462 PolarHBondContact ND1-O 3.3Å; H363-E462 PolarHBondContact NE2-O 2.92Å
463	K	84.7	Confident	89.5	Confident	157 Å²	157	63.4 Å²	63.4	68%	0.683	33%	0.333	S	S	*	.	S	Bend	trans	-147.2	148.8	-179.5	-62.5	-176.1	-177.2	178.2	0	109.8	Q461 I465	Q461-K463 VanDerWaalsContact C-N 3.28Å; Q461-K463 WeakPolarHBondContact CB-O 3.33Å; K463-I465 PolarHBondContact O-N 3.47Å; K463-I465 VanDerWaalsContact O-N 3.15Å
464	D	83.4	Confident	90.1	Very high	60 Å²	60	63.1 Å²	63.1	32%	0.321	33%	0.327	S	S	.	.			trans	-67.6	109.9	168.9	-71.6	12.8	0	0	0	108.2	R339	R339-D464 IonicContact CZ-OD1 3.84Å; R339-D464 IonicContact CZ-OD2 3.08Å; R339-D464 VanDerWaalsContact CZ-OD2 3.28Å; R339-D464 IonicContact NH1-OD2 2.8Å; R339-D464 PolarHBondContact NH1-OD2 3.16Å; R339-D464 IonicContact NH2-OD1 3.45Å; R339-D464 PolarHBondContact NH2-OD1 3.03Å; R339-D464 IonicContact NH2-OD2 3.04Å; R339-D464 PolarHBondContact NH2-OD2 2.99Å
465	I	83.3	Confident	90.7	Very high	70 Å²	70	61.8 Å²	61.8	36%	0.359	31%	0.313	S	S	.	.			trans	-100.4	123.6	177	55	175.6	0	0	0	110.3	K463 M468	K463-I465 PolarHBondContact O-N 3.47Å; K463-I465 VanDerWaalsContact O-N 3.15Å; I465-M468 HydrophobicContact CD1-CE 3.8Å; I465-M468 HydrophobicContact CD1-CG 4.16Å
466	S	81.4	Confident	91.1	Very high	107 Å²	107	63.8 Å²	63.8	75%	0.748	32%	0.32	S	S	*	.	S	Bend	trans	-83.8	-25.9	174.5	-50.9	0	0	0	0	112.7
467	F	89.7	Confident	91.5	Very high	183 Å²	183	61.8 Å²	61.8	80%	0.803	31%	0.31	S	S	*	.			trans	-127	140.1	-176.1	-52.4	-71.4	0	0	0	109.9
468	M	91.9	Very high	91.7	Very high	58 Å²	58	61.9 Å²	61.9	29%	0.286	31%	0.31	S	S	.	.			trans	-115.8	138.7	176.1	-56	-167.8	88.5	0	0	110.5	I440 I465 Q472 L473 Q476	I440-M468 HydrophobicContact CD1-CE 4.41Å; I465-M468 HydrophobicContact CD1-CE 3.8Å; I465-M468 HydrophobicContact CD1-CG 4.16Å; M468-Q472 VanDerWaalsContact CA-OE1 3.27Å; M468-Q472 HydrophobicContact CB-CB 4.4Å; M468-Q472 HydrophobicContact CE-CB 4.17Å; M468-L473 HydrophobicContact CB-CD2 4.07Å; M468-L473 HydrophobicContact CB-CG 4.17Å; M468-L473 HydrophobicContact SD-CD2 4.12Å; M468-Q476 PolarHBondContact SD-NE2 2.96Å
469	T	94.8	Very high	92	Very high	75 Å²	75	61.9 Å²	61.9	46%	0.46	31%	0.31	S	S	.	.			trans	-77	160.8	174.8	71.8	0	0	0	0	110.7	A471 Q472 L473	T469-A471 PolarHBondContact O-N 3.14Å; T469-Q472 PolarHBondContact O-N 2.97Å; T469-Q472 VanDerWaalsContact O-N 3.14Å; T469-Q472 WeakPolarHBondContact OG1-CG 3.48Å; T469-Q472 PolarHBondContact OG1-N 2.98Å; T469-L473 WeakPolarHBondContact O-CG 3.44Å; T469-L473 PolarHBondContact O-N 3.33Å; T469-L473 VanDerWaalsContact O-N 3.11Å
470	R	95.6	Very high	92.2	Very high	125 Å²	125	60.3 Å²	60.3	47%	0.472	30%	0.304	S	S	.	.	H	α-helix	trans	-54.8	-38.4	173.1	-174.1	174.8	177.7	-102.2	0.4	111.9	L473 L474 M514 F520	R470-L473 PolarHBondContact O-N 2.94Å; R470-L474 HydrophobicContact CG-CD1 4.2Å; R470-L474 HydrophobicContact CG-CG 4.46Å; R470-L474 VanDerWaalsContact O-CG 3.3Å; R470-L474 WeakPolarHBondContact O-CG 3.46Å; R470-L474 PolarHBondContact O-N 2.68Å; R470-M514 HydrophobicContact CG-CE 4.37Å; R470-F520 HydrophobicContact CB-CD1 3.95Å; R470-F520 HydrophobicContact CB-CE1 3.78Å; R470-F520 HydrophobicContact CB-CG 4.48Å; R470-F520 HydrophobicContact CB-CZ 4.18Å; R470-F520 HydrophobicContact CG-CD1 4.01Å; R470-F520 HydrophobicContact CG-CE1 4.36Å; R470-F520 HydrophobicContact CG-CG 4.2Å
471	A	96.2	Very high	92.6	Very high	42 Å²	42	59.3 Å²	59.3	35%	0.347	30%	0.298	S	S	.	.	H	α-helix	trans	-63.4	-44.2	178.1	0	0	0	0	0	111.9	D438 T469 L473 L474 A475	D438-A471 HydrophobicContact CB-CB 4.34Å; D438-A471 WeakPolarHBondContact OD2-CB 3.05Å; T469-A471 PolarHBondContact O-N 3.14Å; A471-L473 VanDerWaalsContact C-N 3.32Å; A471-L473 PolarHBondContact O-N 3.41Å; A471-L474 PolarHBondContact O-N 2.64Å; A471-A475 WeakPolarHBondContact O-CB 3.3Å; A471-A475 PolarHBondContact O-N 2.85Å
472	Q	95.7	Very high	93.1	Very high	46 Å²	46	57.3 Å²	57.3	22%	0.215	29%	0.289	C	S	.	.	H	α-helix	trans	-64.3	-33.9	176.7	-70	173.5	-37.6	0	0	113	D438 M468 T469 Q476	D438-Q472 HydrophobicContact CB-CG 3.86Å; D438-Q472 WeakPolarHBondContact O-CG 3.36Å; M468-Q472 VanDerWaalsContact CA-OE1 3.27Å; M468-Q472 HydrophobicContact CB-CB 4.4Å; M468-Q472 HydrophobicContact CE-CB 4.17Å; T469-Q472 PolarHBondContact O-N 2.97Å; T469-Q472 VanDerWaalsContact O-N 3.14Å; T469-Q472 WeakPolarHBondContact OG1-CG 3.48Å; T469-Q472 PolarHBondContact OG1-N 2.98Å; Q472-Q476 PolarHBondContact O-N 3.17Å; Q472-Q476 VanDerWaalsContact O-N 3.08Å; Q472-Q476 PolarHBondContact O-NE2 3.12Å
473	L	96.8	Very high	93.8	Very high	9 Å²	9	50.7 Å²	50.7	5%	0.047	26%	0.258	C	S	.	.	H	α-helix	trans	-72.7	-40.5	175.8	-63.1	168.1	0	0	0	111.5	M468 T469 R470 A471 A475 Q476 L477 L510 M514 F518 F520	M468-L473 HydrophobicContact CB-CD2 4.07Å; M468-L473 HydrophobicContact CB-CG 4.17Å; M468-L473 HydrophobicContact SD-CD2 4.12Å; T469-L473 WeakPolarHBondContact O-CG 3.44Å; T469-L473 PolarHBondContact O-N 3.33Å; T469-L473 VanDerWaalsContact O-N 3.11Å; R470-L473 PolarHBondContact O-N 2.94Å; A471-L473 VanDerWaalsContact C-N 3.32Å; A471-L473 PolarHBondContact O-N 3.41Å; L473-A475 VanDerWaalsContact C-N 3.32Å; L473-Q476 PolarHBondContact O-N 3.17Å; L473-L477 PolarHBondContact O-N 3.02Å; L473-L510 HydrophobicContact CD2-CD1 3.8Å; L473-M514 HydrophobicContact CB-CE 4.01Å; L473-M514 HydrophobicContact CB-CG 4.45Å; L473-M514 HydrophobicContact CB-SD 3.9Å; L473-M514 HydrophobicContact CD1-CG 4.24Å; L473-F518 HydrophobicContact CD1-CD2 4.06Å; L473-F518 HydrophobicContact CD1-CE2 4.31Å; L473-F520 HydrophobicContact CD1-CD2 3.96Å; L473-F520 HydrophobicContact CD1-CE2 3.26Å; L473-F520 HydrophobicContact CD1-CZ 4.05Å
474	L	97.8	Very high	94.3	Very high	30 Å²	30	45 Å²	45	16%	0.157	23%	0.233	C	C	.	.	H	α-helix	trans	-63.2	-39.2	172.4	-69.7	173.2	0	0	0	111.5	R470 A471 Q476 L477 D478 M514 L552	R470-L474 HydrophobicContact CG-CD1 4.2Å; R470-L474 HydrophobicContact CG-CG 4.46Å; R470-L474 VanDerWaalsContact O-CG 3.3Å; R470-L474 WeakPolarHBondContact O-CG 3.46Å; R470-L474 PolarHBondContact O-N 2.68Å; A471-L474 PolarHBondContact O-N 2.64Å; L474-Q476 VanDerWaalsContact C-N 3.33Å; L474-Q476 PolarHBondContact O-N 2.83Å; L474-L477 HydrophobicContact CD2-CD1 4.37Å; L474-L477 WeakPolarHBondContact O-CB 3.43Å; L474-L477 PolarHBondContact O-N 3.22Å; L474-D478 VanDerWaalsContact O-CG 3.3Å; L474-D478 PolarHBondContact O-N 3.27Å; L474-M514 HydrophobicContact CD2-CE 3.95Å; L474-M514 HydrophobicContact CG-CE 4.19Å; L474-L552 HydrophobicContact CD2-CD2 4.08Å
475	A	97.4	Very high	95	Very high	2 Å²	2	42.2 Å²	42.2	2%	0.017	22%	0.217	C	C	.	.	H	α-helix	trans	-63.5	-38.4	175.6	0	0	0	0	0	112	T436 A471 L473 D478 V479	T436-A475 HydrophobicContact CG2-CB 3.65Å; A471-A475 WeakPolarHBondContact O-CB 3.3Å; A471-A475 PolarHBondContact O-N 2.85Å; L473-A475 VanDerWaalsContact C-N 3.32Å; A475-D478 PolarHBondContact O-N 3.07Å; A475-V479 WeakPolarHBondContact O-CG2 3.47Å; A475-V479 PolarHBondContact O-N 2.58Å
476	Q	97	Very high	95.6	Very high	49 Å²	49	38.9 Å²	38.9	23%	0.229	20%	0.2	C	C	.	.	H	α-helix	trans	-64.4	-41.5	172.7	-81.2	173.9	78.9	0	0	112.8	I440 M468 Q472 L473 L474 D478 V479 L480 L510	I440-Q476 HydrophobicContact CD1-CG 4.29Å; M468-Q476 PolarHBondContact SD-NE2 2.96Å; Q472-Q476 PolarHBondContact O-N 3.17Å; Q472-Q476 VanDerWaalsContact O-N 3.08Å; Q472-Q476 PolarHBondContact O-NE2 3.12Å; L473-Q476 PolarHBondContact O-N 3.17Å; L474-Q476 VanDerWaalsContact C-N 3.33Å; L474-Q476 PolarHBondContact O-N 2.83Å; Q476-D478 VanDerWaalsContact C-N 3.29Å; Q476-D478 PolarHBondContact O-N 3.22Å; Q476-V479 PolarHBondContact O-N 2.75Å; Q476-L480 VanDerWaalsContact O-CG 3.28Å; Q476-L480 WeakPolarHBondContact O-CG 3.48Å; Q476-L480 PolarHBondContact O-N 3.5Å; Q476-L510 HydrophobicContact CB-CD2 3.76Å
477	L	98	Very high	96.2	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-58.1	-45.7	172.3	-71	175.8	0	0	0	110.6	L473 L474 V479 L480 M481 A507 L510 A511 M514 L552 L553 S556	L473-L477 PolarHBondContact O-N 3.02Å; L474-L477 HydrophobicContact CD2-CD1 4.37Å; L474-L477 WeakPolarHBondContact O-CB 3.43Å; L474-L477 PolarHBondContact O-N 3.22Å; L477-V479 VanDerWaalsContact C-N 3.34Å; L477-V479 PolarHBondContact O-N 2.76Å; L477-L480 PolarHBondContact O-N 2.88Å; L477-L480 VanDerWaalsContact O-N 3.15Å; L477-M481 WeakPolarHBondContact O-CG 3.4Å; L477-M481 PolarHBondContact O-N 3.15Å; L477-A507 HydrophobicContact CD2-CB 3.9Å; L477-A507 WeakPolarHBondContact CD2-O 3.28Å; L477-L510 HydrophobicContact CD2-CB 4.08Å; L477-L510 HydrophobicContact CD2-CD2 3.87Å; L477-L510 HydrophobicContact CD2-CG 4.14Å; L477-L510 HydrophobicContact CG-CD2 3.95Å; L477-L510 HydrophobicContact CG-CG 4.41Å; L477-A511 HydrophobicContact CD2-CB 4.45Å; L477-M514 HydrophobicContact CD1-SD 3.88Å; L477-L552 HydrophobicContact CD1-CB 4.49Å; L477-L553 HydrophobicContact CD2-CD2 4.18Å; L477-S556 PolarHBondContact O-OG 2.81Å
478	D	98.3	Very high	96.5	Very high	13 Å²	13	27.6 Å²	27.6	7%	0.07	14%	0.138	C	C	.	.	H	α-helix	trans	-60.8	-44.2	179.6	-68.2	-4	0	0	0	111.2	V432 T436 L474 A475 Q476 L480 M481 G482 S556 R559 V560	V432-D478 HydrophobicContact CG1-CB 4.18Å; V432-D478 WeakPolarHBondContact CG1-O 3.43Å; T436-D478 HydrophobicContact CG2-CB 4.37Å; L474-D478 VanDerWaalsContact O-CG 3.3Å; L474-D478 PolarHBondContact O-N 3.27Å; A475-D478 PolarHBondContact O-N 3.07Å; Q476-D478 VanDerWaalsContact C-N 3.29Å; Q476-D478 PolarHBondContact O-N 3.22Å; D478-L480 PolarHBondContact O-N 2.92Å; D478-M481 PolarHBondContact O-N 2.88Å; D478-G482 PolarHBondContact O-N 2.83Å; D478-S556 VanDerWaalsContact CA-OG 3.27Å; D478-S556 WeakPolarHBondContact CA-OG 3.35Å; D478-S556 PolarHBondContact N-OG 3.46Å; D478-S556 VanDerWaalsContact N-OG 3.16Å; D478-S556 VanDerWaalsContact OD1-CA 3.31Å; D478-S556 WeakPolarHBondContact OD1-CA 3.37Å; D478-S556 VanDerWaalsContact OD1-CB 3.27Å; D478-S556 WeakPolarHBondContact OD1-CB 3.48Å; D478-S556 PolarHBondContact OD1-OG 2.86Å; D478-R559 IonicContact OD1-CZ 3.38Å; D478-R559 IonicContact OD1-NE 3.43Å; D478-R559 PolarHBondContact OD1-NE 3.49Å; D478-R559 IonicContact OD1-NH2 3.04Å; D478-R559 PolarHBondContact OD1-NH2 3.26Å; D478-R559 IonicContact OD2-CZ 2.86Å; D478-R559 IonicContact OD2-NE 3.49Å; D478-R559 PolarHBondContact OD2-NE 3.39Å; D478-R559 IonicContact OD2-NH2 2.71Å; D478-V560 HydrophobicContact CB-CG2 3.61Å; D478-V560 WeakPolarHBondContact O-CG2 3.26Å
479	V	97.9	Very high	96.6	Very high	10 Å²	10	28.1 Å²	28.1	6%	0.061	14%	0.142	C	C	.	.	H	α-helix	trans	-60.1	-44.5	174.9	171.9	0	0	0	0	111.4	H429 V432 A433 F459 A475 Q476 L477 M481 G482	H429-V479 PolarHBondContact CE1-O 2.81Å; H429-V479 PolarHBondContact ND1-O 3.45Å; V432-V479 HydrophobicContact CG1-CG2 4.13Å; A433-V479 HydrophobicContact CB-CG1 4.42Å; A433-V479 HydrophobicContact CB-CG2 3.82Å; F459-V479 HydrophobicContact CE1-CG1 4.04Å; F459-V479 HydrophobicContact CE2-CG1 4.14Å; F459-V479 HydrophobicContact CZ-CG1 3.42Å; F459-V479 VanDerWaalsContact CZ-CG1 3.42Å; A475-V479 WeakPolarHBondContact O-CG2 3.47Å; A475-V479 PolarHBondContact O-N 2.58Å; Q476-V479 PolarHBondContact O-N 2.75Å; L477-V479 VanDerWaalsContact C-N 3.34Å; L477-V479 PolarHBondContact O-N 2.76Å; V479-M481 PolarHBondContact O-N 2.85Å; V479-G482 PolarHBondContact O-N 2.82Å
480	L	98.1	Very high	96.6	Very high	26 Å²	26	27.1 Å²	27.1	14%	0.136	14%	0.136	C	C	.	.	H	α-helix	trans	-62.7	-29.3	178.8	-69.6	165.5	0	0	0	112.5	H429 Q476 L477 D478 G482 D503 K506 A507	H429-L480 PolarHBondContact CE1-O 3.12Å; Q476-L480 VanDerWaalsContact O-CG 3.28Å; Q476-L480 WeakPolarHBondContact O-CG 3.48Å; Q476-L480 PolarHBondContact O-N 3.5Å; L477-L480 PolarHBondContact O-N 2.88Å; L477-L480 VanDerWaalsContact O-N 3.15Å; D478-L480 PolarHBondContact O-N 2.92Å; L480-G482 VanDerWaalsContact C-N 3.31Å; L480-D503 HydrophobicContact CB-CB 4.43Å; L480-D503 HydrophobicContact CD2-CB 4.23Å; L480-D503 WeakPolarHBondContact O-CB 3.31Å; L480-K506 HydrophobicContact CD1-CB 4Å; L480-K506 HydrophobicContact CD2-CB 3.89Å; L480-K506 HydrophobicContact CD2-CD 3.99Å; L480-A507 HydrophobicContact CB-CB 4.12Å; L480-A507 HydrophobicContact CD1-CB 3.92Å
481	M	97.7	Very high	96.5	Very high	3 Å²	3	23.3 Å²	23.3	2%	0.015	12%	0.123	C	C	.	.	H	α-helix	trans	-78.8	-14	174.5	-62	-52.5	175.7	0	0	113.8	L477 D478 V479 G483 V485 F504 A507 L553 S556 L557 V560	L477-M481 WeakPolarHBondContact O-CG 3.4Å; L477-M481 PolarHBondContact O-N 3.15Å; D478-M481 PolarHBondContact O-N 2.88Å; V479-M481 PolarHBondContact O-N 2.85Å; M481-G483 PolarHBondContact O-N 2.84Å; M481-V485 WeakPolarHBondContact O-CG2 3.47Å; M481-V485 PolarHBondContact O-N 3.21Å; M481-V485 VanDerWaalsContact O-N 3.17Å; M481-F504 HydrophobicContact SD-CD1 4.08Å; M481-F504 HydrophobicContact SD-CE1 3.77Å; M481-A507 HydrophobicContact CE-CB 3.98Å; M481-L553 HydrophobicContact CE-CB 4.06Å; M481-L553 HydrophobicContact CE-CD2 3.56Å; M481-L553 HydrophobicContact CE-CG 4.4Å; M481-S556 WeakPolarHBondContact CG-OG 3.36Å; M481-L557 HydrophobicContact CB-CD2 3.93Å; M481-L557 HydrophobicContact CB-CG 4.47Å; M481-L557 HydrophobicContact CE-CG 4.22Å; M481-L557 HydrophobicContact CG-CD2 3.89Å; M481-L557 HydrophobicContact CG-CG 3.95Å; M481-L557 HydrophobicContact SD-CD1 4.38Å; M481-L557 HydrophobicContact SD-CD2 3.55Å; M481-L557 VanDerWaalsContact SD-CD2 3.55Å; M481-L557 HydrophobicContact SD-CG 3.65Å; M481-V560 HydrophobicContact CB-CB 4.28Å; M481-V560 HydrophobicContact CB-CG1 4.33Å; M481-V560 HydrophobicContact CB-CG2 4.11Å
482	G	97.1	Very high	96.4	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-58.7	-42.2	-173.8	0	0	0	0	0	114	G428 D478 V479 L480 G486	G428-G482 WeakPolarHBondContact CA-O 3.49Å; D478-G482 PolarHBondContact O-N 2.83Å; V479-G482 PolarHBondContact O-N 2.82Å; L480-G482 VanDerWaalsContact C-N 3.31Å; G482-G486 PolarHBondContact O-N 3.37Å
483	G	96.2	Very high	96.2	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-62.5	-54.8	-179.9	0	0	0	0	0	113	H425 H429 M481 V485 G486 E487	H425-G483 WeakPolarHBondContact O-CA 3.41Å; H429-G483 PolarHBondContact CE1-N 2.8Å; H429-G483 VanDerWaalsContact CE1-N 3.35Å; H429-G483 WeakPolarHBondContact NE2-CA 3.29Å; H429-G483 PolarHBondContact NE2-N 3Å; M481-G483 PolarHBondContact O-N 2.84Å; G483-V485 PolarHBondContact O-N 3.3Å; G483-G486 PolarHBondContact O-N 2.71Å; G483-E487 PolarHBondContact O-N 3.46Å
484	R	96.7	Very high	96	Very high	38 Å²	38	31.5 Å²	31.5	14%	0.143	18%	0.179	C	C	.	.	H	α-helix	trans	-56.2	-49	177.6	170.5	62.8	76.4	-133	11.2	111.7	G486 E487 E488 T497 A500 F504	R484-G486 VanDerWaalsContact C-N 3.34Å; R484-E487 IonicContact NH1-OE2 3.58Å; R484-E487 PolarHBondContact NH1-OE2 3.22Å; R484-E487 PolarHBondContact O-N 3.45Å; R484-E488 WeakPolarHBondContact O-CB 3.17Å; R484-E488 PolarHBondContact O-N 2.8Å; R484-T497 PolarHBondContact NH1-O 3.45Å; R484-T497 PolarHBondContact NH2-O 3.08Å; R484-A500 HydrophobicContact CB-CB 3.99Å; R484-F504 HydrophobicContact CB-CZ 3.91Å; R484-F504 HydrophobicContact CG-CZ 3.86Å
485	V	97.1	Very high	95.7	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-67.3	-38.7	-176.7	172.6	0	0	0	0	111	M481 G483 E487 E488 L489 L557 V560 R561 L564	M481-V485 WeakPolarHBondContact O-CG2 3.47Å; M481-V485 PolarHBondContact O-N 3.21Å; M481-V485 VanDerWaalsContact O-N 3.17Å; G483-V485 PolarHBondContact O-N 3.3Å; V485-E487 VanDerWaalsContact C-N 3.35Å; V485-E487 PolarHBondContact O-N 2.99Å; V485-E488 PolarHBondContact O-N 3.13Å; V485-L489 HydrophobicContact CG1-CD1 3.92Å; V485-L489 HydrophobicContact CG1-CG 4.2Å; V485-L489 VanDerWaalsContact O-CG 3.3Å; V485-L489 WeakPolarHBondContact O-CG 3.45Å; V485-L489 PolarHBondContact O-N 3.38Å; V485-L557 HydrophobicContact CG2-CD2 4Å; V485-V560 HydrophobicContact CB-CG1 3.86Å; V485-V560 HydrophobicContact CG1-CG1 4.08Å; V485-V560 HydrophobicContact CG2-CB 4.38Å; V485-V560 HydrophobicContact CG2-CG1 3.88Å; V485-R561 HydrophobicContact CB-CG 4.46Å; V485-R561 HydrophobicContact CG1-CB 4.31Å; V485-R561 HydrophobicContact CG1-CG 3.74Å; V485-R561 HydrophobicContact CG2-CG 3.85Å; V485-L564 HydrophobicContact CB-CD1 4.04Å; V485-L564 HydrophobicContact CG1-CB 4.19Å; V485-L564 HydrophobicContact CG1-CD1 3.76Å; V485-L564 HydrophobicContact CG1-CG 4.5Å
486	G	95.5	Very high	95.5	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-58.6	-44.9	174.6	0	0	0	0	0	112.4	G482 G483 R484 H571	G482-G486 PolarHBondContact O-N 3.37Å; G483-G486 PolarHBondContact O-N 2.71Å; R484-G486 VanDerWaalsContact C-N 3.34Å; G486-H571 VanDerWaalsContact CA-CE1 3.49Å; G486-H571 WeakPolarHBondContact CA-CE1 3.49Å; G486-H571 PolarHBondContact O-CE1 3.06Å; G486-H571 VanDerWaalsContact O-CE1 3.24Å
487	E	95.5	Very high	95.3	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-62.5	-49.6	173.5	-72.1	178.4	-152.5	0	0	112.1	V421 H425 G483 R484 V485 L489 V490 F491 T497	V421-E487 HydrophobicContact CG1-CG 4.17Å; H425-E487 HydrophobicContact CB-CG 4.1Å; H425-E487 IonicContact CE1-OE1 2.96Å; H425-E487 IonicContact CG-OE1 3.73Å; H425-E487 IonicContact ND1-OE1 2.72Å; H425-E487 PolarHBondContact ND1-OE1 2.71Å; G483-E487 PolarHBondContact O-N 3.46Å; R484-E487 IonicContact NH1-OE2 3.58Å; R484-E487 PolarHBondContact NH1-OE2 3.22Å; R484-E487 PolarHBondContact O-N 3.45Å; V485-E487 VanDerWaalsContact C-N 3.35Å; V485-E487 PolarHBondContact O-N 2.99Å; E487-L489 VanDerWaalsContact C-N 3.32Å; E487-L489 PolarHBondContact O-N 3.33Å; E487-V490 PolarHBondContact O-N 3.43Å; E487-F491 HydrophobicContact CB-CD2 4.2Å; E487-F491 WeakPolarHBondContact O-CD2 3.39Å; E487-F491 PolarHBondContact O-N 3.36Å; E487-T497 PolarHBondContact OE1-OG1 2.93Å; E487-T497 PolarHBondContact OE2-N 3.45Å; E487-T497 PolarHBondContact OE2-OG1 3.35Å; E487-T497 VanDerWaalsContact OE2-OG1 3.06Å
488	E	96	Very high	95	Very high	53 Å²	53	45.7 Å²	45.7	25%	0.248	25%	0.252	C	S	.	.	H	α-helix	trans	-58.2	-42.5	-175.6	-170.7	-173.9	151.3	0	0	111.8	R484 V485 V490 G492 V496 R561	R484-E488 WeakPolarHBondContact O-CB 3.17Å; R484-E488 PolarHBondContact O-N 2.8Å; V485-E488 PolarHBondContact O-N 3.13Å; E488-V490 VanDerWaalsContact C-N 3.28Å; E488-V490 PolarHBondContact O-N 2.96Å; E488-G492 WeakPolarHBondContact O-CA 3.27Å; E488-G492 PolarHBondContact O-N 3.28Å; E488-V496 HydrophobicContact CB-CG1 3.93Å; E488-V496 HydrophobicContact CG-CG1 4.29Å; E488-R561 IonicContact OE1-CZ 3.84Å; E488-R561 IonicContact OE1-NE 2.59Å; E488-R561 PolarHBondContact OE1-NE 3.2Å; E488-R561 IonicContact OE1-NH2 2.8Å; E488-R561 PolarHBondContact OE1-NH2 3.02Å; E488-R561 IonicContact OE2-CZ 3.07Å; E488-R561 IonicContact OE2-NE 3.99Å; E488-R561 PolarHBondContact OE2-NE 2.93Å; E488-R561 IonicContact OE2-NH2 3.28Å; E488-R561 PolarHBondContact OE2-NH2 3.23Å
489	L	94.3	Very high	94.6	Very high	69 Å²	69	47.1 Å²	47.1	36%	0.361	27%	0.27	S	S	.	.	H	α-helix	trans	-67.6	-25.4	-178.7	-71.6	175.5	0	0	0	113.9	V485 E487 L564 S565	V485-L489 HydrophobicContact CG1-CD1 3.92Å; V485-L489 HydrophobicContact CG1-CG 4.2Å; V485-L489 VanDerWaalsContact O-CG 3.3Å; V485-L489 WeakPolarHBondContact O-CG 3.45Å; V485-L489 PolarHBondContact O-N 3.38Å; E487-L489 VanDerWaalsContact C-N 3.32Å; E487-L489 PolarHBondContact O-N 3.33Å; L489-L564 HydrophobicContact CD1-CB 3.55Å; L489-S565 WeakPolarHBondContact CD2-OG 3.42Å
490	V	94.2	Very high	94.3	Very high	54 Å²	54	46.7 Å²	46.7	33%	0.327	27%	0.268	S	S	.	.	H	α-helix	trans	-103.3	-41.8	-174	176.2	0	0	0	0	112	F424 E487 E488	F424-V490 HydrophobicContact CD1-CB 4.11Å; F424-V490 HydrophobicContact CD1-CG1 3.95Å; F424-V490 HydrophobicContact CD1-CG2 3.62Å; F424-V490 HydrophobicContact CD2-CG1 4.42Å; F424-V490 HydrophobicContact CE1-CB 4.3Å; F424-V490 HydrophobicContact CE1-CG1 3.76Å; F424-V490 HydrophobicContact CE1-CG2 3.77Å; F424-V490 HydrophobicContact CE2-CG1 4.32Å; F424-V490 HydrophobicContact CG-CG1 4.27Å; F424-V490 HydrophobicContact CG-CG2 4.46Å; F424-V490 HydrophobicContact CZ-CG1 3.98Å; E487-V490 PolarHBondContact O-N 3.43Å; E488-V490 VanDerWaalsContact C-N 3.28Å; E488-V490 PolarHBondContact O-N 2.96Å
491	F	93.9	Very high	94.2	Very high	45 Å²	45	48.3 Å²	48.3	20%	0.197	29%	0.285	C	S	.	.	H	α-helix	trans	-99	-15.2	-176.3	-54.2	-67.1	0	0	0	113.2	R420 V421 F424 E487 K495	R420-F491 HydrophobicContact CG-CE1 4.38Å; R420-F491 HydrophobicContact CG-CZ 4.16Å; V421-F491 HydrophobicContact CB-CE2 4.4Å; V421-F491 HydrophobicContact CG2-CE2 4.05Å; V421-F491 HydrophobicContact CG2-CZ 4.06Å; F424-F491 HydrophobicContact CB-CE2 3.89Å; F424-F491 HydrophobicContact CB-CZ 4.23Å; F424-F491 HydrophobicContact CD2-CE2 4.17Å; F424-F491 AromaticContact CD2-CZ 3.64Å; F424-F491 HydrophobicContact CD2-CZ 3.64Å; F424-F491 HydrophobicContact CE2-CZ 4.35Å; F424-F491 HydrophobicContact CG-CE2 4.21Å; F424-F491 HydrophobicContact CG-CZ 4.14Å; E487-F491 HydrophobicContact CB-CD2 4.2Å; E487-F491 WeakPolarHBondContact O-CD2 3.39Å; E487-F491 PolarHBondContact O-N 3.36Å; F491-K495 HydrophobicContact CB-CB 3.67Å; F491-K495 HydrophobicContact CB-CD 4.44Å
492	G	93.4	Very high	94	Very high	32 Å²	32	51.2 Å²	51.2	33%	0.33	30%	0.301	S	S	.	.			trans	84.8	166.1	-173.3	0	0	0	0	0	112.7	E488 D494 K495	E488-G492 WeakPolarHBondContact O-CA 3.27Å; E488-G492 PolarHBondContact O-N 3.28Å; G492-D494 VanDerWaalsContact C-N 3.28Å; G492-D494 PolarHBondContact O-N 3.38Å; G492-K495 PolarHBondContact O-N 3.22Å
493	A	91.8	Very high	94	Very high	67 Å²	67	52.1 Å²	52.1	55%	0.554	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-60.2	-33.7	-176	0	0	0	0	0	113.6	K495 V496	A493-K495 VanDerWaalsContact C-N 3.27Å; A493-K495 PolarHBondContact O-N 2.84Å; A493-V496 WeakPolarHBondContact O-CG2 3.48Å
494	D	92.7	Very high	94	Very high	169 Å²	169	55.1 Å²	55.1	90%	0.904	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-75.9	-14.2	-177	-61.4	-33.5	0	0	0	113.8	G492	G492-D494 VanDerWaalsContact C-N 3.28Å; G492-D494 PolarHBondContact O-N 3.38Å
495	K	91.8	Very high	94	Very high	146 Å²	146	60 Å²	60	64%	0.635	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-113.6	10.4	-175.1	-66.6	-171.8	-179.3	179.9	0	113.6	F491 G492 A493	F491-K495 HydrophobicContact CB-CB 3.67Å; F491-K495 HydrophobicContact CB-CD 4.44Å; G492-K495 PolarHBondContact O-N 3.22Å; A493-K495 VanDerWaalsContact C-N 3.27Å; A493-K495 PolarHBondContact O-N 2.84Å
496	V	92.6	Very high	94	Very high	46 Å²	46	64.4 Å²	64.4	28%	0.279	36%	0.356	S	S	.	.			trans	-68.1	140.2	173.1	-57.8	0	0	0	0	110.1	E488 A493	E488-V496 HydrophobicContact CB-CG1 3.93Å; E488-V496 HydrophobicContact CG-CG1 4.29Å; A493-V496 WeakPolarHBondContact O-CG2 3.48Å
497	T	92.2	Very high	94.1	Very high	45 Å²	45	64.4 Å²	64.4	28%	0.276	36%	0.356	S	S	.	.			trans	-96.8	175.9	-173.3	69.6	0	0	0	0	112.9	V421 R484 E487 G499	V421-T497 HydrophobicContact CG1-CG2 3.58Å; V421-T497 HydrophobicContact CG2-CG2 4.32Å; R484-T497 PolarHBondContact NH1-O 3.45Å; R484-T497 PolarHBondContact NH2-O 3.08Å; E487-T497 PolarHBondContact OE1-OG1 2.93Å; E487-T497 PolarHBondContact OE2-N 3.45Å; E487-T497 PolarHBondContact OE2-OG1 3.35Å; E487-T497 VanDerWaalsContact OE2-OG1 3.06Å; T497-G499 PolarHBondContact O-N 3.47Å; T497-G499 PolarHBondContact OG1-N 3.2Å
498	N	91.7	Very high	94.2	Very high	142 Å²	142	66.7 Å²	66.7	76%	0.759	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-80.3	3.8	170.4	64.3	-24.8	0	0	0	113.6	A500 A501	N498-A500 VanDerWaalsContact C-N 3.27Å; N498-A500 PolarHBondContact O-N 3.33Å; N498-A501 VanDerWaalsContact O-CB 3.29Å; N498-A501 WeakPolarHBondContact O-CB 3.13Å; N498-A501 PolarHBondContact O-N 3.39Å; N498-A501 VanDerWaalsContact O-N 3.17Å
499	G	89.4	Confident	94.3	Very high	43 Å²	43	67.7 Å²	67.7	44%	0.443	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-58.9	-33.7	-179	0	0	0	0	0	114.1	T497 A501	T497-G499 PolarHBondContact O-N 3.47Å; T497-G499 PolarHBondContact OG1-N 3.2Å; G499-A501 PolarHBondContact O-N 3.45Å; G499-A501 VanDerWaalsContact O-N 3.14Å
500	A	93.4	Very high	94.4	Very high	1 Å²	1	65.5 Å²	65.5	1%	0.008	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-74.4	3.3	179.4	0	0	0	0	0	115	R484 N498 D502 D503 F504	R484-A500 HydrophobicContact CB-CB 3.99Å; N498-A500 VanDerWaalsContact C-N 3.27Å; N498-A500 PolarHBondContact O-N 3.33Å; A500-D502 VanDerWaalsContact C-N 3.34Å; A500-D502 PolarHBondContact O-N 2.94Å; A500-D503 WeakPolarHBondContact CA-OD2 3.22Å; A500-D503 PolarHBondContact O-N 3.41Å; A500-F504 HydrophobicContact CB-CD2 4.15Å; A500-F504 HydrophobicContact CB-CE2 3.79Å; A500-F504 HydrophobicContact CB-CZ 4.28Å; A500-F504 WeakPolarHBondContact O-CD2 3.37Å; A500-F504 WeakPolarHBondContact O-CG 3.26Å; A500-F504 PolarHBondContact O-N 3.22Å
501	A	94.5	Very high	94.5	Very high	61 Å²	61	63 Å²	63	50%	0.504	35%	0.35	S	S	.	.	H	α-helix	trans	-60.5	-41.5	-176.8	0	0	0	0	0	112.7	N498 G499 R505	N498-A501 VanDerWaalsContact O-CB 3.29Å; N498-A501 WeakPolarHBondContact O-CB 3.13Å; N498-A501 PolarHBondContact O-N 3.39Å; N498-A501 VanDerWaalsContact O-N 3.17Å; G499-A501 PolarHBondContact O-N 3.45Å; G499-A501 VanDerWaalsContact O-N 3.14Å; A501-R505 WeakPolarHBondContact O-CB 3.29Å; A501-R505 PolarHBondContact O-N 3.24Å
502	D	93.5	Very high	94.6	Very high	63 Å²	63	64.1 Å²	64.1	34%	0.337	36%	0.356	S	S	.	.	H	α-helix	trans	-70.2	-35.9	178.3	-168.6	53.6	0	0	0	112.1	A500 R505 K506	A500-D502 VanDerWaalsContact C-N 3.34Å; A500-D502 PolarHBondContact O-N 2.94Å; D502-R505 WeakPolarHBondContact O-CB 3.42Å; D502-R505 PolarHBondContact O-N 2.97Å; D502-R505 IonicContact OD1-CZ 3.71Å; D502-R505 VanDerWaalsContact OD1-CZ 3.22Å; D502-R505 IonicContact OD1-NE 2.7Å; D502-R505 PolarHBondContact OD1-NE 3.02Å; D502-R505 IonicContact OD1-NH2 3.94Å; D502-R505 PolarHBondContact OD1-NH2 3.27Å; D502-K506 WeakPolarHBondContact O-CG 3.41Å; D502-K506 PolarHBondContact O-N 3.2Å; D502-K506 WeakPolarHBondContact OD2-CE 3.47Å; D502-K506 IonicContact OD2-NZ 3.09Å; D502-K506 PolarHBondContact OD2-NZ 3.33Å
503	D	96.7	Very high	94.7	Very high	19 Å²	19	64.2 Å²	64.2	10%	0.102	35%	0.349	C	S	.	.	H	α-helix	trans	-66.3	-43.1	177	-53	-49.3	0	0	0	111.4	H425 H429 L480 A500 K506 A507	H425-D503 IonicContact CE1-OD2 3.25Å; H425-D503 IonicContact NE2-OD2 3.36Å; H425-D503 PolarHBondContact NE2-OD2 2.93Å; H429-D503 IonicContact CE1-OD1 3.59Å; H429-D503 IonicContact CE1-OD2 3.2Å; H429-D503 IonicContact NE2-OD1 3.95Å; H429-D503 IonicContact NE2-OD2 2.78Å; H429-D503 PolarHBondContact NE2-OD2 2.81Å; L480-D503 HydrophobicContact CB-CB 4.43Å; L480-D503 HydrophobicContact CD2-CB 4.23Å; L480-D503 WeakPolarHBondContact O-CB 3.31Å; A500-D503 WeakPolarHBondContact CA-OD2 3.22Å; A500-D503 PolarHBondContact O-N 3.41Å; D503-K506 PolarHBondContact O-N 2.9Å; D503-A507 VanDerWaalsContact O-CB 3.26Å; D503-A507 WeakPolarHBondContact O-CB 3.38Å; D503-A507 PolarHBondContact O-N 3.46Å
504	F	97.3	Very high	94.8	Very high	64 Å²	64	61 Å²	61	28%	0.281	32%	0.322	S	S	.	.	H	α-helix	trans	-63.1	-43.1	173.7	-69	-44.9	0	0	0	111.8	M481 R484 A500 K506 A507 T508	M481-F504 HydrophobicContact SD-CD1 4.08Å; M481-F504 HydrophobicContact SD-CE1 3.77Å; R484-F504 HydrophobicContact CB-CZ 3.91Å; R484-F504 HydrophobicContact CG-CZ 3.86Å; A500-F504 HydrophobicContact CB-CD2 4.15Å; A500-F504 HydrophobicContact CB-CE2 3.79Å; A500-F504 HydrophobicContact CB-CZ 4.28Å; A500-F504 WeakPolarHBondContact O-CD2 3.37Å; A500-F504 WeakPolarHBondContact O-CG 3.26Å; A500-F504 PolarHBondContact O-N 3.22Å; F504-K506 VanDerWaalsContact C-N 3.34Å; F504-K506 PolarHBondContact O-N 3.03Å; F504-A507 PolarHBondContact O-N 3.28Å; F504-T508 WeakPolarHBondContact O-CB 3.3Å; F504-T508 PolarHBondContact O-N 3.32Å; F504-T508 PolarHBondContact O-OG1 2.7Å
505	R	97.1	Very high	94.9	Very high	140 Å²	140	53 Å²	53	53%	0.528	28%	0.279	S	S	.	.	H	α-helix	trans	-57.1	-47.7	175.3	-176.1	-174.3	67.7	90.4	-2	111.3	A501 D502 I509	A501-R505 WeakPolarHBondContact O-CB 3.29Å; A501-R505 PolarHBondContact O-N 3.24Å; D502-R505 WeakPolarHBondContact O-CB 3.42Å; D502-R505 PolarHBondContact O-N 2.97Å; D502-R505 IonicContact OD1-CZ 3.71Å; D502-R505 VanDerWaalsContact OD1-CZ 3.22Å; D502-R505 IonicContact OD1-NE 2.7Å; D502-R505 PolarHBondContact OD1-NE 3.02Å; D502-R505 IonicContact OD1-NH2 3.94Å; D502-R505 PolarHBondContact OD1-NH2 3.27Å; R505-I509 HydrophobicContact CG-CD1 4.19Å; R505-I509 VanDerWaalsContact O-CG1 3.29Å; R505-I509 WeakPolarHBondContact O-CG1 3.35Å; R505-I509 PolarHBondContact O-N 3.45Å; R505-I509 VanDerWaalsContact O-N 3.08Å
506	K	97.1	Very high	95	Very high	92 Å²	92	47 Å²	47	40%	0.4	25%	0.253	S	S	.	.	H	α-helix	trans	-62.3	-44.1	176	-74	164.6	173.6	159.3	0	111.8	L480 D502 D503 F504 I509 L510	L480-K506 HydrophobicContact CD1-CB 4Å; L480-K506 HydrophobicContact CD2-CB 3.89Å; L480-K506 HydrophobicContact CD2-CD 3.99Å; D502-K506 WeakPolarHBondContact O-CG 3.41Å; D502-K506 PolarHBondContact O-N 3.2Å; D502-K506 WeakPolarHBondContact OD2-CE 3.47Å; D502-K506 IonicContact OD2-NZ 3.09Å; D502-K506 PolarHBondContact OD2-NZ 3.33Å; D503-K506 PolarHBondContact O-N 2.9Å; F504-K506 VanDerWaalsContact C-N 3.34Å; F504-K506 PolarHBondContact O-N 3.03Å; K506-I509 PolarHBondContact O-N 2.97Å; K506-L510 WeakPolarHBondContact O-CB 3.37Å; K506-L510 PolarHBondContact O-N 2.81Å
507	A	98	Very high	94.9	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-65.4	-42.9	-179.3	0	0	0	0	0	111.5	L477 L480 M481 D503 F504 L510 A511 L553	L477-A507 HydrophobicContact CD2-CB 3.9Å; L477-A507 WeakPolarHBondContact CD2-O 3.28Å; L480-A507 HydrophobicContact CB-CB 4.12Å; L480-A507 HydrophobicContact CD1-CB 3.92Å; M481-A507 HydrophobicContact CE-CB 3.98Å; D503-A507 VanDerWaalsContact O-CB 3.26Å; D503-A507 WeakPolarHBondContact O-CB 3.38Å; D503-A507 PolarHBondContact O-N 3.46Å; F504-A507 PolarHBondContact O-N 3.28Å; A507-L510 PolarHBondContact O-N 2.8Å; A507-A511 VanDerWaalsContact O-CB 3.31Å; A507-A511 WeakPolarHBondContact O-CB 3.36Å; A507-A511 PolarHBondContact O-N 2.83Å; A507-L553 HydrophobicContact CB-CD2 3.81Å
508	T	97.3	Very high	95	Very high	50 Å²	50	53 Å²	53	31%	0.307	27%	0.269	S	S	.	.	H	α-helix	trans	-61.8	-47.5	175.8	-60.3	0	0	0	0	111.2	F504 L510 A511 Q512	F504-T508 WeakPolarHBondContact O-CB 3.3Å; F504-T508 PolarHBondContact O-N 3.32Å; F504-T508 PolarHBondContact O-OG1 2.7Å; T508-L510 VanDerWaalsContact C-N 3.31Å; T508-L510 PolarHBondContact O-N 3.42Å; T508-A511 PolarHBondContact O-N 3.21Å; T508-Q512 HydrophobicContact CG2-CG 4.34Å; T508-Q512 VanDerWaalsContact O-CB 3.3Å; T508-Q512 WeakPolarHBondContact O-CB 3.24Å; T508-Q512 VanDerWaalsContact O-CG 3.22Å; T508-Q512 WeakPolarHBondContact O-CG 3.38Å; T508-Q512 PolarHBondContact O-N 3.47Å
509	I	96.7	Very high	95	Very high	74 Å²	74	47.6 Å²	47.6	38%	0.379	25%	0.247	S	C	.	.	H	α-helix	trans	-60.9	-42.5	176.9	-68	166.1	0	0	0	110.7	R505 K506 Q512 N513	R505-I509 HydrophobicContact CG-CD1 4.19Å; R505-I509 VanDerWaalsContact O-CG1 3.29Å; R505-I509 WeakPolarHBondContact O-CG1 3.35Å; R505-I509 PolarHBondContact O-N 3.45Å; R505-I509 VanDerWaalsContact O-N 3.08Å; K506-I509 PolarHBondContact O-N 2.97Å; I509-Q512 PolarHBondContact O-N 2.83Å; I509-N513 WeakPolarHBondContact O-CB 3.28Å; I509-N513 VanDerWaalsContact O-CG 3.29Å; I509-N513 PolarHBondContact O-N 2.95Å; I509-N513 PolarHBondContact O-ND2 2.88Å
510	L	97.4	Very high	95.1	Very high	23 Å²	23	48.8 Å²	48.8	12%	0.12	24%	0.24	C	C	.	.	H	α-helix	trans	-63.6	-48.8	178.3	-175.5	59.5	0	0	0	111.6	L473 Q476 L477 K506 A507 T508 Q512 N513 M514	L473-L510 HydrophobicContact CD2-CD1 3.8Å; Q476-L510 HydrophobicContact CB-CD2 3.76Å; L477-L510 HydrophobicContact CD2-CB 4.08Å; L477-L510 HydrophobicContact CD2-CD2 3.87Å; L477-L510 HydrophobicContact CD2-CG 4.14Å; L477-L510 HydrophobicContact CG-CD2 3.95Å; L477-L510 HydrophobicContact CG-CG 4.41Å; K506-L510 WeakPolarHBondContact O-CB 3.37Å; K506-L510 PolarHBondContact O-N 2.81Å; A507-L510 PolarHBondContact O-N 2.8Å; T508-L510 VanDerWaalsContact C-N 3.31Å; T508-L510 PolarHBondContact O-N 3.42Å; L510-Q512 PolarHBondContact O-N 3.41Å; L510-N513 PolarHBondContact O-N 3.08Å; L510-M514 VanDerWaalsContact O-CG 3.31Å; L510-M514 WeakPolarHBondContact O-CG 3.43Å; L510-M514 PolarHBondContact O-N 2.97Å
511	A	97.1	Very high	94.9	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-61.8	-42.8	177.1	0	0	0	0	0	111.7	L477 A507 T508 N513 M514 V515 V549 L552 L553	L477-A511 HydrophobicContact CD2-CB 4.45Å; A507-A511 VanDerWaalsContact O-CB 3.31Å; A507-A511 WeakPolarHBondContact O-CB 3.36Å; A507-A511 PolarHBondContact O-N 2.83Å; T508-A511 PolarHBondContact O-N 3.21Å; A511-N513 VanDerWaalsContact C-N 3.34Å; A511-N513 PolarHBondContact O-N 3.37Å; A511-M514 WeakPolarHBondContact O-CB 3.5Å; A511-M514 PolarHBondContact O-N 3.44Å; A511-V515 WeakPolarHBondContact O-CG2 3.38Å; A511-V515 PolarHBondContact O-N 2.72Å; A511-V515 VanDerWaalsContact O-N 3.09Å; A511-V549 HydrophobicContact CB-CG1 4.03Å; A511-L552 HydrophobicContact CB-CB 4.43Å; A511-L552 HydrophobicContact CB-CD1 4.4Å; A511-L553 HydrophobicContact CB-CD2 3.99Å; A511-L553 HydrophobicContact CB-CG 4.17Å
512	Q	95	Very high	94.7	Very high	70 Å²	70	51.2 Å²	51.2	33%	0.327	25%	0.254	S	S	.	.	H	α-helix	trans	-59.4	-43.3	173.7	-76.7	175.5	-17.8	0	0	111.7	T508 I509 L510 V515 K516 V549	T508-Q512 HydrophobicContact CG2-CG 4.34Å; T508-Q512 VanDerWaalsContact O-CB 3.3Å; T508-Q512 WeakPolarHBondContact O-CB 3.24Å; T508-Q512 VanDerWaalsContact O-CG 3.22Å; T508-Q512 WeakPolarHBondContact O-CG 3.38Å; T508-Q512 PolarHBondContact O-N 3.47Å; I509-Q512 PolarHBondContact O-N 2.83Å; L510-Q512 PolarHBondContact O-N 3.41Å; Q512-V515 PolarHBondContact O-N 3.41Å; Q512-K516 VanDerWaalsContact O-CB 3.29Å; Q512-K516 WeakPolarHBondContact O-CB 3.34Å; Q512-K516 PolarHBondContact O-N 2.94Å; Q512-V549 HydrophobicContact CG-CG1 4.41Å; Q512-V549 HydrophobicContact CG-CG2 4.07Å
513	N	94.9	Very high	94.5	Very high	34 Å²	34	53.8 Å²	53.8	18%	0.182	26%	0.262	C	S	.	.	H	α-helix	trans	-65.7	-39	176.5	-74	-32.8	0	0	0	112.3	I509 L510 A511 V515 R517 F518	I509-N513 WeakPolarHBondContact O-CB 3.28Å; I509-N513 VanDerWaalsContact O-CG 3.29Å; I509-N513 PolarHBondContact O-N 2.95Å; I509-N513 PolarHBondContact O-ND2 2.88Å; L510-N513 PolarHBondContact O-N 3.08Å; A511-N513 VanDerWaalsContact C-N 3.34Å; A511-N513 PolarHBondContact O-N 3.37Å; N513-V515 PolarHBondContact O-N 3.44Å; N513-R517 WeakPolarHBondContact O-CA 3.33Å; N513-R517 WeakPolarHBondContact O-CB 3.29Å; N513-R517 PolarHBondContact O-N 3.27Å; N513-R517 WeakPolarHBondContact OD1-CD 3.44Å; N513-R517 PolarHBondContact OD1-NE 3.26Å; N513-F518 HydrophobicContact CB-CD2 4.31Å; N513-F518 HydrophobicContact CB-CE2 3.73Å; N513-F518 HydrophobicContact CB-CZ 3.87Å; N513-F518 WeakPolarHBondContact O-CG 3.49Å; N513-F518 PolarHBondContact O-N 2.75Å
514	M	95.4	Very high	94.1	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-58.2	-37.9	174.8	-69.9	176.5	74.2	0	0	112.1	R470 L473 L474 L477 L510 A511 F518 F520 L552	R470-M514 HydrophobicContact CG-CE 4.37Å; L473-M514 HydrophobicContact CB-CE 4.01Å; L473-M514 HydrophobicContact CB-CG 4.45Å; L473-M514 HydrophobicContact CB-SD 3.9Å; L473-M514 HydrophobicContact CD1-CG 4.24Å; L474-M514 HydrophobicContact CD2-CE 3.95Å; L474-M514 HydrophobicContact CG-CE 4.19Å; L477-M514 HydrophobicContact CD1-SD 3.88Å; L510-M514 VanDerWaalsContact O-CG 3.31Å; L510-M514 WeakPolarHBondContact O-CG 3.43Å; L510-M514 PolarHBondContact O-N 2.97Å; A511-M514 WeakPolarHBondContact O-CB 3.5Å; A511-M514 PolarHBondContact O-N 3.44Å; M514-F518 HydrophobicContact CG-CD2 4.15Å; M514-F520 HydrophobicContact CB-CB 4.38Å; M514-F520 HydrophobicContact CB-CD2 4.13Å; M514-F520 HydrophobicContact CE-CD2 4.27Å; M514-F520 HydrophobicContact CG-CD2 4.07Å; M514-F520 PolarHBondContact O-N 3.06Å; M514-L552 HydrophobicContact CB-CD1 4.26Å
515	V	94.5	Very high	93.6	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-85.7	-50.8	-179.2	179.6	0	0	0	0	112.5	A511 Q512 N513 I524 I545 E548 V549 L552	A511-V515 WeakPolarHBondContact O-CG2 3.38Å; A511-V515 PolarHBondContact O-N 2.72Å; A511-V515 VanDerWaalsContact O-N 3.09Å; Q512-V515 PolarHBondContact O-N 3.41Å; N513-V515 PolarHBondContact O-N 3.44Å; V515-I524 HydrophobicContact CG1-CG1 3.91Å; V515-I545 HydrophobicContact CG1-CG1 4.43Å; V515-I545 HydrophobicContact CG1-CG2 4.1Å; V515-E548 HydrophobicContact CG1-CB 4.24Å; V515-E548 HydrophobicContact CG1-CG 4.3Å; V515-E548 HydrophobicContact CG2-CB 4.07Å; V515-E548 HydrophobicContact CG2-CG 3.66Å; V515-V549 HydrophobicContact CB-CG2 4.35Å; V515-V549 HydrophobicContact CG2-CG2 4.04Å; V515-L552 HydrophobicContact CG2-CD1 3.76Å
516	K	92.4	Very high	93.2	Very high	20 Å²	20	51.4 Å²	51.4	9%	0.087	27%	0.274	C	S	.	.	H	α-helix	trans	-81.1	-26.5	-172.4	-67.8	-168.5	178.6	-169.3	0	114.1	Q512 V528 I529 D534 I545	Q512-K516 VanDerWaalsContact O-CB 3.29Å; Q512-K516 WeakPolarHBondContact O-CB 3.34Å; Q512-K516 PolarHBondContact O-N 2.94Å; K516-V528 WeakPolarHBondContact O-CA 3.17Å; K516-I529 HydrophobicContact CB-CB 4.19Å; K516-I529 HydrophobicContact CD-CG2 4.4Å; K516-I529 HydrophobicContact CG-CB 4.34Å; K516-I529 PolarHBondContact O-N 2.8Å; K516-D534 IonicContact NZ-OD1 3.4Å; K516-D534 PolarHBondContact NZ-OD1 3.3Å; K516-D534 IonicContact NZ-OD2 3.56Å; K516-D534 PolarHBondContact NZ-OD2 2.96Å; K516-D534 VanDerWaalsContact NZ-OD2 3.17Å; K516-I545 HydrophobicContact CG-CG2 4.18Å
517	R	91.7	Very high	92.7	Very high	111 Å²	111	52.3 Å²	52.3	42%	0.419	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125	-40.8	-168.4	-59.3	-174.1	-176.9	-173.3	1	114.7	N513 D531	N513-R517 WeakPolarHBondContact O-CA 3.33Å; N513-R517 WeakPolarHBondContact O-CB 3.29Å; N513-R517 PolarHBondContact O-N 3.27Å; N513-R517 WeakPolarHBondContact OD1-CD 3.44Å; N513-R517 PolarHBondContact OD1-NE 3.26Å; R517-D531 IonicContact CZ-OD1 2.77Å; R517-D531 IonicContact CZ-OD2 3.73Å; R517-D531 IonicContact NE-OD1 3.45Å; R517-D531 IonicContact NH2-OD1 3.76Å; R517-D531 PolarHBondContact NH2-OD1 3.48Å; R517-D531 IonicContact NH2-OD2 3.47Å; R517-D531 PolarHBondContact NH2-OD2 3.1Å
518	F	92.9	Very high	92.3	Very high	105 Å²	105	57.4 Å²	57.4	46%	0.461	31%	0.306	S	S	.	.	S	Bend	trans	-89.6	-10.3	-173	-54.3	-29	0	0	0	113.9	L473 N513 M514 F520	L473-F518 HydrophobicContact CD1-CD2 4.06Å; L473-F518 HydrophobicContact CD1-CE2 4.31Å; N513-F518 HydrophobicContact CB-CD2 4.31Å; N513-F518 HydrophobicContact CB-CE2 3.73Å; N513-F518 HydrophobicContact CB-CZ 3.87Å; N513-F518 WeakPolarHBondContact O-CG 3.49Å; N513-F518 PolarHBondContact O-N 2.75Å; M514-F518 HydrophobicContact CG-CD2 4.15Å; F518-F520 VanDerWaalsContact C-N 3.34Å; F518-F520 HydrophobicContact CB-CD2 3.46Å; F518-F520 VanDerWaalsContact CB-CD2 3.46Å; F518-F520 HydrophobicContact CB-CE2 3.43Å; F518-F520 VanDerWaalsContact CB-CE2 3.43Å; F518-F520 HydrophobicContact CB-CG 4.31Å; F518-F520 HydrophobicContact CB-CZ 4.29Å; F518-F520 HydrophobicContact CD2-CD2 4.1Å; F518-F520 AromaticContact CD2-CE2 3.89Å; F518-F520 HydrophobicContact CD2-CE2 3.89Å; F518-F520 HydrophobicContact CG-CD2 4.28Å; F518-F520 HydrophobicContact CG-CE2 4.03Å; F518-F520 PolarHBondContact O-N 2.87Å
519	G	92	Very high	91.8	Very high	29 Å²	29	55.3 Å²	55.3	30%	0.299	29%	0.292	S	S	.	.			trans	69	28.3	179.6	0	0	0	0	0	113.8	S521	G519-S521 VanDerWaalsContact C-N 3.31Å
520	F	91.9	Very high	91	Very high	68 Å²	68	54 Å²	54	30%	0.298	29%	0.289	S	S	.	.			trans	-84.2	-2.8	178	-68.1	-50.2	0	0	0	114.3	R470 L473 M514 F518	R470-F520 HydrophobicContact CB-CD1 3.95Å; R470-F520 HydrophobicContact CB-CE1 3.78Å; R470-F520 HydrophobicContact CB-CG 4.48Å; R470-F520 HydrophobicContact CB-CZ 4.18Å; R470-F520 HydrophobicContact CG-CD1 4.01Å; R470-F520 HydrophobicContact CG-CE1 4.36Å; R470-F520 HydrophobicContact CG-CG 4.2Å; L473-F520 HydrophobicContact CD1-CD2 3.96Å; L473-F520 HydrophobicContact CD1-CE2 3.26Å; L473-F520 HydrophobicContact CD1-CZ 4.05Å; M514-F520 HydrophobicContact CB-CB 4.38Å; M514-F520 HydrophobicContact CB-CD2 4.13Å; M514-F520 HydrophobicContact CE-CD2 4.27Å; M514-F520 HydrophobicContact CG-CD2 4.07Å; M514-F520 PolarHBondContact O-N 3.06Å; F518-F520 VanDerWaalsContact C-N 3.34Å; F518-F520 HydrophobicContact CB-CD2 3.46Å; F518-F520 VanDerWaalsContact CB-CD2 3.46Å; F518-F520 HydrophobicContact CB-CE2 3.43Å; F518-F520 VanDerWaalsContact CB-CE2 3.43Å; F518-F520 HydrophobicContact CB-CG 4.31Å; F518-F520 HydrophobicContact CB-CZ 4.29Å; F518-F520 HydrophobicContact CD2-CD2 4.1Å; F518-F520 AromaticContact CD2-CE2 3.89Å; F518-F520 HydrophobicContact CD2-CE2 3.89Å; F518-F520 HydrophobicContact CG-CD2 4.28Å; F518-F520 HydrophobicContact CG-CE2 4.03Å; F518-F520 PolarHBondContact O-N 2.87Å
521	S	90.1	Very high	90.1	Very high	3 Å²	3	57.2 Å²	57.2	2%	0.021	31%	0.306	C	S	.	.			trans	-93.5	121.5	169.8	-179.1	0	0	0	0	110.8	G519 K523 I524 G525 E548	G519-S521 VanDerWaalsContact C-N 3.31Å; S521-K523 VanDerWaalsContact C-N 3.28Å; S521-K523 PolarHBondContact O-N 3.4Å; S521-K523 PolarHBondContact OG-N 2.82Å; S521-I524 PolarHBondContact OG-N 2.8Å; S521-G525 PolarHBondContact O-N 3.32Å; S521-E548 WeakPolarHBondContact CB-OE1 3.41Å; S521-E548 WeakPolarHBondContact OG-CG 3.35Å; S521-E548 PolarHBondContact OG-OE1 3.43Å
522	S	88.7	Confident	88.9	Confident	111 Å²	111	63.6 Å²	63.6	78%	0.776	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-28	174	53.7	0	0	0	0	112.7
523	K	90.6	Very high	87.5	Confident	117 Å²	117	63.9 Å²	63.9	51%	0.509	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-39.5	-177	-59.8	179.4	-164.1	142.5	0	112.5	S521 E548	S521-K523 VanDerWaalsContact C-N 3.28Å; S521-K523 PolarHBondContact O-N 3.4Å; S521-K523 PolarHBondContact OG-N 2.82Å; K523-E548 WeakPolarHBondContact CD-OE2 3.43Å; K523-E548 WeakPolarHBondContact CE-OE2 3.41Å; K523-E548 IonicContact NZ-OE2 2.75Å; K523-E548 PolarHBondContact NZ-OE2 3.43Å
524	I	88.1	Confident	86.2	Confident	18 Å²	18	65 Å²	65	9%	0.092	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-32.4	177.7	-60.9	-61.8	0	0	0	111.5	V515 S521 R527 I529 L544 I545	V515-I524 HydrophobicContact CG1-CG1 3.91Å; S521-I524 PolarHBondContact OG-N 2.8Å; I524-R527 HydrophobicContact CG2-CG 4.17Å; I524-I529 HydrophobicContact CG2-CD1 4.14Å; I524-L544 HydrophobicContact CD1-CB 3.88Å; I524-I545 HydrophobicContact CD1-CG1 3.75Å; I524-I545 HydrophobicContact CG1-CG1 4.28Å
525	G	87.1	Confident	85	Confident	19 Å²	19	73.8 Å²	73.8	20%	0.196	39%	0.393	C	S	.	.			trans	84.2	179.2	-177.8	0	0	0	0	0	113.9	S521 R527	S521-G525 PolarHBondContact O-N 3.32Å; G525-R527 PolarHBondContact O-N 3.19Å
526	P	88.8	Confident	84.2	Confident	135 Å²	135	80.9 Å²	80.9	88%	0.877	43%	0.427	S	S	*	.	S	Bend	trans	-82.4	60.2	-172.6	35.5	-37.4	0	0	0	112.1
527	R	86.1	Confident	83.7	Confident	112 Å²	112	81.4 Å²	81.4	42%	0.423	43%	0.43	S	S	.	.			trans	-122	151.6	176.9	67.7	179.9	-177.2	-179.8	-0.5	111.4	I524 G525	I524-R527 HydrophobicContact CG2-CG 4.17Å; G525-R527 PolarHBondContact O-N 3.19Å
528	V	89.3	Confident	83.4	Confident	107 Å²	107	78.3 Å²	78.3	65%	0.648	43%	0.433	S	S	*	.			trans	-95	129.2	173.4	-179.8	0	0	0	0	109.3	K516	K516-V528 WeakPolarHBondContact O-CA 3.17Å
529	I	86.2	Confident	83.2	Confident	5 Å²	5	80.7 Å²	80.7	3%	0.026	45%	0.445	C	S	.	.			trans	-108.1	109.1	174	-60.6	179.9	0	0	0	107.7	K516 I524 L537 T541 I545	K516-I529 HydrophobicContact CB-CB 4.19Å; K516-I529 HydrophobicContact CD-CG2 4.4Å; K516-I529 HydrophobicContact CG-CB 4.34Å; K516-I529 PolarHBondContact O-N 2.8Å; I524-I529 HydrophobicContact CG2-CD1 4.14Å; I529-L537 HydrophobicContact CD1-CD2 4.44Å; I529-L537 HydrophobicContact CG2-CD1 3.56Å; I529-L537 HydrophobicContact CG2-CD2 3.97Å; I529-L537 HydrophobicContact CG2-CG 4.27Å; I529-T541 HydrophobicContact CD1-CG2 4.49Å; I529-I545 HydrophobicContact CD1-CD1 3.47Å; I529-I545 VanDerWaalsContact CD1-CD1 3.47Å; I529-I545 HydrophobicContact CD1-CG1 4.21Å
530	P	81.3	Confident	83.1	Confident	47 Å²	47	82.6 Å²	82.6	31%	0.305	46%	0.458	S	S	.	.			trans	-74.2	143.1	179.4	28.8	-31.9	0	0	0	111.4	T532 Q533	P530-T532 PolarHBondContact O-N 2.89Å; P530-Q533 HydrophobicContact CG-CB 3.96Å; P530-Q533 VanDerWaalsContact CG-CD 3.44Å; P530-Q533 HydrophobicContact CG-CG 3.74Å; P530-Q533 VanDerWaalsContact CG-OE1 3.31Å; P530-Q533 PolarHBondContact O-N 3.43Å; P530-Q533 VanDerWaalsContact O-N 3.12Å
531	D	77.8	Confident	82.9	Confident	91 Å²	91	80.9 Å²	80.9	49%	0.487	45%	0.454	S	S	.	.	G	3₁₀ helix	trans	-59.5	-32.8	-175.9	-55.1	-13.6	0	0	0	112.9	R517 Q533	R517-D531 IonicContact CZ-OD1 2.77Å; R517-D531 IonicContact CZ-OD2 3.73Å; R517-D531 IonicContact NE-OD1 3.45Å; R517-D531 IonicContact NH2-OD1 3.76Å; R517-D531 PolarHBondContact NH2-OD1 3.48Å; R517-D531 IonicContact NH2-OD2 3.47Å; R517-D531 PolarHBondContact NH2-OD2 3.1Å; D531-Q533 PolarHBondContact O-N 3.2Å
532	T	72	Confident	82.9	Confident	133 Å²	133	86.2 Å²	86.2	82%	0.816	47%	0.473	S	S	*	.	G	3₁₀ helix	trans	-71.7	-10	-178	55.2	0	0	0	0	113.8	P530	P530-T532 PolarHBondContact O-N 2.89Å
533	Q	65.4	Low	83.1	Confident	77 Å²	77	84.3 Å²	84.3	36%	0.36	46%	0.455	S	S	.	.	G	3₁₀ helix	trans	-108	14.1	-175.2	-68.1	-175.6	-6.5	0	0	113.4	P530 D531 E535 Q536 L537	P530-Q533 HydrophobicContact CG-CB 3.96Å; P530-Q533 VanDerWaalsContact CG-CD 3.44Å; P530-Q533 HydrophobicContact CG-CG 3.74Å; P530-Q533 VanDerWaalsContact CG-OE1 3.31Å; P530-Q533 PolarHBondContact O-N 3.43Å; P530-Q533 VanDerWaalsContact O-N 3.12Å; D531-Q533 PolarHBondContact O-N 3.2Å; Q533-E535 PolarHBondContact O-N 3.38Å; Q533-Q536 HydrophobicContact CB-CB 4.22Å; Q533-Q536 HydrophobicContact CB-CG 4.48Å; Q533-Q536 VanDerWaalsContact CD-OE1 3.3Å; Q533-Q536 WeakPolarHBondContact O-CA 3.37Å; Q533-Q536 PolarHBondContact O-N 3.2Å; Q533-L537 PolarHBondContact O-N 2.94Å
534	D	67.6	Low	83.2	Confident	57 Å²	57	82.3 Å²	82.3	31%	0.305	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-25.6	178.2	-81.2	-9.2	0	0	0	112.4	K516 R542	K516-D534 IonicContact NZ-OD1 3.4Å; K516-D534 PolarHBondContact NZ-OD1 3.3Å; K516-D534 IonicContact NZ-OD2 3.56Å; K516-D534 PolarHBondContact NZ-OD2 2.96Å; K516-D534 VanDerWaalsContact NZ-OD2 3.17Å; D534-R542 PolarHBondContact O-NH1 2.79Å
535	E	71.3	Confident	83.4	Confident	184 Å²	184	81.6 Å²	81.6	86%	0.86	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-24.6	172.6	-64.1	-175.7	173.9	0	0	114.6	Q533	Q533-E535 PolarHBondContact O-N 3.38Å
536	Q	76.9	Confident	83.7	Confident	149 Å²	149	84.9 Å²	84.9	70%	0.696	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-11.4	179	-60.9	-177.9	-5.5	0	0	112.5	Q533	Q533-Q536 HydrophobicContact CB-CB 4.22Å; Q533-Q536 HydrophobicContact CB-CG 4.48Å; Q533-Q536 VanDerWaalsContact CD-OE1 3.3Å; Q533-Q536 WeakPolarHBondContact O-CA 3.37Å; Q533-Q536 PolarHBondContact O-N 3.2Å
537	L	81.8	Confident	84	Confident	32 Å²	32	84.6 Å²	84.6	17%	0.168	44%	0.443	C	S	.	.	S	Bend	trans	-75.4	133.2	176.5	-64.2	171.4	0	0	0	110.4	I529 Q533 T541 R542 I545	I529-L537 HydrophobicContact CD1-CD2 4.44Å; I529-L537 HydrophobicContact CG2-CD1 3.56Å; I529-L537 HydrophobicContact CG2-CD2 3.97Å; I529-L537 HydrophobicContact CG2-CG 4.27Å; Q533-L537 PolarHBondContact O-N 2.94Å; L537-T541 HydrophobicContact CD2-CG2 4.16Å; L537-R542 HydrophobicContact CB-CG 3.71Å; L537-R542 HydrophobicContact CD1-CG 4.26Å; L537-I545 HydrophobicContact CD1-CD1 4.14Å
538	G	85.3	Confident	84.4	Confident	46 Å²	46	80.1 Å²	80.1	47%	0.474	43%	0.427	S	S	.	.			trans	-59.8	142.9	169.7	0	0	0	0	0	111.1	A540 T541 R542	G538-A540 VanDerWaalsContact C-N 3.26Å; G538-A540 PolarHBondContact O-N 2.91Å; G538-T541 WeakPolarHBondContact O-CA 3.46Å; G538-T541 WeakPolarHBondContact O-CB 3.48Å; G538-T541 PolarHBondContact O-N 3.33Å; G538-R542 PolarHBondContact O-N 3.07Å; G538-R542 VanDerWaalsContact O-N 3.15Å
539	E	88.7	Confident	84.8	Confident	154 Å²	154	75.4 Å²	75.4	72%	0.72	40%	0.399	S	S	*	.	H	α-helix	trans	-48.7	-47.3	-179.7	-173.9	177.6	-177	0	0	112	T541 R542 D543	E539-T541 PolarHBondContact O-N 3.31Å; E539-R542 WeakPolarHBondContact O-CB 3.1Å; E539-R542 PolarHBondContact O-N 3.23Å; E539-D543 PolarHBondContact O-N 3.46Å
540	A	89.8	Confident	85.3	Confident	69 Å²	69	79.5 Å²	79.5	57%	0.57	42%	0.421	S	S	*	.	H	α-helix	trans	-58.1	-32.9	176.8	0	0	0	0	0	113.9	G538 L544	G538-A540 VanDerWaalsContact C-N 3.26Å; G538-A540 PolarHBondContact O-N 2.91Å; A540-L544 WeakPolarHBondContact O-CB 3.4Å; A540-L544 WeakPolarHBondContact O-CD1 3.4Å; A540-L544 WeakPolarHBondContact O-CG 3.47Å; A540-L544 PolarHBondContact O-N 2.98Å
541	T	89.1	Confident	86	Confident	33 Å²	33	81.3 Å²	81.3	20%	0.202	43%	0.425	C	S	.	.	H	α-helix	trans	-73.5	-39.8	175.4	-69.1	0	0	0	0	111.3	I529 L537 G538 E539 L544 I545	I529-T541 HydrophobicContact CD1-CG2 4.49Å; L537-T541 HydrophobicContact CD2-CG2 4.16Å; G538-T541 WeakPolarHBondContact O-CA 3.46Å; G538-T541 WeakPolarHBondContact O-CB 3.48Å; G538-T541 PolarHBondContact O-N 3.33Å; E539-T541 PolarHBondContact O-N 3.31Å; T541-L544 PolarHBondContact O-N 2.89Å; T541-I545 HydrophobicContact CG2-CD1 3.95Å; T541-I545 HydrophobicContact CG2-CG1 4.47Å; T541-I545 VanDerWaalsContact O-CG1 3.29Å; T541-I545 WeakPolarHBondContact O-CG1 3.38Å; T541-I545 PolarHBondContact O-N 3.35Å
542	R	89.4	Confident	86.9	Confident	114 Å²	114	77.8 Å²	77.8	43%	0.43	41%	0.406	S	S	.	.	H	α-helix	trans	-62.7	-47.8	178.1	-65.4	174.8	59.9	164.8	-4.6	110.6	D534 L537 G538 E539 L544 I545 D546	D534-R542 PolarHBondContact O-NH1 2.79Å; L537-R542 HydrophobicContact CB-CG 3.71Å; L537-R542 HydrophobicContact CD1-CG 4.26Å; G538-R542 PolarHBondContact O-N 3.07Å; G538-R542 VanDerWaalsContact O-N 3.15Å; E539-R542 WeakPolarHBondContact O-CB 3.1Å; E539-R542 PolarHBondContact O-N 3.23Å; R542-L544 VanDerWaalsContact C-N 3.25Å; R542-L544 PolarHBondContact O-N 2.95Å; R542-I545 WeakPolarHBondContact O-CB 3.25Å; R542-I545 PolarHBondContact O-N 2.98Å; R542-D546 PolarHBondContact O-N 2.94Å
543	D	92.3	Very high	88.1	Confident	72 Å²	72	72.6 Å²	72.6	39%	0.385	37%	0.373	S	S	.	.	H	α-helix	trans	-58.3	-37.5	175.6	-70.6	-4	0	0	0	112.7	E539 K547	E539-D543 PolarHBondContact O-N 3.46Å; D543-K547 WeakPolarHBondContact O-CB 3.47Å; D543-K547 WeakPolarHBondContact O-CD 3.45Å; D543-K547 WeakPolarHBondContact O-CG 3.31Å; D543-K547 PolarHBondContact O-N 3.47Å
544	L	92.4	Very high	89.7	Confident	74 Å²	74	73 Å²	73	39%	0.387	38%	0.378	S	S	.	.	H	α-helix	trans	-69.1	-38.5	176.8	-76.7	172.7	0	0	0	112.2	I524 A540 T541 R542 E548	I524-L544 HydrophobicContact CD1-CB 3.88Å; A540-L544 WeakPolarHBondContact O-CB 3.4Å; A540-L544 WeakPolarHBondContact O-CD1 3.4Å; A540-L544 WeakPolarHBondContact O-CG 3.47Å; A540-L544 PolarHBondContact O-N 2.98Å; T541-L544 PolarHBondContact O-N 2.89Å; R542-L544 VanDerWaalsContact C-N 3.25Å; R542-L544 PolarHBondContact O-N 2.95Å; L544-E548 WeakPolarHBondContact O-CB 3.4Å; L544-E548 PolarHBondContact O-N 3.5Å; L544-E548 VanDerWaalsContact O-N 3.08Å
545	I	92.6	Very high	91.1	Very high	3 Å²	3	73.8 Å²	73.8	2%	0.015	38%	0.382	C	S	.	.	H	α-helix	trans	-63.5	-49.4	175.3	-67	162.4	0	0	0	109.4	V515 K516 I524 I529 L537 T541 R542 K547 E548 V549	V515-I545 HydrophobicContact CG1-CG1 4.43Å; V515-I545 HydrophobicContact CG1-CG2 4.1Å; K516-I545 HydrophobicContact CG-CG2 4.18Å; I524-I545 HydrophobicContact CD1-CG1 3.75Å; I524-I545 HydrophobicContact CG1-CG1 4.28Å; I529-I545 HydrophobicContact CD1-CD1 3.47Å; I529-I545 VanDerWaalsContact CD1-CD1 3.47Å; I529-I545 HydrophobicContact CD1-CG1 4.21Å; L537-I545 HydrophobicContact CD1-CD1 4.14Å; T541-I545 HydrophobicContact CG2-CD1 3.95Å; T541-I545 HydrophobicContact CG2-CG1 4.47Å; T541-I545 VanDerWaalsContact O-CG1 3.29Å; T541-I545 WeakPolarHBondContact O-CG1 3.38Å; T541-I545 PolarHBondContact O-N 3.35Å; R542-I545 WeakPolarHBondContact O-CB 3.25Å; R542-I545 PolarHBondContact O-N 2.98Å; I545-K547 PolarHBondContact O-N 3.32Å; I545-E548 PolarHBondContact O-N 3.32Å; I545-E548 VanDerWaalsContact O-N 3.13Å; I545-V549 HydrophobicContact CG2-CG2 4.32Å; I545-V549 WeakPolarHBondContact O-CG2 3.36Å; I545-V549 PolarHBondContact O-N 3.33Å
546	D	93.3	Very high	92.4	Very high	88 Å²	88	65 Å²	65	47%	0.471	34%	0.341	S	S	.	.	H	α-helix	trans	-61.6	-45.4	-178.2	-68.3	-19	0	0	0	110.8	R542 E548 V549 D550	R542-D546 PolarHBondContact O-N 2.94Å; D546-E548 VanDerWaalsContact C-N 3.29Å; D546-E548 PolarHBondContact O-N 2.97Å; D546-V549 PolarHBondContact O-N 3.08Å; D546-D550 WeakPolarHBondContact O-CB 3.39Å; D546-D550 VanDerWaalsContact O-CG 3.31Å; D546-D550 PolarHBondContact O-N 3.29Å
547	K	95.7	Very high	93.4	Very high	130 Å²	130	58.9 Å²	58.9	57%	0.565	31%	0.313	S	S	*	.	H	α-helix	trans	-58.5	-38.4	174.3	-76.6	169	-175.6	166	0	113.2	D543 I545 Q551	D543-K547 WeakPolarHBondContact O-CB 3.47Å; D543-K547 WeakPolarHBondContact O-CD 3.45Å; D543-K547 WeakPolarHBondContact O-CG 3.31Å; D543-K547 PolarHBondContact O-N 3.47Å; I545-K547 PolarHBondContact O-N 3.32Å; K547-Q551 VanDerWaalsContact O-CB 3.29Å; K547-Q551 WeakPolarHBondContact O-CB 3.32Å; K547-Q551 PolarHBondContact O-N 3.36Å
548	E	95.4	Very high	94.1	Very high	17 Å²	17	61.2 Å²	61.2	8%	0.079	33%	0.329	C	S	.	.	H	α-helix	trans	-73.3	-39.8	179.7	-167.5	80.2	160.2	0	0	111.8	V515 S521 K523 L544 I545 D546 Q551 L552	V515-E548 HydrophobicContact CG1-CB 4.24Å; V515-E548 HydrophobicContact CG1-CG 4.3Å; V515-E548 HydrophobicContact CG2-CB 4.07Å; V515-E548 HydrophobicContact CG2-CG 3.66Å; S521-E548 WeakPolarHBondContact CB-OE1 3.41Å; S521-E548 WeakPolarHBondContact OG-CG 3.35Å; S521-E548 PolarHBondContact OG-OE1 3.43Å; K523-E548 WeakPolarHBondContact CD-OE2 3.43Å; K523-E548 WeakPolarHBondContact CE-OE2 3.41Å; K523-E548 IonicContact NZ-OE2 2.75Å; K523-E548 PolarHBondContact NZ-OE2 3.43Å; L544-E548 WeakPolarHBondContact O-CB 3.4Å; L544-E548 PolarHBondContact O-N 3.5Å; L544-E548 VanDerWaalsContact O-N 3.08Å; I545-E548 PolarHBondContact O-N 3.32Å; I545-E548 VanDerWaalsContact O-N 3.13Å; D546-E548 VanDerWaalsContact C-N 3.29Å; D546-E548 PolarHBondContact O-N 2.97Å; E548-Q551 PolarHBondContact O-N 3.11Å; E548-L552 WeakPolarHBondContact O-CG 3.36Å; E548-L552 PolarHBondContact O-N 3.39Å
549	V	95.9	Very high	94.7	Very high	8 Å²	8	63.4 Å²	63.4	5%	0.048	32%	0.323	C	S	.	.	H	α-helix	trans	-61.8	-47.9	173.9	171	0	0	0	0	109.8	A511 Q512 V515 I545 D546 Q551 L552 L553	A511-V549 HydrophobicContact CB-CG1 4.03Å; Q512-V549 HydrophobicContact CG-CG1 4.41Å; Q512-V549 HydrophobicContact CG-CG2 4.07Å; V515-V549 HydrophobicContact CB-CG2 4.35Å; V515-V549 HydrophobicContact CG2-CG2 4.04Å; I545-V549 HydrophobicContact CG2-CG2 4.32Å; I545-V549 WeakPolarHBondContact O-CG2 3.36Å; I545-V549 PolarHBondContact O-N 3.33Å; D546-V549 PolarHBondContact O-N 3.08Å; V549-Q551 VanDerWaalsContact C-N 3.31Å; V549-Q551 PolarHBondContact O-N 3.47Å; V549-L552 PolarHBondContact O-N 3.18Å; V549-L553 HydrophobicContact CG1-CD1 3.91Å; V549-L553 VanDerWaalsContact O-CG 3.32Å; V549-L553 WeakPolarHBondContact O-CG 3.45Å; V549-L553 PolarHBondContact O-N 3.18Å
550	D	96.7	Very high	95.2	Very high	91 Å²	91	56.1 Å²	56.1	49%	0.487	29%	0.289	S	S	.	.	H	α-helix	trans	-59.5	-42.5	176.3	-75.5	-16.7	0	0	0	111.7	D546 L553 N554	D546-D550 WeakPolarHBondContact O-CB 3.39Å; D546-D550 VanDerWaalsContact O-CG 3.31Å; D546-D550 PolarHBondContact O-N 3.29Å; D550-L553 PolarHBondContact O-N 2.96Å; D550-N554 VanDerWaalsContact O-CB 3.27Å; D550-N554 WeakPolarHBondContact O-CB 3.29Å; D550-N554 VanDerWaalsContact O-CG 3.29Å; D550-N554 PolarHBondContact O-N 3.14Å; D550-N554 PolarHBondContact O-ND2 3.45Å
551	Q	96.8	Very high	95.5	Very high	86 Å²	86	57 Å²	57	40%	0.402	28%	0.277	S	S	.	.	H	α-helix	trans	-60.9	-48.2	176.9	-176.5	172.7	2.1	0	0	111.2	K547 E548 V549 L553 N554 D555	K547-Q551 VanDerWaalsContact O-CB 3.29Å; K547-Q551 WeakPolarHBondContact O-CB 3.32Å; K547-Q551 PolarHBondContact O-N 3.36Å; E548-Q551 PolarHBondContact O-N 3.11Å; V549-Q551 VanDerWaalsContact C-N 3.31Å; V549-Q551 PolarHBondContact O-N 3.47Å; Q551-L553 VanDerWaalsContact C-N 3.33Å; Q551-L553 PolarHBondContact O-N 3Å; Q551-N554 PolarHBondContact O-N 3.49Å; Q551-D555 VanDerWaalsContact O-CB 3.25Å; Q551-D555 WeakPolarHBondContact O-CB 3.33Å; Q551-D555 PolarHBondContact O-N 3.21Å
552	L	96.9	Very high	95.9	Very high	17 Å²	17	59.9 Å²	59.9	9%	0.089	30%	0.295	C	S	.	.	H	α-helix	trans	-59	-43.5	178.8	-74.6	172.2	0	0	0	112.6	L474 L477 A511 M514 V515 E548 V549 S556	L474-L552 HydrophobicContact CD2-CD2 4.08Å; L477-L552 HydrophobicContact CD1-CB 4.49Å; A511-L552 HydrophobicContact CB-CB 4.43Å; A511-L552 HydrophobicContact CB-CD1 4.4Å; M514-L552 HydrophobicContact CB-CD1 4.26Å; V515-L552 HydrophobicContact CG2-CD1 3.76Å; E548-L552 WeakPolarHBondContact O-CG 3.36Å; E548-L552 PolarHBondContact O-N 3.39Å; V549-L552 PolarHBondContact O-N 3.18Å; L552-S556 WeakPolarHBondContact O-CB 3.39Å; L552-S556 PolarHBondContact O-N 2.91Å; L552-S556 VanDerWaalsContact O-N 3.12Å
553	L	98	Very high	96.3	Very high	23 Å²	23	56.2 Å²	56.2	12%	0.12	28%	0.283	C	S	.	.	H	α-helix	trans	-69.5	-44.2	-179.5	-64.6	172.6	0	0	0	111.7	L477 M481 A507 A511 V549 D550 Q551 S556 L557	L477-L553 HydrophobicContact CD2-CD2 4.18Å; M481-L553 HydrophobicContact CE-CB 4.06Å; M481-L553 HydrophobicContact CE-CD2 3.56Å; M481-L553 HydrophobicContact CE-CG 4.4Å; A507-L553 HydrophobicContact CB-CD2 3.81Å; A511-L553 HydrophobicContact CB-CD2 3.99Å; A511-L553 HydrophobicContact CB-CG 4.17Å; V549-L553 HydrophobicContact CG1-CD1 3.91Å; V549-L553 VanDerWaalsContact O-CG 3.32Å; V549-L553 WeakPolarHBondContact O-CG 3.45Å; V549-L553 PolarHBondContact O-N 3.18Å; D550-L553 PolarHBondContact O-N 2.96Å; Q551-L553 VanDerWaalsContact C-N 3.33Å; Q551-L553 PolarHBondContact O-N 3Å; L553-S556 WeakPolarHBondContact O-CB 3.45Å; L553-S556 PolarHBondContact O-N 2.83Å; L553-L557 PolarHBondContact O-N 2.7Å
554	N	97.8	Very high	96.5	Very high	87 Å²	87	52.8 Å²	52.8	47%	0.465	27%	0.265	S	S	.	.	H	α-helix	trans	-68.6	-38.2	179	-74.6	-47.8	0	0	0	112.6	D550 Q551 S556 L557 T558	D550-N554 VanDerWaalsContact O-CB 3.27Å; D550-N554 WeakPolarHBondContact O-CB 3.29Å; D550-N554 VanDerWaalsContact O-CG 3.29Å; D550-N554 PolarHBondContact O-N 3.14Å; D550-N554 PolarHBondContact O-ND2 3.45Å; Q551-N554 PolarHBondContact O-N 3.49Å; N554-S556 VanDerWaalsContact C-N 3.3Å; N554-S556 PolarHBondContact O-N 3.38Å; N554-L557 PolarHBondContact O-N 3.3Å; N554-T558 WeakPolarHBondContact O-CB 3.35Å; N554-T558 PolarHBondContact O-N 3.06Å; N554-T558 PolarHBondContact O-OG1 2.98Å
555	D	97.8	Very high	96.7	Very high	72 Å²	72	52.2 Å²	52.2	39%	0.385	27%	0.268	S	S	.	.	H	α-helix	trans	-62.2	-42.1	174.4	-72.6	-11.8	0	0	0	110.4	Q551 T558 R559	Q551-D555 VanDerWaalsContact O-CB 3.25Å; Q551-D555 WeakPolarHBondContact O-CB 3.33Å; Q551-D555 PolarHBondContact O-N 3.21Å; D555-T558 PolarHBondContact O-N 3.2Å; D555-R559 WeakPolarHBondContact O-CG 3.49Å; D555-R559 PolarHBondContact O-N 3.44Å; D555-R559 PolarHBondContact O-NH1 3.34Å
556	S	97.7	Very high	96.8	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-62.1	-50	175.3	-177.3	0	0	0	0	112.2	L477 D478 M481 L552 L553 N554 T558 R559 V560	L477-S556 PolarHBondContact O-OG 2.81Å; D478-S556 VanDerWaalsContact CA-OG 3.27Å; D478-S556 WeakPolarHBondContact CA-OG 3.35Å; D478-S556 PolarHBondContact N-OG 3.46Å; D478-S556 VanDerWaalsContact N-OG 3.16Å; D478-S556 VanDerWaalsContact OD1-CA 3.31Å; D478-S556 WeakPolarHBondContact OD1-CA 3.37Å; D478-S556 VanDerWaalsContact OD1-CB 3.27Å; D478-S556 WeakPolarHBondContact OD1-CB 3.48Å; D478-S556 PolarHBondContact OD1-OG 2.86Å; M481-S556 WeakPolarHBondContact CG-OG 3.36Å; L552-S556 WeakPolarHBondContact O-CB 3.39Å; L552-S556 PolarHBondContact O-N 2.91Å; L552-S556 VanDerWaalsContact O-N 3.12Å; L553-S556 WeakPolarHBondContact O-CB 3.45Å; L553-S556 PolarHBondContact O-N 2.83Å; N554-S556 VanDerWaalsContact C-N 3.3Å; N554-S556 PolarHBondContact O-N 3.38Å; S556-T558 VanDerWaalsContact C-N 3.26Å; S556-T558 PolarHBondContact O-N 2.9Å; S556-R559 PolarHBondContact O-N 3.25Å; S556-V560 WeakPolarHBondContact O-CB 3.13Å; S556-V560 VanDerWaalsContact O-CG2 3.27Å; S556-V560 WeakPolarHBondContact O-CG2 3.47Å; S556-V560 PolarHBondContact O-N 2.99Å
557	L	97.3	Very high	96.9	Very high	21 Å²	21	54.9 Å²	54.9	11%	0.11	29%	0.287	C	S	.	.	H	α-helix	trans	-55.2	-42	174.7	-80	168.5	0	0	0	112.2	M481 V485 L553 N554 V560 R561	M481-L557 HydrophobicContact CB-CD2 3.93Å; M481-L557 HydrophobicContact CB-CG 4.47Å; M481-L557 HydrophobicContact CE-CG 4.22Å; M481-L557 HydrophobicContact CG-CD2 3.89Å; M481-L557 HydrophobicContact CG-CG 3.95Å; M481-L557 HydrophobicContact SD-CD1 4.38Å; M481-L557 HydrophobicContact SD-CD2 3.55Å; M481-L557 VanDerWaalsContact SD-CD2 3.55Å; M481-L557 HydrophobicContact SD-CG 3.65Å; V485-L557 HydrophobicContact CG2-CD2 4Å; L553-L557 PolarHBondContact O-N 2.7Å; N554-L557 PolarHBondContact O-N 3.3Å; L557-V560 PolarHBondContact O-N 3.46Å; L557-R561 WeakPolarHBondContact O-CB 3.49Å; L557-R561 WeakPolarHBondContact O-CG 3.18Å; L557-R561 PolarHBondContact O-N 3.49Å
558	T	97.9	Very high	96.8	Very high	81 Å²	81	51.6 Å²	51.6	50%	0.497	28%	0.28	S	S	.	.	H	α-helix	trans	-67.9	-43.7	-179.1	-57.3	0	0	0	0	112	N554 D555 S556 V560 T562	N554-T558 WeakPolarHBondContact O-CB 3.35Å; N554-T558 PolarHBondContact O-N 3.06Å; N554-T558 PolarHBondContact O-OG1 2.98Å; D555-T558 PolarHBondContact O-N 3.2Å; S556-T558 VanDerWaalsContact C-N 3.26Å; S556-T558 PolarHBondContact O-N 2.9Å; T558-V560 VanDerWaalsContact C-N 3.34Å; T558-V560 PolarHBondContact O-N 3.05Å; T558-T562 PolarHBondContact O-N 3.47Å; T558-T562 VanDerWaalsContact O-N 3.08Å; T558-T562 PolarHBondContact O-OG1 3.15Å
559	R	97.6	Very high	96.7	Very high	91 Å²	91	59.8 Å²	59.8	34%	0.343	32%	0.315	S	S	.	.	H	α-helix	trans	-59.1	-46.9	174.2	-74.9	-168.6	-59.2	-85.1	1.6	111.2	D478 D555 S556 T562 L563	D478-R559 IonicContact OD1-CZ 3.38Å; D478-R559 IonicContact OD1-NE 3.43Å; D478-R559 PolarHBondContact OD1-NE 3.49Å; D478-R559 IonicContact OD1-NH2 3.04Å; D478-R559 PolarHBondContact OD1-NH2 3.26Å; D478-R559 IonicContact OD2-CZ 2.86Å; D478-R559 IonicContact OD2-NE 3.49Å; D478-R559 PolarHBondContact OD2-NE 3.39Å; D478-R559 IonicContact OD2-NH2 2.71Å; D555-R559 WeakPolarHBondContact O-CG 3.49Å; D555-R559 PolarHBondContact O-N 3.44Å; D555-R559 PolarHBondContact O-NH1 3.34Å; S556-R559 PolarHBondContact O-N 3.25Å; R559-T562 WeakPolarHBondContact O-CB 3.26Å; R559-T562 PolarHBondContact O-N 3.41Å; R559-L563 WeakPolarHBondContact O-CB 3.37Å; R559-L563 PolarHBondContact O-N 3.36Å
560	V	97.9	Very high	96.7	Very high	1 Å²	1	62.1 Å²	62.1	1%	0.006	33%	0.326	C	S	.	.	H	α-helix	trans	-68.6	-40.4	-177	174.5	0	0	0	0	111.8	V432 D478 M481 V485 S556 L557 T558 T562 L563 L564	V432-V560 HydrophobicContact CG1-CG2 4.31Å; V432-V560 HydrophobicContact CG2-CG1 3.81Å; D478-V560 HydrophobicContact CB-CG2 3.61Å; D478-V560 WeakPolarHBondContact O-CG2 3.26Å; M481-V560 HydrophobicContact CB-CB 4.28Å; M481-V560 HydrophobicContact CB-CG1 4.33Å; M481-V560 HydrophobicContact CB-CG2 4.11Å; V485-V560 HydrophobicContact CB-CG1 3.86Å; V485-V560 HydrophobicContact CG1-CG1 4.08Å; V485-V560 HydrophobicContact CG2-CB 4.38Å; V485-V560 HydrophobicContact CG2-CG1 3.88Å; S556-V560 WeakPolarHBondContact O-CB 3.13Å; S556-V560 VanDerWaalsContact O-CG2 3.27Å; S556-V560 WeakPolarHBondContact O-CG2 3.47Å; S556-V560 PolarHBondContact O-N 2.99Å; L557-V560 PolarHBondContact O-N 3.46Å; T558-V560 VanDerWaalsContact C-N 3.34Å; T558-V560 PolarHBondContact O-N 3.05Å; V560-T562 VanDerWaalsContact C-N 3.32Å; V560-T562 PolarHBondContact O-N 3.24Å; V560-L563 PolarHBondContact O-N 3.04Å; V560-L564 HydrophobicContact CG1-CD1 3.95Å; V560-L564 HydrophobicContact CG1-CG 4.35Å; V560-L564 WeakPolarHBondContact O-CB 3.48Å; V560-L564 PolarHBondContact O-N 3.29Å
561	R	97.4	Very high	96.6	Very high	88 Å²	88	57.9 Å²	57.9	33%	0.332	30%	0.303	S	S	.	.	H	α-helix	trans	-56.5	-46.2	170.9	-80.8	-176.2	-176.3	116.9	2.9	111.8	V485 E488 L557 S565	V485-R561 HydrophobicContact CB-CG 4.46Å; V485-R561 HydrophobicContact CG1-CB 4.31Å; V485-R561 HydrophobicContact CG1-CG 3.74Å; V485-R561 HydrophobicContact CG2-CG 3.85Å; E488-R561 IonicContact OE1-CZ 3.84Å; E488-R561 IonicContact OE1-NE 2.59Å; E488-R561 PolarHBondContact OE1-NE 3.2Å; E488-R561 IonicContact OE1-NH2 2.8Å; E488-R561 PolarHBondContact OE1-NH2 3.02Å; E488-R561 IonicContact OE2-CZ 3.07Å; E488-R561 IonicContact OE2-NE 3.99Å; E488-R561 PolarHBondContact OE2-NE 2.93Å; E488-R561 IonicContact OE2-NH2 3.28Å; E488-R561 PolarHBondContact OE2-NH2 3.23Å; L557-R561 WeakPolarHBondContact O-CB 3.49Å; L557-R561 WeakPolarHBondContact O-CG 3.18Å; L557-R561 PolarHBondContact O-N 3.49Å; R561-S565 WeakPolarHBondContact O-CB 3.37Å; R561-S565 PolarHBondContact O-N 3.39Å; R561-S565 PolarHBondContact O-OG 3.09Å
562	T	97.5	Very high	96.6	Very high	94 Å²	94	59 Å²	59	58%	0.577	31%	0.306	S	S	*	.	H	α-helix	trans	-63	-46.1	179.1	-54	0	0	0	0	111	T558 R559 V560 S566	T558-T562 PolarHBondContact O-N 3.47Å; T558-T562 VanDerWaalsContact O-N 3.08Å; T558-T562 PolarHBondContact O-OG1 3.15Å; R559-T562 WeakPolarHBondContact O-CB 3.26Å; R559-T562 PolarHBondContact O-N 3.41Å; V560-T562 VanDerWaalsContact C-N 3.32Å; V560-T562 PolarHBondContact O-N 3.24Å; T562-S566 PolarHBondContact O-N 2.92Å; T562-S566 VanDerWaalsContact O-N 3.09Å
563	L	97.1	Very high	96.5	Very high	36 Å²	36	61 Å²	61	19%	0.188	32%	0.317	C	S	.	.	H	α-helix	trans	-63.6	-54.6	-179.5	-176	156.8	0	0	0	111.8	V432 L435 R559 V560 S565 S566 Q567	V432-L563 HydrophobicContact CG2-CD2 4.27Å; L435-L563 HydrophobicContact CB-CD1 4.03Å; L435-L563 HydrophobicContact CB-CD2 4.12Å; L435-L563 HydrophobicContact CB-CG 4.4Å; L435-L563 HydrophobicContact CD1-CD2 3.66Å; L435-L563 HydrophobicContact CD1-CG 4.37Å; R559-L563 WeakPolarHBondContact O-CB 3.37Å; R559-L563 PolarHBondContact O-N 3.36Å; V560-L563 PolarHBondContact O-N 3.04Å; L563-S565 VanDerWaalsContact C-N 3.35Å; L563-S565 PolarHBondContact O-N 3.17Å; L563-S566 PolarHBondContact O-N 3.48Å; L563-S566 PolarHBondContact O-OG 2.96Å; L563-Q567 PolarHBondContact O-N 3.41Å; L563-Q567 VanDerWaalsContact O-N 3.13Å
564	L	96.5	Very high	96.4	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-68.7	-31.3	-178.7	-73.2	179.7	0	0	0	112.8	L431 V432 V485 L489 V560 Q567 S568	L431-L564 HydrophobicContact CB-CD2 4.16Å; L431-L564 HydrophobicContact CD2-CD2 3.74Å; L431-L564 HydrophobicContact CG-CD2 4.1Å; V432-L564 HydrophobicContact CG2-CD1 3.9Å; V432-L564 HydrophobicContact CG2-CD2 3.95Å; V432-L564 HydrophobicContact CG2-CG 3.85Å; V485-L564 HydrophobicContact CB-CD1 4.04Å; V485-L564 HydrophobicContact CG1-CB 4.19Å; V485-L564 HydrophobicContact CG1-CD1 3.76Å; V485-L564 HydrophobicContact CG1-CG 4.5Å; L489-L564 HydrophobicContact CD1-CB 3.55Å; V560-L564 HydrophobicContact CG1-CD1 3.95Å; V560-L564 HydrophobicContact CG1-CG 4.35Å; V560-L564 WeakPolarHBondContact O-CB 3.48Å; V560-L564 PolarHBondContact O-N 3.29Å; L564-Q567 CarbonylContact O-C 3.29Å; L564-Q567 VanDerWaalsContact O-C 3.29Å; L564-Q567 PolarHBondContact O-N 3.25Å; L564-S568 WeakPolarHBondContact O-CA 3.25Å; L564-S568 PolarHBondContact O-N 3.13Å
565	S	96	Very high	96.3	Very high	63 Å²	63	55.8 Å²	55.8	44%	0.441	29%	0.289	S	S	.	.	H	α-helix	trans	-63.6	-42.8	172.4	-61.8	0	0	0	0	111.4	L489 R561 L563 Q567 S568	L489-S565 WeakPolarHBondContact CD2-OG 3.42Å; R561-S565 WeakPolarHBondContact O-CB 3.37Å; R561-S565 PolarHBondContact O-N 3.39Å; R561-S565 PolarHBondContact O-OG 3.09Å; L563-S565 VanDerWaalsContact C-N 3.35Å; L563-S565 PolarHBondContact O-N 3.17Å; S565-Q567 PolarHBondContact O-N 2.9Å; S565-S568 PolarHBondContact O-N 3.46Å
566	S	96.5	Very high	96.2	Very high	85 Å²	85	56.1 Å²	56.1	59%	0.594	29%	0.288	S	S	*	.	H	α-helix	trans	-64.8	-28.7	176.4	77.3	0	0	0	0	112.9	T562 L563	T562-S566 PolarHBondContact O-N 2.92Å; T562-S566 VanDerWaalsContact O-N 3.09Å; L563-S566 PolarHBondContact O-N 3.48Å; L563-S566 PolarHBondContact O-OG 2.96Å
567	Q	94	Very high	96.1	Very high	62 Å²	62	56.1 Å²	56.1	29%	0.29	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.9	25.8	-178.8	-59.7	-61.2	-13.6	0	0	113.7	L431 L435 L563 L564 S565 K569 Q570 H571	L431-Q567 HydrophobicContact CD2-CB 4.06Å; L435-Q567 HydrophobicContact CD1-CB 4.24Å; L435-Q567 HydrophobicContact CD1-CG 3.7Å; L563-Q567 PolarHBondContact O-N 3.41Å; L563-Q567 VanDerWaalsContact O-N 3.13Å; L564-Q567 CarbonylContact O-C 3.29Å; L564-Q567 VanDerWaalsContact O-C 3.29Å; L564-Q567 PolarHBondContact O-N 3.25Å; S565-Q567 PolarHBondContact O-N 2.9Å; Q567-K569 PolarHBondContact O-N 3.22Å; Q567-K569 VanDerWaalsContact O-N 3.1Å; Q567-Q570 HydrophobicContact CB-CB 4.36Å; Q567-Q570 WeakPolarHBondContact O-CB 3.39Å; Q567-Q570 PolarHBondContact O-N 3.36Å; Q567-Q570 VanDerWaalsContact OE1-OE1 3.04Å; Q567-H571 PolarHBondContact O-N 2.94Å
568	S	93.7	Very high	95.9	Very high	60 Å²	60	55.1 Å²	55.1	42%	0.42	28%	0.283	S	S	.	.	H	α-helix	trans	-54.9	-35.8	-175.5	176	0	0	0	0	113.5	L564 S565 K572	L564-S568 WeakPolarHBondContact O-CA 3.25Å; L564-S568 PolarHBondContact O-N 3.13Å; S565-S568 PolarHBondContact O-N 3.46Å; S568-K572 PolarHBondContact O-N 3Å
569	K	94.5	Very high	95.8	Very high	189 Å²	189	53.8 Å²	53.8	82%	0.822	27%	0.273	S	S	*	.	H	α-helix	trans	-64.9	-42.4	175.8	-70.2	179.5	-177.2	175.3	0	112.6	Q567 L573	Q567-K569 PolarHBondContact O-N 3.22Å; Q567-K569 VanDerWaalsContact O-N 3.1Å; K569-L573 VanDerWaalsContact O-CB 3.25Å; K569-L573 WeakPolarHBondContact O-CB 3.41Å; K569-L573 PolarHBondContact O-N 3.26Å
570	Q	94.7	Very high	95.5	Very high	58 Å²	58	53.8 Å²	53.8	27%	0.271	28%	0.276	S	S	.	.	H	α-helix	trans	-68.7	-41.8	178.9	-72.7	-175.6	-12.7	0	0	111	L431 Q567 L573 L574 L593	L431-Q570 HydrophobicContact CD1-CB 4.38Å; L431-Q570 HydrophobicContact CD2-CB 4.11Å; Q567-Q570 HydrophobicContact CB-CB 4.36Å; Q567-Q570 WeakPolarHBondContact O-CB 3.39Å; Q567-Q570 PolarHBondContact O-N 3.36Å; Q567-Q570 VanDerWaalsContact OE1-OE1 3.04Å; Q570-L573 PolarHBondContact O-N 2.96Å; Q570-L574 WeakPolarHBondContact O-CB 3.29Å; Q570-L574 PolarHBondContact O-N 3.15Å; Q570-L593 HydrophobicContact CB-CD2 3.77Å; Q570-L593 HydrophobicContact CG-CD2 4.16Å
571	H	96	Very high	95.3	Very high	1 Å²	1	57 Å²	57	1%	0.005	29%	0.291	C	S	.	.	H	α-helix	trans	-57.5	-50.2	175.5	177.6	-118	0	0	0	111.8	F424 G428 L431 G486 Q567 L573 L574 A575	F424-H571 AromaticContact CD1-CE1 3.63Å; F424-H571 PolarHBondContact O-NE2 3.44Å; G428-H571 PolarHBondContact N-NE2 2.87Å; L431-H571 HydrophobicContact CD2-CB 3.78Å; G486-H571 VanDerWaalsContact CA-CE1 3.49Å; G486-H571 WeakPolarHBondContact CA-CE1 3.49Å; G486-H571 PolarHBondContact O-CE1 3.06Å; G486-H571 VanDerWaalsContact O-CE1 3.24Å; Q567-H571 PolarHBondContact O-N 2.94Å; H571-L573 PolarHBondContact O-N 3.01Å; H571-L574 PolarHBondContact O-N 3.28Å; H571-A575 WeakPolarHBondContact O-CB 3.29Å; H571-A575 PolarHBondContact O-N 2.85Å
572	K	95.5	Very high	95	Very high	109 Å²	109	57.5 Å²	57.5	47%	0.474	30%	0.296	S	S	.	.	H	α-helix	trans	-61.7	-44.2	176.5	-178.7	174.6	174.6	177.3	0	112.7	F424 S568 L574 A575 E576	F424-K572 HydrophobicContact CE1-CB 4.38Å; F424-K572 HydrophobicContact CE1-CG 4.33Å; F424-K572 HydrophobicContact CZ-CG 4.47Å; S568-K572 PolarHBondContact O-N 3Å; K572-L574 VanDerWaalsContact C-N 3.32Å; K572-L574 PolarHBondContact O-N 3.17Å; K572-A575 PolarHBondContact O-N 3.22Å; K572-E576 WeakPolarHBondContact CE-OE1 2.89Å; K572-E576 HydrophobicContact CG-CG 4.49Å; K572-E576 IonicContact NZ-OE1 3.86Å; K572-E576 WeakPolarHBondContact O-CB 3.41Å; K572-E576 WeakPolarHBondContact O-CG 3.3Å; K572-E576 PolarHBondContact O-N 3.18Å
573	L	95.3	Very high	94.8	Very high	60 Å²	60	55.3 Å²	55.3	31%	0.314	28%	0.283	S	S	.	.	H	α-helix	trans	-63.2	-40	-179.9	-178.6	146.6	0	0	0	111.7	K569 Q570 H571 A577 V592	K569-L573 VanDerWaalsContact O-CB 3.25Å; K569-L573 WeakPolarHBondContact O-CB 3.41Å; K569-L573 PolarHBondContact O-N 3.26Å; Q570-L573 PolarHBondContact O-N 2.96Å; H571-L573 PolarHBondContact O-N 3.01Å; L573-A577 WeakPolarHBondContact O-CB 3.38Å; L573-A577 PolarHBondContact O-N 3.37Å; L573-V592 HydrophobicContact CD2-CB 4.41Å; L573-V592 HydrophobicContact CD2-CG1 3.27Å; L573-V592 WeakPolarHBondContact CD2-O 3.19Å
574	L	96.1	Very high	94.7	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-67.7	-43.9	176	-179.1	56.7	0	0	0	111.8	A427 A430 Q570 H571 K572 E576 A577 L578 L584 V589 V592 L593	A427-L574 HydrophobicContact CB-CB 4.21Å; A427-L574 HydrophobicContact CB-CD2 4.1Å; A427-L574 HydrophobicContact CB-CG 3.95Å; A430-L574 HydrophobicContact CB-CD2 4.1Å; Q570-L574 WeakPolarHBondContact O-CB 3.29Å; Q570-L574 PolarHBondContact O-N 3.15Å; H571-L574 PolarHBondContact O-N 3.28Å; K572-L574 VanDerWaalsContact C-N 3.32Å; K572-L574 PolarHBondContact O-N 3.17Å; L574-E576 PolarHBondContact O-N 2.85Å; L574-A577 PolarHBondContact O-N 3.16Å; L574-L578 HydrophobicContact CG-CD1 4.45Å; L574-L578 WeakPolarHBondContact O-CG 3.22Å; L574-L578 PolarHBondContact O-N 3.27Å; L574-L584 HydrophobicContact CD1-CD1 3.85Å; L574-V589 HydrophobicContact CD1-CB 4.4Å; L574-V589 HydrophobicContact CD1-CG1 3.89Å; L574-V589 HydrophobicContact CD1-CG2 4.06Å; L574-V589 HydrophobicContact CD2-CG1 4.06Å; L574-V592 HydrophobicContact CD1-CG1 4.2Å; L574-L593 HydrophobicContact CB-CD2 4.49Å
575	A	95.7	Very high	94.6	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-61.9	-40.9	176.7	0	0	0	0	0	112.4	F424 A427 H571 K572 L578 L579	F424-A575 HydrophobicContact CB-CB 4.45Å; F424-A575 HydrophobicContact CD1-CB 3.44Å; F424-A575 VanDerWaalsContact CD1-CB 3.44Å; F424-A575 HydrophobicContact CD2-CB 4.03Å; F424-A575 HydrophobicContact CE1-CB 3.54Å; F424-A575 HydrophobicContact CE2-CB 4.07Å; F424-A575 HydrophobicContact CG-CB 3.72Å; F424-A575 HydrophobicContact CZ-CB 3.84Å; A427-A575 HydrophobicContact CB-CB 3.93Å; H571-A575 WeakPolarHBondContact O-CB 3.29Å; H571-A575 PolarHBondContact O-N 2.85Å; K572-A575 PolarHBondContact O-N 3.22Å; A575-L578 PolarHBondContact O-N 3.43Å; A575-L579 WeakPolarHBondContact O-CG 3.48Å; A575-L579 PolarHBondContact O-N 2.89Å
576	E	95	Very high	94.4	Very high	80 Å²	80	56.5 Å²	56.5	37%	0.374	28%	0.284	S	S	.	.	H	α-helix	trans	-65.8	-37.2	175.1	-74	176	-178.7	0	0	112.4	K572 L574 L579 H580	K572-E576 WeakPolarHBondContact CE-OE1 2.89Å; K572-E576 HydrophobicContact CG-CG 4.49Å; K572-E576 IonicContact NZ-OE1 3.86Å; K572-E576 WeakPolarHBondContact O-CB 3.41Å; K572-E576 WeakPolarHBondContact O-CG 3.3Å; K572-E576 PolarHBondContact O-N 3.18Å; L574-E576 PolarHBondContact O-N 2.85Å; E576-L579 PolarHBondContact O-N 3.45Å; E576-H580 PolarHBondContact O-N 3.18Å
577	A	95.3	Very high	94.3	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-65.7	-41.6	173.1	0	0	0	0	0	111.6	L573 L574 L579 H580 F581 L584 V592	L573-A577 WeakPolarHBondContact O-CB 3.38Å; L573-A577 PolarHBondContact O-N 3.37Å; L574-A577 PolarHBondContact O-N 3.16Å; A577-L579 VanDerWaalsContact C-N 3.33Å; A577-L579 PolarHBondContact O-N 2.88Å; A577-H580 PolarHBondContact O-N 3.13Å; A577-H580 VanDerWaalsContact O-N 3.13Å; A577-F581 HydrophobicContact CB-CD2 4.31Å; A577-F581 VanDerWaalsContact O-CD2 3.29Å; A577-F581 WeakPolarHBondContact O-CD2 3.47Å; A577-F581 PolarHBondContact O-N 3.26Å; A577-L584 HydrophobicContact CB-CD1 3.92Å; A577-V592 HydrophobicContact CB-CB 4.46Å; A577-V592 HydrophobicContact CB-CG1 3.63Å; A577-V592 HydrophobicContact CB-CG2 3.9Å
578	L	94.9	Very high	94.3	Very high	0 Å²	0	58 Å²	58	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-60.9	-40.9	175.1	-77.1	170.3	0	0	0	112.1	A423 E426 A427 V445 I447 L574 A575 H580 E582 L584	A423-L578 HydrophobicContact CB-CB 4.13Å; E426-L578 HydrophobicContact CB-CD1 4.42Å; A427-L578 HydrophobicContact CB-CD1 4.08Å; V445-L578 HydrophobicContact CB-CD2 4.43Å; V445-L578 HydrophobicContact CG1-CD2 3.86Å; V445-L578 HydrophobicContact CG2-CD1 3.86Å; V445-L578 HydrophobicContact CG2-CD2 4Å; I447-L578 WeakPolarHBondContact CD1-O 3.49Å; I447-L578 HydrophobicContact CG2-CB 4.21Å; I447-L578 HydrophobicContact CG2-CD1 4.48Å; L574-L578 HydrophobicContact CG-CD1 4.45Å; L574-L578 WeakPolarHBondContact O-CG 3.22Å; L574-L578 PolarHBondContact O-N 3.27Å; A575-L578 PolarHBondContact O-N 3.43Å; L578-H580 PolarHBondContact O-N 3.24Å; L578-E582 WeakPolarHBondContact O-CA 3.27Å; L578-E582 PolarHBondContact O-N 3.38Å; L578-L584 HydrophobicContact CD2-CB 4.36Å; L578-L584 HydrophobicContact CD2-CD1 3.87Å; L578-L584 HydrophobicContact CD2-CG 4.05Å; L578-L584 HydrophobicContact CG-CD1 4.03Å
579	L	93.7	Very high	94.4	Very high	52 Å²	52	55.1 Å²	55.1	27%	0.272	27%	0.265	S	S	.	.	H	α-helix	trans	-62.8	-25	176.6	-73.7	167.1	0	0	0	113.7	R420 A423 I447 A575 E576 A577	R420-L579 HydrophobicContact CB-CD2 4.42Å; R420-L579 HydrophobicContact CG-CD1 4.23Å; A423-L579 HydrophobicContact CB-CD1 4.36Å; A423-L579 HydrophobicContact CB-CD2 3.79Å; A423-L579 HydrophobicContact CB-CG 3.65Å; I447-L579 HydrophobicContact CD1-CD2 4.22Å; A575-L579 WeakPolarHBondContact O-CG 3.48Å; A575-L579 PolarHBondContact O-N 2.89Å; E576-L579 PolarHBondContact O-N 3.45Å; A577-L579 VanDerWaalsContact C-N 3.33Å; A577-L579 PolarHBondContact O-N 2.88Å
580	H	92.4	Very high	94.4	Very high	91 Å²	91	49.9 Å²	49.9	42%	0.421	25%	0.245	S	C	.	.	H	α-helix	trans	-92.3	-46.6	179.4	-173.9	66.2	0	0	0	113	E576 A577 L578 P599 P600	E576-H580 PolarHBondContact O-N 3.18Å; A577-H580 PolarHBondContact O-N 3.13Å; A577-H580 VanDerWaalsContact O-N 3.13Å; L578-H580 PolarHBondContact O-N 3.24Å; H580-P599 HydrophobicContact CB-CB 3.79Å; H580-P600 WeakPolarHBondContact NE2-CD 3.27Å
581	F	93	Very high	94.5	Very high	70 Å²	70	48.3 Å²	48.3	31%	0.307	24%	0.242	S	C	.	.	H	α-helix	trans	-92.9	-13.6	-174.6	-64	-68.5	0	0	0	113.6	A577 T583 L584 M597	A577-F581 HydrophobicContact CB-CD2 4.31Å; A577-F581 VanDerWaalsContact O-CD2 3.29Å; A577-F581 WeakPolarHBondContact O-CD2 3.47Å; A577-F581 PolarHBondContact O-N 3.26Å; F581-T583 PolarHBondContact O-N 3.2Å; F581-L584 HydrophobicContact CB-CD2 3.78Å; F581-L584 HydrophobicContact CB-CG 4.41Å; F581-L584 HydrophobicContact CD2-CD2 3.92Å; F581-L584 HydrophobicContact CG-CD2 4.06Å; F581-M597 HydrophobicContact CD1-CE 3.86Å; F581-M597 HydrophobicContact CD2-CE 3.86Å; F581-M597 HydrophobicContact CE1-CE 3.63Å; F581-M597 HydrophobicContact CE2-CE 3.64Å; F581-M597 HydrophobicContact CE2-CG 4.14Å; F581-M597 HydrophobicContact CG-CE 3.98Å; F581-M597 HydrophobicContact CZ-CE 3.51Å; F581-M597 HydrophobicContact CZ-CG 4.21Å
582	E	92.2	Very high	94.4	Very high	97 Å²	97	48.3 Å²	48.3	45%	0.453	24%	0.242	S	C	.	.	S	Bend	trans	63	-36	-176.8	-54.8	-179.5	149.5	0	0	115.4	T446 I447 I448 L578	T446-E582 CarbonylContact C-O 3.55Å; T446-E582 VanDerWaalsContact CA-O 3.31Å; T446-E582 WeakPolarHBondContact CA-O 3.27Å; T446-E582 PolarHBondContact OG1-O 3Å; I447-E582 HydrophobicContact CG1-CB 4.29Å; I447-E582 WeakPolarHBondContact CG1-O 3.31Å; I447-E582 PolarHBondContact N-O 3.26Å; I448-E582 HydrophobicContact CD1-CB 4.46Å; I448-E582 HydrophobicContact CG1-CB 4.12Å; L578-E582 WeakPolarHBondContact O-CA 3.27Å; L578-E582 PolarHBondContact O-N 3.38Å
583	T	92.8	Very high	94.2	Very high	48 Å²	48	45 Å²	45	29%	0.294	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	133.3	179	-57.6	0	0	0	0	109.6	V445 T446 I448 F581	V445-T583 CarbonylContact O-C 3.52Å; V445-T583 WeakPolarHBondContact O-CA 3.3Å; T446-T583 WeakPolarHBondContact CB-OG1 3.46Å; T446-T583 PolarHBondContact OG1-OG1 3.03Å; I448-T583 WeakPolarHBondContact CD1-OG1 3.32Å; F581-T583 PolarHBondContact O-N 3.2Å
584	L	95.1	Very high	94.1	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	129.9	176.1	-62.8	170.3	0	0	0	109.8	K444 V445 L574 A577 L578 F581 E588 V589 V592 M597	K444-L584 CarbonylContact C-O 3.53Å; K444-L584 VanDerWaalsContact CA-O 3.26Å; K444-L584 WeakPolarHBondContact CA-O 3.4Å; V445-L584 HydrophobicContact CG1-CB 4.09Å; V445-L584 PolarHBondContact N-O 3.31Å; V445-L584 PolarHBondContact O-N 3.48Å; L574-L584 HydrophobicContact CD1-CD1 3.85Å; A577-L584 HydrophobicContact CB-CD1 3.92Å; L578-L584 HydrophobicContact CD2-CB 4.36Å; L578-L584 HydrophobicContact CD2-CD1 3.87Å; L578-L584 HydrophobicContact CD2-CG 4.05Å; L578-L584 HydrophobicContact CG-CD1 4.03Å; F581-L584 HydrophobicContact CB-CD2 3.78Å; F581-L584 HydrophobicContact CB-CG 4.41Å; F581-L584 HydrophobicContact CD2-CD2 3.92Å; F581-L584 HydrophobicContact CG-CD2 4.06Å; L584-E588 HydrophobicContact CB-CB 4.33Å; L584-E588 HydrophobicContact CD2-CB 4.03Å; L584-V589 HydrophobicContact CB-CG2 3.7Å; L584-V589 HydrophobicContact CD1-CG2 4.45Å; L584-V592 HydrophobicContact CD1-CG2 4.32Å; L584-M597 HydrophobicContact CD2-CE 4.11Å
585	T	93.6	Very high	93.8	Very high	56 Å²	56	46.7 Å²	46.7	34%	0.344	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	163.7	169.5	60.8	0	0	0	0	111.3	D587 E588 V589	T585-D587 VanDerWaalsContact C-N 3.25Å; T585-D587 PolarHBondContact O-N 2.99Å; T585-E588 WeakPolarHBondContact CB-OE2 3.43Å; T585-E588 WeakPolarHBondContact CG2-OE2 3.18Å; T585-E588 PolarHBondContact N-OE2 2.93Å; T585-E588 PolarHBondContact O-N 2.99Å; T585-E588 VanDerWaalsContact O-N 3.1Å; T585-E588 VanDerWaalsContact OG1-CD 3.22Å; T585-E588 VanDerWaalsContact OG1-CG 3.31Å; T585-E588 WeakPolarHBondContact OG1-CG 3.42Å; T585-E588 PolarHBondContact OG1-N 2.9Å; T585-E588 PolarHBondContact OG1-OE2 2.84Å; T585-V589 WeakPolarHBondContact O-CG2 3.42Å; T585-V589 PolarHBondContact O-N 3.28Å
586	K	93.2	Very high	93.3	Very high	69 Å²	69	55.4 Å²	55.4	30%	0.3	29%	0.293	S	S	.	.	H	α-helix	trans	-46.6	-48.3	175.6	-174.8	-166.2	-176.3	177.3	0	112.7	L442 H443 V589 L590	L442-K586 WeakPolarHBondContact O-CB 3.33Å; L442-K586 VanDerWaalsContact O-CD 3.28Å; L442-K586 WeakPolarHBondContact O-CD 3.27Å; L442-K586 WeakPolarHBondContact O-CG 3.18Å; H443-K586 PolarHBondContact O-N 3.36Å; K586-V589 PolarHBondContact O-N 2.97Å; K586-L590 HydrophobicContact CG-CD1 4.4Å; K586-L590 WeakPolarHBondContact O-CG 3.33Å; K586-L590 PolarHBondContact O-N 3.47Å
587	D	93.5	Very high	92.9	Very high	107 Å²	107	53.8 Å²	53.8	57%	0.572	29%	0.286	S	S	*	.	H	α-helix	trans	-68.5	-37.5	-176.2	-59.2	-40.1	0	0	0	111.5	T585 L590 A591	T585-D587 VanDerWaalsContact C-N 3.25Å; T585-D587 PolarHBondContact O-N 2.99Å; D587-L590 PolarHBondContact O-N 3.49Å; D587-A591 WeakPolarHBondContact O-CB 3.29Å; D587-A591 PolarHBondContact O-N 3.46Å
588	E	95.1	Very high	92.3	Very high	71 Å²	71	60.6 Å²	60.6	33%	0.332	32%	0.316	S	S	.	.	H	α-helix	trans	-68.6	-39.8	173.8	-68.6	164.8	148.5	0	0	111.6	L584 T585 L590 A591 V592 M597	L584-E588 HydrophobicContact CB-CB 4.33Å; L584-E588 HydrophobicContact CD2-CB 4.03Å; T585-E588 WeakPolarHBondContact CB-OE2 3.43Å; T585-E588 WeakPolarHBondContact CG2-OE2 3.18Å; T585-E588 PolarHBondContact N-OE2 2.93Å; T585-E588 PolarHBondContact O-N 2.99Å; T585-E588 VanDerWaalsContact O-N 3.1Å; T585-E588 VanDerWaalsContact OG1-CD 3.22Å; T585-E588 VanDerWaalsContact OG1-CG 3.31Å; T585-E588 WeakPolarHBondContact OG1-CG 3.42Å; T585-E588 PolarHBondContact OG1-N 2.9Å; T585-E588 PolarHBondContact OG1-OE2 2.84Å; E588-L590 VanDerWaalsContact C-N 3.34Å; E588-L590 PolarHBondContact O-N 2.9Å; E588-A591 PolarHBondContact O-N 3.07Å; E588-V592 WeakPolarHBondContact O-CB 3.42Å; E588-V592 VanDerWaalsContact O-CG2 3.24Å; E588-V592 WeakPolarHBondContact O-CG2 3.43Å; E588-V592 PolarHBondContact O-N 3.28Å; E588-M597 HydrophobicContact CB-SD 4.01Å; E588-M597 HydrophobicContact CG-SD 4.13Å
589	V	95.1	Very high	91.3	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-59.5	-46.9	173	173.2	0	0	0	0	110.2	L434 L442 V445 L574 L584 T585 K586 A591 V592 L593	L434-V589 HydrophobicContact CD1-CG1 3.56Å; L442-V589 HydrophobicContact CD2-CB 4.22Å; L442-V589 HydrophobicContact CD2-CG1 4.06Å; L442-V589 HydrophobicContact CD2-CG2 4.12Å; V445-V589 HydrophobicContact CG1-CG2 3.64Å; L574-V589 HydrophobicContact CD1-CB 4.4Å; L574-V589 HydrophobicContact CD1-CG1 3.89Å; L574-V589 HydrophobicContact CD1-CG2 4.06Å; L574-V589 HydrophobicContact CD2-CG1 4.06Å; L584-V589 HydrophobicContact CB-CG2 3.7Å; L584-V589 HydrophobicContact CD1-CG2 4.45Å; T585-V589 WeakPolarHBondContact O-CG2 3.42Å; T585-V589 PolarHBondContact O-N 3.28Å; K586-V589 PolarHBondContact O-N 2.97Å; V589-A591 VanDerWaalsContact C-N 3.32Å; V589-A591 PolarHBondContact O-N 3.05Å; V589-V592 WeakPolarHBondContact O-CB 3.48Å; V589-V592 PolarHBondContact O-N 3.16Å; V589-L593 HydrophobicContact CG1-CD1 4.03Å; V589-L593 HydrophobicContact CG1-CG 4.36Å; V589-L593 WeakPolarHBondContact O-CB 3.49Å; V589-L593 VanDerWaalsContact O-CG 3.26Å; V589-L593 WeakPolarHBondContact O-CG 3.3Å; V589-L593 PolarHBondContact O-N 2.95Å
590	L	95.3	Very high	90.3	Very high	79 Å²	79	64.1 Å²	64.1	41%	0.414	34%	0.342	S	S	.	.	H	α-helix	trans	-62.7	-38.5	175.8	-68.7	174.6	0	0	0	112	L434 K586 D587 E588 L593 A594	L434-L590 HydrophobicContact CD1-CD2 4.43Å; L434-L590 HydrophobicContact CD2-CD2 4.37Å; K586-L590 HydrophobicContact CG-CD1 4.4Å; K586-L590 WeakPolarHBondContact O-CG 3.33Å; K586-L590 PolarHBondContact O-N 3.47Å; D587-L590 PolarHBondContact O-N 3.49Å; E588-L590 VanDerWaalsContact C-N 3.34Å; E588-L590 PolarHBondContact O-N 2.9Å; L590-L593 PolarHBondContact O-N 3.14Å; L590-A594 VanDerWaalsContact O-CB 3.26Å; L590-A594 WeakPolarHBondContact O-CB 3.33Å; L590-A594 PolarHBondContact O-N 3.24Å
591	A	95	Very high	88.5	Confident	25 Å²	25	69.4 Å²	69.4	21%	0.207	36%	0.363	C	S	.	.	H	α-helix	trans	-66.5	-37.8	176	0	0	0	0	0	112.6	D587 E588 V589 G595 K596 M597	D587-A591 WeakPolarHBondContact O-CB 3.29Å; D587-A591 PolarHBondContact O-N 3.46Å; E588-A591 PolarHBondContact O-N 3.07Å; V589-A591 VanDerWaalsContact C-N 3.32Å; V589-A591 PolarHBondContact O-N 3.05Å; A591-G595 PolarHBondContact O-N 3.24Å; A591-G595 VanDerWaalsContact O-N 3.16Å; A591-K596 HydrophobicContact CB-CB 4.4Å; A591-K596 PolarHBondContact O-N 2.62Å; A591-M597 HydrophobicContact CB-CB 4.07Å; A591-M597 PolarHBondContact O-N 3.34Å
592	V	94	Very high	86.2	Confident	1 Å²	1	72.3 Å²	72.3	1%	0.006	39%	0.387	C	S	.	.	H	α-helix	trans	-63.7	-51	173.5	163.7	0	0	0	0	109.7	L573 L574 A577 L584 E588 V589 A594 G595 M597	L573-V592 HydrophobicContact CD2-CB 4.41Å; L573-V592 HydrophobicContact CD2-CG1 3.27Å; L573-V592 WeakPolarHBondContact CD2-O 3.19Å; L574-V592 HydrophobicContact CD1-CG1 4.2Å; A577-V592 HydrophobicContact CB-CB 4.46Å; A577-V592 HydrophobicContact CB-CG1 3.63Å; A577-V592 HydrophobicContact CB-CG2 3.9Å; L584-V592 HydrophobicContact CD1-CG2 4.32Å; E588-V592 WeakPolarHBondContact O-CB 3.42Å; E588-V592 VanDerWaalsContact O-CG2 3.24Å; E588-V592 WeakPolarHBondContact O-CG2 3.43Å; E588-V592 PolarHBondContact O-N 3.28Å; V589-V592 WeakPolarHBondContact O-CB 3.48Å; V589-V592 PolarHBondContact O-N 3.16Å; V592-A594 VanDerWaalsContact C-N 3.29Å; V592-A594 PolarHBondContact O-N 2.72Å; V592-G595 WeakPolarHBondContact O-CA 3.41Å; V592-G595 PolarHBondContact O-N 2.96Å; V592-M597 WeakPolarHBondContact CA-O 3.45Å; V592-M597 HydrophobicContact CG2-CB 3.85Å; V592-M597 HydrophobicContact CG2-CG 3.94Å; V592-M597 HydrophobicContact CG2-SD 4.07Å
593	L	93	Very high	83.5	Confident	38 Å²	38	75.9 Å²	75.9	20%	0.199	40%	0.403	C	S	.	.	H	α-helix	trans	-62.1	-34.6	177.9	-67.6	177.5	0	0	0	113	L431 L434 Q570 L574 V589 L590 G595	L431-L593 HydrophobicContact CD1-CD1 4.14Å; L431-L593 HydrophobicContact CD1-CD2 4.26Å; L434-L593 HydrophobicContact CD1-CD1 3.84Å; Q570-L593 HydrophobicContact CB-CD2 3.77Å; Q570-L593 HydrophobicContact CG-CD2 4.16Å; L574-L593 HydrophobicContact CB-CD2 4.49Å; V589-L593 HydrophobicContact CG1-CD1 4.03Å; V589-L593 HydrophobicContact CG1-CG 4.36Å; V589-L593 WeakPolarHBondContact O-CB 3.49Å; V589-L593 VanDerWaalsContact O-CG 3.26Å; V589-L593 WeakPolarHBondContact O-CG 3.3Å; V589-L593 PolarHBondContact O-N 2.95Å; L590-L593 PolarHBondContact O-N 3.14Å; L593-G595 PolarHBondContact O-N 3.25Å
594	A	92.7	Very high	80.6	Confident	67 Å²	67	78.7 Å²	78.7	55%	0.554	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-5.2	172.7	0	0	0	0	0	113.6	L590 V592 K596	L590-A594 VanDerWaalsContact O-CB 3.26Å; L590-A594 WeakPolarHBondContact O-CB 3.33Å; L590-A594 PolarHBondContact O-N 3.24Å; V592-A594 VanDerWaalsContact C-N 3.29Å; V592-A594 PolarHBondContact O-N 2.72Å; A594-K596 VanDerWaalsContact C-N 3.27Å; A594-K596 HydrophobicContact CB-CD 4.49Å; A594-K596 HydrophobicContact CB-CG 4.27Å; A594-K596 PolarHBondContact O-N 3.17Å
595	G	88.4	Confident	77.9	Confident	30 Å²	30	84.9 Å²	84.9	31%	0.309	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.7	12.1	-178.8	0	0	0	0	0	115.2	A591 V592 L593 K598	A591-G595 PolarHBondContact O-N 3.24Å; A591-G595 VanDerWaalsContact O-N 3.16Å; V592-G595 WeakPolarHBondContact O-CA 3.41Å; V592-G595 PolarHBondContact O-N 2.96Å; L593-G595 PolarHBondContact O-N 3.25Å; G595-K598 VanDerWaalsContact O-CE 3.3Å; G595-K598 WeakPolarHBondContact O-CE 3.39Å
596	K	87.1	Confident	74.9	Confident	183 Å²	183	88.1 Å²	88.1	80%	0.796	48%	0.482	S	S	*	.	S	Bend	trans	-77.6	-31	176.7	-65.2	-179.4	-179.9	177.7	0	112.2	A591 A594	A591-K596 HydrophobicContact CB-CB 4.4Å; A591-K596 PolarHBondContact O-N 2.62Å; A594-K596 VanDerWaalsContact C-N 3.27Å; A594-K596 HydrophobicContact CB-CD 4.49Å; A594-K596 HydrophobicContact CB-CG 4.27Å; A594-K596 PolarHBondContact O-N 3.17Å
597	M	86.4	Confident	72.2	Confident	46 Å²	46	90.3 Å²	90.3	23%	0.227	51%	0.506	C	S	.	.	S	Bend	trans	-113.3	119.6	175.4	-173.8	172.5	-177.9	0	0	108.1	F581 L584 E588 A591 V592	F581-M597 HydrophobicContact CD1-CE 3.86Å; F581-M597 HydrophobicContact CD2-CE 3.86Å; F581-M597 HydrophobicContact CE1-CE 3.63Å; F581-M597 HydrophobicContact CE2-CE 3.64Å; F581-M597 HydrophobicContact CE2-CG 4.14Å; F581-M597 HydrophobicContact CG-CE 3.98Å; F581-M597 HydrophobicContact CZ-CE 3.51Å; F581-M597 HydrophobicContact CZ-CG 4.21Å; L584-M597 HydrophobicContact CD2-CE 4.11Å; E588-M597 HydrophobicContact CB-SD 4.01Å; E588-M597 HydrophobicContact CG-SD 4.13Å; A591-M597 HydrophobicContact CB-CB 4.07Å; A591-M597 PolarHBondContact O-N 3.34Å; V592-M597 WeakPolarHBondContact CA-O 3.45Å; V592-M597 HydrophobicContact CG2-CB 3.85Å; V592-M597 HydrophobicContact CG2-CG 3.94Å; V592-M597 HydrophobicContact CG2-SD 4.07Å
598	K	80.9	Confident	69.2	Low	143 Å²	143	94.3 Å²	94.3	62%	0.622	52%	0.519	S	S	*	.			trans	-128.8	141.9	177.7	-68.9	-179	-178.9	172.3	0	108.8	G595	G595-K598 VanDerWaalsContact O-CE 3.3Å; G595-K598 WeakPolarHBondContact O-CE 3.39Å
599	P	75.5	Confident	66.4	Low	42 Å²	42	96.6 Å²	96.6	27%	0.273	54%	0.543	S	S	.	.			trans	-57.4	140.1	166.6	26.1	-32.4	0	0	0	108.4	H580 K601	H580-P599 HydrophobicContact CB-CB 3.79Å; P599-K601 PolarHBondContact O-N 3.3Å
600	P	72.2	Confident	63.4	Low	84 Å²	84	102.2 Å²	102.2	55%	0.545	58%	0.577	S	S	.	*			trans	-54.9	133.9	171.9	23.6	-29.7	0	0	0	108.1	H580 T602	H580-P600 WeakPolarHBondContact NE2-CD 3.27Å; P600-T602 PolarHBondContact O-N 3.02Å
601	K	55.5	Low	60.7	Low	202 Å²	202	104.3 Å²	104.3	88%	0.878	59%	0.593	S	S	*	*			trans	-58.1	114	173.1	-69.8	-178	179.2	-179.9	0	106.6	P599 Q603	P599-K601 PolarHBondContact O-N 3.3Å; K601-Q603 VanDerWaalsContact C-N 3.34Å; K601-Q603 PolarHBondContact O-N 3.41Å
602	T	44	Very low	57.7	Low	130 Å²	130	110.9 Å²	110.9	80%	0.798	62%	0.624	S	S	*	*			trans	-51.6	100.8	172.3	-52.9	0	0	0	0	107.8	P600 S604	P600-T602 PolarHBondContact O-N 3.02Å; T602-S604 PolarHBondContact O-N 2.95Å
603	Q	34.3	Very low	55	Low	172 Å²	172	117.7 Å²	117.7	80%	0.804	66%	0.66	S	S	*	*			trans	-62.1	126.6	156.7	-69.1	-176.1	4.8	0	0	103.9	K601 V605	K601-Q603 VanDerWaalsContact C-N 3.34Å; K601-Q603 PolarHBondContact O-N 3.41Å; Q603-V605 VanDerWaalsContact C-N 3.28Å; Q603-V605 PolarHBondContact O-N 3.25Å
604	S	33.1	Very low	52.2	Low	107 Å²	107	121.2 Å²	121.2	75%	0.748	69%	0.685	S	S	*	*			trans	-51.6	96.3	175.3	52.2	0	0	0	0	108.6	T602 T606	T602-S604 PolarHBondContact O-N 2.95Å; S604-T606 VanDerWaalsContact C-N 3.32Å; S604-T606 PolarHBondContact O-N 2.97Å
605	V	37.8	Very low	49.4	Very low	131 Å²	131	126.8 Å²	126.8	79%	0.794	70%	0.699	S	S	*	*			trans	-68.4	101.6	173.5	178.8	0	0	0	0	104.9	Q603 S607	Q603-V605 VanDerWaalsContact C-N 3.28Å; Q603-V605 PolarHBondContact O-N 3.25Å; V605-S607 PolarHBondContact O-N 3.27Å
606	T	31.9	Very low	46.7	Very low	123 Å²	123	133.5 Å²	133.5	76%	0.755	73%	0.727	S	S	*	*			trans	-57.2	122.7	167.1	-8.4	0	0	0	0	106.1	S604 K608	S604-T606 VanDerWaalsContact C-N 3.32Å; S604-T606 PolarHBondContact O-N 2.97Å; T606-K608 PolarHBondContact O-N 3.33Å
607	S	34.7	Very low	44.1	Very low	115 Å²	115	127.5 Å²	127.5	80%	0.804	72%	0.718	S	S	*	*			trans	-47.1	98.1	179.6	42.7	0	0	0	0	112.1	V605	V605-S607 PolarHBondContact O-N 3.27Å
608	K	32.2	Very low	41.7	Very low	192 Å²	192	131.4 Å²	131.4	84%	0.835	75%	0.747	S	S	*	*			trans	-129.8	74.2	153.2	-72.5	-169.8	179.5	-179.3	0	107.8	T606 T610	T606-K608 PolarHBondContact O-N 3.33Å; K608-T610 PolarHBondContact O-N 3.12Å; K608-T610 VanDerWaalsContact O-N 3.09Å
609	S	34.7	Very low	39.4	Very low	119 Å²	119	130.2 Å²	130.2	83%	0.832	76%	0.756	S	S	*	*			trans	-66	101.8	160.4	-178.4	0	0	0	0	107.4
610	T	33.2	Very low	37.2	Very low	117 Å²	117	134.3 Å²	134.3	72%	0.718	78%	0.78	S	S	*	*			trans	-145	74.1	159.6	-49.8	0	0	0	0	107.1	K608	K608-T610 PolarHBondContact O-N 3.12Å; K608-T610 VanDerWaalsContact O-N 3.09Å
611	T	38	Very low	35.3	Very low	124 Å²	124	135.2 Å²	135.2	76%	0.761	79%	0.789	S	S	*	*			trans	-115.5	101	161.4	-51.9	0	0	0	0	107.3	L613	T611-L613 PolarHBondContact O-N 3.48Å; T611-L613 VanDerWaalsContact O-N 3.11Å
612	L	31.9	Very low	34.3	Very low	163 Å²	163	131.9 Å²	131.9	85%	0.853	79%	0.786	S	S	*	*			trans	-59.8	101.5	167.5	-67.3	158.7	0	0	0	108.2
613	L	38.2	Very low	33.9	Very low	144 Å²	144	133.8 Å²	133.8	75%	0.754	79%	0.786	S	S	*	*			trans	-96.2	138.1	157.7	-86.5	159.3	0	0	0	108	T611 Q615	T611-L613 PolarHBondContact O-N 3.48Å; T611-L613 VanDerWaalsContact O-N 3.11Å; L613-Q615 PolarHBondContact O-N 3.43Å
614	P	34.3	Very low	34.1	Very low	112 Å²	112	131.5 Å²	131.5	73%	0.727	78%	0.777	S	S	*	*			trans	-63.2	126.3	-170.7	-16.2	29	0	0	0	110.4	L616	P614-L616 PolarHBondContact O-N 3.06Å
615	Q	33.3	Very low	34.4	Very low	183 Å²	183	130.2 Å²	130.2	86%	0.855	77%	0.766	S	S	*	*			trans	-56.7	108.5	170	-63.9	-75.5	-6.2	0	0	107.8	L613 G617	L613-Q615 PolarHBondContact O-N 3.43Å; Q615-G617 PolarHBondContact O-N 3.38Å; Q615-G617 VanDerWaalsContact O-N 3.13Å
616	L	32.4	Very low	34.6	Very low	171 Å²	171	134.6 Å²	134.6	90%	0.895	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-60.5	117.8	161.9	-89.5	97.2	0	0	0	106.5	P614	P614-L616 PolarHBondContact O-N 3.06Å
617	G	32.2	Very low	35.2	Very low	58 Å²	58	136.1 Å²	136.1	60%	0.598	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-54.6	155.6	178.8	0	0	0	0	0	112.1	Q615 S619	Q615-G617 PolarHBondContact O-N 3.38Å; Q615-G617 VanDerWaalsContact O-N 3.13Å; G617-S619 PolarHBondContact O-N 3Å
618	P	36.2	Very low	35.8	Very low	128 Å²	128	134.9 Å²	134.9	83%	0.831	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-58.2	126.8	-169.2	22.6	-32.4	0	0	0	111	T620	P618-T620 PolarHBondContact O-N 2.68Å
619	S	31.8	Very low	36.8	Very low	118 Å²	118	129.3 Å²	129.3	83%	0.825	74%	0.735	S	S	*	*			trans	-58.9	107.7	172.8	47.6	0	0	0	0	109.1	G617 S621	G617-S619 PolarHBondContact O-N 3Å; S619-S621 PolarHBondContact O-N 3.25Å
620	T	29.4	Very low	37.7	Very low	127 Å²	127	127 Å²	127	78%	0.779	72%	0.719	S	S	*	*			trans	-60.4	107.8	165.5	48.8	0	0	0	0	107.4	P618 T622	P618-T620 PolarHBondContact O-N 2.68Å; T620-T622 PolarHBondContact O-N 3.37Å
621	S	32.9	Very low	38.6	Very low	103 Å²	103	126.7 Å²	126.7	72%	0.72	71%	0.712	S	S	*	*			trans	-55	105.3	166.3	49.4	0	0	0	0	108	S619 E623	S619-S621 PolarHBondContact O-N 3.25Å; S621-E623 PolarHBondContact O-N 3.47Å
622	T	33.6	Very low	39.8	Very low	132 Å²	132	125.7 Å²	125.7	81%	0.81	70%	0.701	S	S	*	*			trans	-65.3	91.2	166.4	36.7	0	0	0	0	107.5	T620 I624	T620-T622 PolarHBondContact O-N 3.37Å; T622-I624 PolarHBondContact O-N 3.47Å
623	E	36.2	Very low	41.3	Very low	171 Å²	171	122.7 Å²	122.7	80%	0.799	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-55.1	117.3	161.5	-75.1	-172	154.7	0	0	107.6	S621 P625	S621-E623 PolarHBondContact O-N 3.47Å; E623-P625 WeakPolarHBondContact O-CD 3.4Å
624	I	37.8	Very low	42.5	Very low	123 Å²	123	119.7 Å²	119.7	63%	0.631	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-58.5	120	168.5	-62.8	170.1	0	0	0	106	T622 R626 I628 V629	T622-I624 PolarHBondContact O-N 3.47Å; I624-R626 PolarHBondContact O-N 3.2Å; I624-R626 VanDerWaalsContact O-N 3.17Å; I624-I628 HydrophobicContact CG2-CB 4.41Å; I624-V629 HydrophobicContact CG2-CG2 4.34Å
625	P	38.8	Very low	43.5	Very low	80 Å²	80	120.2 Å²	120.2	52%	0.519	67%	0.665	S	S	.	*	P	Polyproline II helix	trans	-57.4	126.7	-174.6	-23	30.9	0	0	0	109.7	E623 M627 I628	E623-P625 WeakPolarHBondContact O-CD 3.4Å; P625-M627 PolarHBondContact O-N 2.97Å; P625-I628 HydrophobicContact CG-CD1 4.48Å; P625-I628 PolarHBondContact O-N 3.43Å
626	R	43.4	Very low	45	Very low	224 Å²	224	115.3 Å²	115.3	85%	0.845	65%	0.647	S	S	*	*	H	α-helix	trans	-46.4	-26.4	179.2	-74.5	178.9	171.9	164	-2.2	113.6	I624 I628 V629 S630	I624-R626 PolarHBondContact O-N 3.2Å; I624-R626 VanDerWaalsContact O-N 3.17Å; R626-I628 PolarHBondContact O-N 2.88Å; R626-V629 PolarHBondContact O-N 2.88Å; R626-S630 PolarHBondContact O-N 3.34Å; R626-S630 VanDerWaalsContact O-N 3.08Å; R626-S630 PolarHBondContact O-OG 2.86Å
627	M	44.3	Very low	46.2	Very low	155 Å²	155	110.3 Å²	110.3	76%	0.764	62%	0.623	S	S	*	*	H	α-helix	trans	-57.9	-39.9	172.8	-96.7	-172.6	172.5	0	0	114.4	P625 S630 L631	P625-M627 PolarHBondContact O-N 2.97Å; M627-S630 PolarHBondContact O-N 3.49Å; M627-L631 PolarHBondContact O-N 3.38Å
628	I	47.7	Very low	47.2	Very low	89 Å²	89	112.3 Å²	112.3	46%	0.456	62%	0.62	S	S	.	*	H	α-helix	trans	-71.3	-40.5	-176.8	-59.2	179.2	0	0	0	110.3	I624 P625 R626 L631 I632	I624-I628 HydrophobicContact CG2-CB 4.41Å; P625-I628 HydrophobicContact CG-CD1 4.48Å; P625-I628 PolarHBondContact O-N 3.43Å; R626-I628 PolarHBondContact O-N 2.88Å; I628-L631 PolarHBondContact O-N 2.91Å; I628-I632 HydrophobicContact CG2-CD1 4.08Å; I628-I632 WeakPolarHBondContact O-CG1 3.47Å; I628-I632 PolarHBondContact O-N 3.39Å; I628-I632 VanDerWaalsContact O-N 3.12Å
629	V	53.3	Low	48	Very low	75 Å²	75	113.1 Å²	113.1	46%	0.455	61%	0.611	S	S	.	*	H	α-helix	trans	-65.7	-41.7	176.2	-179.4	0	0	0	0	110.7	I624 R626 L631 I632 I633	I624-V629 HydrophobicContact CG2-CG2 4.34Å; R626-V629 PolarHBondContact O-N 2.88Å; V629-L631 PolarHBondContact O-N 3.36Å; V629-I632 PolarHBondContact O-N 2.95Å; V629-I633 HydrophobicContact CG1-CD1 3.92Å; V629-I633 VanDerWaalsContact O-CG1 3.29Å; V629-I633 WeakPolarHBondContact O-CG1 3.4Å; V629-I633 PolarHBondContact O-N 2.75Å; V629-I633 VanDerWaalsContact O-N 3.13Å
630	S	52.5	Low	48.9	Very low	71 Å²	71	111.9 Å²	111.9	50%	0.497	59%	0.594	S	S	.	*	H	α-helix	trans	-63.5	-38.5	174.7	-64.4	0	0	0	0	112.9	R626 M627 I633 V634	R626-S630 PolarHBondContact O-N 3.34Å; R626-S630 VanDerWaalsContact O-N 3.08Å; R626-S630 PolarHBondContact O-OG 2.86Å; M627-S630 PolarHBondContact O-N 3.49Å; S630-I633 PolarHBondContact O-N 3.08Å; S630-V634 VanDerWaalsContact O-CG2 3.3Å; S630-V634 WeakPolarHBondContact O-CG2 3.45Å; S630-V634 PolarHBondContact O-N 2.99Å
631	L	53.5	Low	49.9	Very low	109 Å²	109	108.8 Å²	108.8	57%	0.571	58%	0.578	S	S	*	*	H	α-helix	trans	-66.7	-41	179.4	-130.9	108.6	0	0	0	112.2	M627 I628 V629 V634 H635	M627-L631 PolarHBondContact O-N 3.38Å; I628-L631 PolarHBondContact O-N 2.91Å; V629-L631 PolarHBondContact O-N 3.36Å; L631-V634 PolarHBondContact O-N 3.24Å; L631-H635 PolarHBondContact O-CD2 3.43Å; L631-H635 PolarHBondContact O-N 2.95Å
632	I	63.1	Low	50.6	Low	104 Å²	104	112.5 Å²	112.5	53%	0.533	58%	0.581	S	S	.	*	H	α-helix	trans	-64.6	-43	177.5	-66.1	167.1	0	0	0	110.3	I628 V629 V634 H635 V636	I628-I632 HydrophobicContact CG2-CD1 4.08Å; I628-I632 WeakPolarHBondContact O-CG1 3.47Å; I628-I632 PolarHBondContact O-N 3.39Å; I628-I632 VanDerWaalsContact O-N 3.12Å; V629-I632 PolarHBondContact O-N 2.95Å; I632-V634 PolarHBondContact O-N 2.88Å; I632-H635 PolarHBondContact O-N 3.1Å; I632-V636 HydrophobicContact CG2-CG2 4.45Å; I632-V636 VanDerWaalsContact O-CG2 3.3Å; I632-V636 WeakPolarHBondContact O-CG2 3.49Å; I632-V636 PolarHBondContact O-N 2.84Å
633	I	62.1	Low	50.9	Low	100 Å²	100	113.7 Å²	113.7	51%	0.513	58%	0.576	S	S	.	*	H	α-helix	trans	-63.9	-42.1	178.7	-67.1	168.1	0	0	0	111	V629 S630 V636 V637	V629-I633 HydrophobicContact CG1-CD1 3.92Å; V629-I633 VanDerWaalsContact O-CG1 3.29Å; V629-I633 WeakPolarHBondContact O-CG1 3.4Å; V629-I633 PolarHBondContact O-N 2.75Å; V629-I633 VanDerWaalsContact O-N 3.13Å; S630-I633 PolarHBondContact O-N 3.08Å; I633-V636 PolarHBondContact O-N 3.3Å; I633-V637 HydrophobicContact CG2-CG2 4.37Å; I633-V637 VanDerWaalsContact O-CG2 3.25Å; I633-V637 WeakPolarHBondContact O-CG2 3.41Å; I633-V637 PolarHBondContact O-N 3.28Å
634	V	63.7	Low	50.9	Low	81 Å²	81	108.5 Å²	108.5	49%	0.491	56%	0.557	S	S	.	*	H	α-helix	trans	-62.6	-45.5	177.5	172.6	0	0	0	0	111.1	S630 L631 I632 V636 V637 D638	S630-V634 VanDerWaalsContact O-CG2 3.3Å; S630-V634 WeakPolarHBondContact O-CG2 3.45Å; S630-V634 PolarHBondContact O-N 2.99Å; L631-V634 PolarHBondContact O-N 3.24Å; I632-V634 PolarHBondContact O-N 2.88Å; V634-V636 VanDerWaalsContact C-N 3.35Å; V634-V636 PolarHBondContact O-N 3.41Å; V634-V637 PolarHBondContact O-N 3.33Å; V634-D638 PolarHBondContact O-N 3.13Å
635	H	55.8	Low	51.2	Low	123 Å²	123	108.3 Å²	108.3	57%	0.569	56%	0.564	S	S	*	*	H	α-helix	trans	-64.6	-36.3	178.9	-86.1	-65.6	0	0	0	113.5	L631 I632 F639	L631-H635 PolarHBondContact O-CD2 3.43Å; L631-H635 PolarHBondContact O-N 2.95Å; I632-H635 PolarHBondContact O-N 3.1Å; H635-F639 VanDerWaalsContact O-CB 3.26Å; H635-F639 WeakPolarHBondContact O-CB 3.35Å; H635-F639 PolarHBondContact O-N 2.85Å
636	V	64.7	Low	51.3	Low	79 Å²	79	111.2 Å²	111.2	48%	0.479	57%	0.569	S	S	.	*	H	α-helix	trans	-68.9	-40.4	176.3	173.1	0	0	0	0	111	I632 I633 V634 F639 I640	I632-V636 HydrophobicContact CG2-CG2 4.45Å; I632-V636 VanDerWaalsContact O-CG2 3.3Å; I632-V636 WeakPolarHBondContact O-CG2 3.49Å; I632-V636 PolarHBondContact O-N 2.84Å; I633-V636 PolarHBondContact O-N 3.3Å; V634-V636 VanDerWaalsContact C-N 3.35Å; V634-V636 PolarHBondContact O-N 3.41Å; V636-F639 PolarHBondContact O-N 2.68Å; V636-I640 HydrophobicContact CG1-CD1 3.77Å; V636-I640 WeakPolarHBondContact O-CD1 3.39Å; V636-I640 VanDerWaalsContact O-CG1 3.23Å; V636-I640 WeakPolarHBondContact O-CG1 3.13Å; V636-I640 PolarHBondContact O-N 2.94Å; V636-I640 VanDerWaalsContact O-N 3.07Å
637	V	58.1	Low	51.2	Low	66 Å²	66	109.6 Å²	109.6	40%	0.4	57%	0.568	S	S	.	*	H	α-helix	trans	-68.6	-40.4	178.9	173.3	0	0	0	0	111.9	I633 V634 I640 S641	I633-V637 HydrophobicContact CG2-CG2 4.37Å; I633-V637 VanDerWaalsContact O-CG2 3.25Å; I633-V637 WeakPolarHBondContact O-CG2 3.41Å; I633-V637 PolarHBondContact O-N 3.28Å; V634-V637 PolarHBondContact O-N 3.33Å; V637-I640 PolarHBondContact O-N 3.22Å; V637-S641 WeakPolarHBondContact O-CB 3.42Å; V637-S641 PolarHBondContact O-N 3.24Å; V637-S641 PolarHBondContact O-OG 3.34Å
638	D	52.6	Low	51	Low	100 Å²	100	109.1 Å²	109.1	54%	0.535	57%	0.568	S	S	.	*	H	α-helix	trans	-67.3	-38.8	176.1	-78.2	-18.8	0	0	0	111.7	V634 S641 F642	V634-D638 PolarHBondContact O-N 3.13Å; D638-S641 PolarHBondContact O-N 2.96Å; D638-F642 PolarHBondContact O-N 3.44Å; D638-F642 VanDerWaalsContact O-N 3.07Å
639	F	53.5	Low	50.7	Low	146 Å²	146	108.5 Å²	108.5	64%	0.64	57%	0.569	S	S	*	*	H	α-helix	trans	-64.8	-41	177.3	-164.2	-95.7	0	0	0	112.2	H635 V636 F643	H635-F639 VanDerWaalsContact O-CB 3.26Å; H635-F639 WeakPolarHBondContact O-CB 3.35Å; H635-F639 PolarHBondContact O-N 2.85Å; V636-F639 PolarHBondContact O-N 2.68Å; F639-F643 HydrophobicContact CZ-CE2 4.26Å
640	I	49.2	Very low	49.9	Very low	91 Å²	91	107.9 Å²	107.9	47%	0.467	56%	0.563	S	S	.	*	H	α-helix	trans	-69.5	-36.9	176.6	-65.8	165.9	0	0	0	111.1	V636 V637 F642 F643 C644	V636-I640 HydrophobicContact CG1-CD1 3.77Å; V636-I640 WeakPolarHBondContact O-CD1 3.39Å; V636-I640 VanDerWaalsContact O-CG1 3.23Å; V636-I640 WeakPolarHBondContact O-CG1 3.13Å; V636-I640 PolarHBondContact O-N 2.94Å; V636-I640 VanDerWaalsContact O-N 3.07Å; V637-I640 PolarHBondContact O-N 3.22Å; I640-F642 VanDerWaalsContact C-N 3.33Å; I640-F642 PolarHBondContact O-N 2.93Å; I640-F643 PolarHBondContact O-N 3.43Å; I640-C644 PolarHBondContact O-N 3.3Å
641	S	50.7	Low	49.4	Very low	63 Å²	63	111.5 Å²	111.5	44%	0.441	57%	0.571	S	S	.	*	H	α-helix	trans	-68.9	-29.5	179.2	-60.4	0	0	0	0	113	V637 D638 F643	V637-S641 WeakPolarHBondContact O-CB 3.42Å; V637-S641 PolarHBondContact O-N 3.24Å; V637-S641 PolarHBondContact O-OG 3.34Å; D638-S641 PolarHBondContact O-N 2.96Å; S641-F643 VanDerWaalsContact C-N 3.34Å
642	F	47.6	Very low	48.8	Very low	180 Å²	180	111.1 Å²	111.1	79%	0.789	57%	0.574	S	S	*	*	H	α-helix	trans	-70.9	-28.2	178.5	-161.5	-98.4	0	0	0	113.2	D638 I640	D638-F642 PolarHBondContact O-N 3.44Å; D638-F642 VanDerWaalsContact O-N 3.07Å; I640-F642 VanDerWaalsContact C-N 3.33Å; I640-F642 PolarHBondContact O-N 2.93Å
643	F	40.6	Very low	47.6	Very low	158 Å²	158	113.8 Å²	113.8	69%	0.693	58%	0.579	S	S	*	*	H	α-helix	trans	-98.9	-4.8	-175.7	-88.1	-82.2	0	0	0	115.1	F639 I640 S641	F639-F643 HydrophobicContact CZ-CE2 4.26Å; I640-F643 PolarHBondContact O-N 3.43Å; S641-F643 VanDerWaalsContact C-N 3.34Å
644	C	35	Very low	46.8	Very low	62 Å²	62	111.9 Å²	111.9	42%	0.419	57%	0.572	S	S	.	*			trans	-116.3	115.3	-175.9	-150.4	0	0	0	0	112.5	I640 F646	I640-C644 PolarHBondContact O-N 3.3Å; C644-F646 PolarHBondContact O-N 3.25Å; C644-F646 VanDerWaalsContact O-N 3.13Å
645	P	44.7	Very low	45.6	Very low	119 Å²	119	114.7 Å²	114.7	77%	0.773	58%	0.579	S	S	*	*			trans	-80.2	14.8	-175.5	32.1	-33.6	0	0	0	114.7
646	F	42	Very low	44.7	Very low	141 Å²	141	112.9 Å²	112.9	62%	0.618	58%	0.577	S	S	*	*			trans	-111.2	84	179.4	-84	-87.9	0	0	0	111.3	C644 D648	C644-F646 PolarHBondContact O-N 3.25Å; C644-F646 VanDerWaalsContact O-N 3.13Å; F646-D648 VanDerWaalsContact C-N 3.26Å; F646-D648 PolarHBondContact O-N 3.5Å
647	K	40.9	Very low	43.4	Very low	189 Å²	189	114.2 Å²	114.2	82%	0.822	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	-26.8	-177.7	-135.5	177.1	-176.2	-177.6	0	113.6
648	D	39.7	Very low	42.4	Very low	145 Å²	145	119 Å²	119	78%	0.775	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	-21.7	-171.9	-64.3	-24.4	0	0	0	114	F646	F646-D648 VanDerWaalsContact C-N 3.26Å; F646-D648 PolarHBondContact O-N 3.5Å
649	T	40.4	Very low	41.6	Very low	77 Å²	77	120.9 Å²	120.9	47%	0.472	60%	0.602	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.5	-22	-176.2	-23.1	0	0	0	0	113.3	T652	T649-T652 PolarHBondContact O-OG1 2.65Å
650	L	37.3	Very low	40.6	Very low	61 Å²	61	120.4 Å²	120.4	32%	0.319	61%	0.606	S	S	.	*	H	α-helix	trans	-79.9	-25.8	-177.9	-122.7	92	0	0	0	113.3	T652 Y653 T654	L650-T652 VanDerWaalsContact C-N 3.25Å; L650-T652 PolarHBondContact O-N 3.49Å; L650-Y653 PolarHBondContact O-N 3.08Å; L650-T654 PolarHBondContact O-N 2.89Å; L650-T654 PolarHBondContact O-OG1 3.36Å; L650-T654 VanDerWaalsContact O-N 3.08Å; L650-T654 WeakPolarHBondContact O-CG2 3.25Å
651	H	41.6	Very low	39.8	Very low	147 Å²	147	124.9 Å²	124.9	68%	0.681	62%	0.622	S	S	*	*	H	α-helix	trans	-67	-28.4	-176.7	-123.7	-60.8	0	0	0	112.6	T654	H651-T654 PolarHBondContact O-OG1 2.88Å
652	T	40.8	Very low	39.1	Very low	102 Å²	102	129.2 Å²	129.2	63%	0.626	65%	0.652	S	S	*	*	H	α-helix	trans	-79	-35.3	174.7	9.5	0	0	0	0	112.7	T649 L650 T656	T649-T652 PolarHBondContact O-OG1 2.65Å; L650-T652 VanDerWaalsContact C-N 3.25Å; L650-T652 PolarHBondContact O-N 3.49Å; T652-T656 PolarHBondContact O-OG1 3.46Å
653	Y	38	Very low	38.7	Very low	160 Å²	160	126.7 Å²	126.7	63%	0.627	65%	0.645	S	S	*	*	H	α-helix	trans	-75.5	-29	179.7	-95.9	-85.9	0	0	0	113.8	L650 H655 T656 H657	L650-Y653 PolarHBondContact O-N 3.08Å; Y653-H655 VanDerWaalsContact C-N 3.35Å; Y653-T656 PolarHBondContact O-OG1 2.99Å; Y653-T656 VanDerWaalsContact O-OG1 3.12Å; Y653-H657 PolarHBondContact O-N 2.87Å
654	T	45.4	Very low	38.6	Very low	60 Å²	60	125 Å²	125	37%	0.368	64%	0.643	S	S	.	*	H	α-helix	trans	-73.2	-26	178.8	44.2	0	0	0	0	113.1	L650 H651 K658	L650-T654 PolarHBondContact O-N 2.89Å; L650-T654 PolarHBondContact O-OG1 3.36Å; L650-T654 VanDerWaalsContact O-N 3.08Å; L650-T654 WeakPolarHBondContact O-CG2 3.25Å; H651-T654 PolarHBondContact O-OG1 2.88Å; T654-K658 PolarHBondContact O-N 2.94Å
655	H	38.8	Very low	38.8	Very low	139 Å²	139	128.5 Å²	128.5	64%	0.644	66%	0.655	S	S	*	*	H	α-helix	trans	-76.1	-32.5	179.1	-127.9	-73.6	0	0	0	113	Y653	Y653-H655 VanDerWaalsContact C-N 3.35Å
656	T	37.2	Very low	38.4	Very low	85 Å²	85	129.1 Å²	129.1	52%	0.521	65%	0.648	S	S	.	*	H	α-helix	trans	-74.8	-34.7	177	28	0	0	0	0	112.7	T652 Y653	T652-T656 PolarHBondContact O-OG1 3.46Å; Y653-T656 PolarHBondContact O-OG1 2.99Å; Y653-T656 VanDerWaalsContact O-OG1 3.12Å
657	H	36.3	Very low	38.2	Very low	108 Å²	108	128.3 Å²	128.3	50%	0.5	65%	0.65	S	S	.	*	H	α-helix	trans	-79.5	-24.3	-179.1	-90.6	-79.4	0	0	0	114.9	Y653 L659 L660	Y653-H657 PolarHBondContact O-N 2.87Å; H657-L659 PolarHBondContact O-N 2.82Å; H657-L660 PolarHBondContact O-N 3.09Å
658	K	38.1	Very low	38	Very low	167 Å²	167	124.3 Å²	124.3	73%	0.726	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.8	-25.8	172.8	-87.5	-175.6	176.5	179.5	0	113.3	T654	T654-K658 PolarHBondContact O-N 2.94Å
659	L	36.6	Very low	37.9	Very low	138 Å²	138	122.8 Å²	122.8	72%	0.723	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	-18.9	179.8	-104.3	152.5	0	0	0	113.9	H657	H657-L659 PolarHBondContact O-N 2.82Å
660	L	31.7	Very low	37.7	Very low	137 Å²	137	126.3 Å²	126.3	72%	0.717	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	-14.7	-177.4	-97.2	152.9	0	0	0	113.7	H657	H657-L660 PolarHBondContact O-N 3.09Å
661	F	33	Very low	37.7	Very low	185 Å²	185	131.8 Å²	131.8	81%	0.811	67%	0.668	S	S	*	*			trans	-114.4	-4.8	-175.4	-100.5	-79.7	0	0	0	115.2
662	S	35.4	Very low	37.4	Very low	153 Å²	153	130.4 Å²	130.4	100%	1.07	67%	0.667	S	S	*	*			trans	-90.4	0	163.3	82	0	0	0	0	109.5

Retrieved 662 of 662 residues in 188.1 ms (Link to these results)

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