A0A087YSN0_POEFO Loading...

Homeobox and leucine zipper encoding a

AlphaFold DB , UniProt , Accession A0A087YSN0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 658 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	34.3	Very low	36.5	Very low	238 Å²	238	146.5 Å²	146.5	100%	1.172	81%	0.808	S	S	*	*				0	109.9	0	-54.5	178.5	-135.6	0	0	104.7
2	A	35.9	Very low	36.1	Very low	91 Å²	91	144.2 Å²	144.2	75%	0.752	81%	0.81	S	S	*	*				72	122.7	61.9	0	0	0	0	0	109.3
3	E	38.4	Very low	35.5	Very low	165 Å²	165	149.5 Å²	149.5	77%	0.771	81%	0.813	S	S	*	*			cis	-136.6	156	16.4	-77.3	-150.8	167	0	0	112.3
4	H	41.2	Very low	35.5	Very low	174 Å²	174	148.3 Å²	148.3	81%	0.806	81%	0.812	S	S	*	*				62.8	139.2	70.8	-102.8	-116.5	0	0	0	111.8
5	I	38.3	Very low	35.4	Very low	124 Å²	124	149.1 Å²	149.1	64%	0.636	81%	0.808	S	S	*	*			cis	-142.6	156.4	27.1	-65.6	179.7	0	0	0	112	I7	I5-I7 HydrophobicContact CG2-CD1 4.24Å; I5-I7 HydrophobicContact CG2-CG1 3.89Å
6	L	43.3	Very low	35.2	Very low	170 Å²	170	154.3 Å²	154.3	89%	0.89	81%	0.812	S	S	*	*			trans	-119.7	141.3	160.2	-81.7	170.1	0	0	0	111.1
7	I	37.6	Very low	35	Very low	150 Å²	150	154.8 Å²	154.8	77%	0.769	82%	0.816	S	S	*	*			trans	-146.8	121.2	169.3	-59.9	179.2	0	0	0	105.7	I5	I5-I7 HydrophobicContact CG2-CD1 4.24Å; I5-I7 HydrophobicContact CG2-CG1 3.89Å
8	A	36.5	Very low	34.8	Very low	90 Å²	90	149.4 Å²	149.4	74%	0.744	80%	0.804	S	S	*	*			cis	84	108.6	17.7	0	0	0	0	0	116.2
9	D	34.8	Very low	34.8	Very low	157 Å²	157	154.2 Å²	154.2	84%	0.84	81%	0.81	S	S	*	*			trans	-153.1	146.4	150.1	-152.5	-7.2	0	0	0	111.9
10	M	29.3	Very low	34.6	Very low	171 Å²	171	152.9 Å²	152.9	84%	0.842	80%	0.803	S	S	*	*			trans	-170.6	151.2	179.1	-104.2	-133.6	70.6	0	0	112.5
11	A	32.5	Very low	34.6	Very low	81 Å²	81	155.7 Å²	155.7	67%	0.669	80%	0.803	S	S	*	*			trans	72.9	157.7	174.8	0	0	0	0	0	114.3
12	S	31.6	Very low	34.6	Very low	119 Å²	119	154.3 Å²	154.3	83%	0.832	79%	0.785	S	S	*	*			cis	-149.6	168.2	32.6	-63.6	0	0	0	0	115.9
13	Y	28	Very low	34.3	Very low	214 Å²	214	157 Å²	157	84%	0.839	79%	0.785	S	S	*	*			trans	-64.5	152.8	169.6	-95.6	-129.6	0	0	0	113.3
14	T	34.8	Very low	34.2	Very low	132 Å²	132	154.6 Å²	154.6	81%	0.81	78%	0.782	S	S	*	*				-178.1	134.4	102.6	28	0	0	0	0	116.1
15	E	34.3	Very low	33.7	Very low	161 Å²	161	152.7 Å²	152.7	75%	0.752	78%	0.778	S	S	*	*			trans	-50.7	149.1	167	169.6	-178.1	-152.2	0	0	118.1
16	R	33.1	Very low	33.8	Very low	231 Å²	231	153.3 Å²	153.3	87%	0.872	78%	0.782	S	S	*	*			trans	-170.7	165.2	131.6	-104.4	170.1	-145.4	83.1	-12.1	112.9
17	N	32	Very low	33.2	Very low	163 Å²	163	151.2 Å²	151.2	87%	0.872	77%	0.771	S	S	*	*			trans	-147.8	145	-161.4	-170.3	4.1	0	0	0	112.4
18	G	30.2	Very low	33.1	Very low	59 Å²	59	152.3 Å²	152.3	61%	0.608	77%	0.773	S	S	*	*			trans	119.7	124.4	149.3	0	0	0	0	0	121.2
19	R	35.1	Very low	34.2	Very low	240 Å²	240	152.1 Å²	152.1	91%	0.906	76%	0.764	S	S	*	*			trans	68.8	157.9	153.4	-59.5	-174.2	-178.5	170.9	1.3	117.8
20	D	31.5	Very low	33.9	Very low	127 Å²	127	152.9 Å²	152.9	68%	0.679	76%	0.76	S	S	*	*			cis	-144.4	-165.3	8.3	-142.9	-57.4	0	0	0	113.1
21	R	33.8	Very low	34	Very low	212 Å²	212	151.5 Å²	151.5	80%	0.8	75%	0.752	S	S	*	*			trans	-66.7	-179.4	-177	-59.5	152.2	150.5	177.2	-6.7	114.8
22	R	34.6	Very low	33.9	Very low	209 Å²	209	153.2 Å²	153.2	79%	0.789	75%	0.754	S	S	*	*			cis	-167.4	-172	18.5	-147.5	175	-177.9	-160.7	-1.4	112.6
23	L	30.2	Very low	33.7	Very low	147 Å²	147	154.1 Å²	154.1	77%	0.77	75%	0.75	S	S	*	*			trans	78.9	135.4	171.3	-93.6	61.6	0	0	0	116.3
24	V	36.4	Very low	33.8	Very low	115 Å²	115	151.7 Å²	151.7	70%	0.697	75%	0.748	S	S	*	*			cis	123.8	118.6	-5.8	171.8	0	0	0	0	112.9
25	D	30.5	Very low	33.5	Very low	135 Å²	135	151.9 Å²	151.9	72%	0.722	75%	0.749	S	S	*	*			trans	175.7	131	141.1	-88.1	-6.5	0	0	0	108.4
26	L	39.1	Very low	33.2	Very low	136 Å²	136	152.4 Å²	152.4	71%	0.712	75%	0.751	S	S	*	*				68.1	133.2	78.6	-58.5	175.3	0	0	0	113.4
27	D	31.9	Very low	34.1	Very low	126 Å²	126	146 Å²	146	67%	0.674	74%	0.74	S	S	*	*			cis	-156.3	145.5	-1	-96.3	-28.8	0	0	0	109.4
28	E	34.2	Very low	33.9	Very low	173 Å²	173	145.3 Å²	145.3	81%	0.808	73%	0.731	S	S	*	*				59.9	158.2	97.2	-98.7	-135.1	135.9	0	0	117.6
29	P	60.8	Low	33.8	Very low	86 Å²	86	152.9 Å²	152.9	56%	0.558	74%	0.742	S	S	*	*			cis	-141.3	-149.5	-33.7	33.1	-9.1	0	0	0	114.9
30	F	29.1	Very low	33.6	Very low	173 Å²	173	150.6 Å²	150.6	76%	0.759	74%	0.741	S	S	*	*			trans	82.5	142	167.3	-87.3	-127.3	0	0	0	119.2
31	E	30	Very low	33.5	Very low	142 Å²	142	153 Å²	153	66%	0.664	75%	0.748	S	S	*	*			cis	-165.2	156.2	-14.6	-136.3	-165.8	167.4	0	0	111.4
32	V	30.8	Very low	33.3	Very low	118 Å²	118	151.6 Å²	151.6	72%	0.715	75%	0.748	S	S	*	*			trans	51.6	148	143.7	161	0	0	0	0	120.2
33	D	27.6	Very low	33.1	Very low	138 Å²	138	146.5 Å²	146.5	74%	0.738	75%	0.751	S	S	*	*			cis	-143	-175.3	16.3	-153.9	-5.1	0	0	0	113.5
34	M	29.2	Very low	32.9	Very low	163 Å²	163	147.8 Å²	147.8	80%	0.803	75%	0.753	S	S	*	*			trans	-98.4	172.1	-179.7	-43.4	-175.2	-144.4	0	0	114.6
35	T	28.2	Very low	32.6	Very low	135 Å²	135	149.4 Å²	149.4	83%	0.828	76%	0.763	S	S	*	*				152.4	145.1	115.3	-54.5	0	0	0	0	113.8
36	E	30	Very low	32.6	Very low	172 Å²	172	151.4 Å²	151.4	80%	0.804	77%	0.765	S	S	*	*			trans	-89.6	-167.1	176.5	-85.8	-122.9	132.7	0	0	112.6
37	P	51.7	Low	32.1	Very low	98 Å²	98	156.5 Å²	156.5	64%	0.636	78%	0.775	S	S	*	*				-135.2	-162.8	-53.4	37.8	-19.8	0	0	0	113.4
38	E	26.6	Very low	31.9	Very low	147 Å²	147	155.6 Å²	155.6	69%	0.687	78%	0.778	S	S	*	*			trans	97.4	142.2	141.9	-119.4	-172.5	-149.1	0	0	122.9
39	R	29.3	Very low	31.7	Very low	219 Å²	219	152 Å²	152	83%	0.826	77%	0.772	S	S	*	*			trans	91.9	160.3	156.5	-66.8	178.6	-158	-173	7.8	121.8
40	E	30.3	Very low	30.3	Very low	191 Å²	191	156.9 Å²	156.9	89%	0.893	79%	0.785	S	S	*	*			trans	-103.4	152.2	-157.5	-48.3	164.4	102.6	0	0	112.7
41	E	28.7	Very low	30.3	Very low	177 Å²	177	157.3 Å²	157.3	83%	0.827	79%	0.787	S	S	*	*				-167.6	168.2	122.6	-171.9	152.1	-163.4	0	0	110.9
42	K	30	Very low	30.3	Very low	183 Å²	183	156.5 Å²	156.5	80%	0.796	79%	0.786	S	S	*	*			trans	-62.4	148.6	176.2	-52	154	-177.3	149	0	113.6
43	A	30.3	Very low	30.1	Very low	103 Å²	103	160.7 Å²	160.7	85%	0.851	79%	0.789	S	S	*	*			trans	-163.3	167.4	135.2	0	0	0	0	0	111.8
44	E	26.6	Very low	30.1	Very low	174 Å²	174	163.2 Å²	163.2	81%	0.813	80%	0.796	S	S	*	*			trans	-71	145.3	171.5	-58.6	167.9	71.2	0	0	112.7
45	T	30	Very low	30	Very low	148 Å²	148	160.5 Å²	160.5	91%	0.908	79%	0.793	S	S	*	*				-164.8	-176.8	125.2	7.5	0	0	0	0	113.7
46	K	30.8	Very low	30.6	Very low	178 Å²	178	160.1 Å²	160.1	77%	0.774	79%	0.793	S	S	*	*			trans	-116.8	156.3	-161.1	-58.7	160.1	-178	162.1	0	112.2
47	R	28.9	Very low	30.4	Very low	243 Å²	243	157.8 Å²	157.8	92%	0.917	80%	0.795	S	S	*	*			trans	69.6	137.6	167.2	-61.5	171.5	172	172.7	-4.3	114.2
48	S	27.8	Very low	29.3	Very low	106 Å²	106	158.6 Å²	158.6	74%	0.741	80%	0.803	S	S	*	*			cis	81	97.3	35.2	-172.2	0	0	0	0	115.2
49	S	29.4	Very low	29.5	Very low	97 Å²	97	156.5 Å²	156.5	68%	0.678	81%	0.811	S	S	*	*				-178.8	134.9	123.6	-85.1	0	0	0	0	114.7
50	K	30.5	Very low	29.6	Very low	189 Å²	189	155.2 Å²	155.2	82%	0.822	81%	0.814	S	S	*	*			trans	59.9	125.7	146.7	-63.3	168.4	-175.8	171.3	0	119
51	K	29.7	Very low	29.7	Very low	183 Å²	183	151.8 Å²	151.8	80%	0.796	81%	0.811	S	S	*	*				67.1	122.3	77.6	-128.1	-176.6	-176.2	175.7	0	110.7
52	L	29.4	Very low	30.2	Very low	124 Å²	124	149.3 Å²	149.3	65%	0.649	81%	0.814	S	S	*	*				-155.7	149.1	52.5	-84.9	156.2	0	0	0	114.3
53	R	28.2	Very low	30.3	Very low	207 Å²	207	145.1 Å²	145.1	78%	0.781	81%	0.813	S	S	*	*			trans	38.7	137.3	148.2	-52.8	-173	-161.1	-82	8	120.5
54	H	27.4	Very low	30.5	Very low	191 Å²	191	145.7 Å²	145.7	88%	0.884	81%	0.811	S	S	*	*				-149.3	154.6	99.8	-98.8	-77.2	0	0	0	111.4
55	S	26.5	Very low	30.6	Very low	106 Å²	106	141 Å²	141	74%	0.741	81%	0.81	S	S	*	*			trans	-153.6	150.6	173.1	-44.1	0	0	0	0	104.7
56	P	40.8	Very low	30.7	Very low	127 Å²	127	140.1 Å²	140.1	83%	0.825	80%	0.804	S	S	*	*				-148.9	173.8	61.7	41.6	-23.5	0	0	0	116.2
57	S	25.2	Very low	30.7	Very low	122 Å²	122	135.2 Å²	135.2	85%	0.853	80%	0.796	S	S	*	*				-167.9	160.2	123.2	-162.6	0	0	0	0	109.9
58	S	29.4	Very low	30.7	Very low	115 Å²	115	128.7 Å²	128.7	80%	0.804	79%	0.788	S	S	*	*			trans	-105	150.8	-174.6	-61.9	0	0	0	0	112.9
59	A	30.3	Very low	30.8	Very low	103 Å²	103	133.2 Å²	133.2	85%	0.851	80%	0.795	S	S	*	*			trans	-139.5	133.2	153.4	0	0	0	0	0	108.1
60	E	32	Very low	31.1	Very low	192 Å²	192	133.3 Å²	133.3	90%	0.897	79%	0.791	S	S	*	*			trans	-84.4	148.9	-176.4	-65.4	178.4	88.8	0	0	112.3
61	S	31.6	Very low	32	Very low	119 Å²	119	130.4 Å²	130.4	83%	0.832	79%	0.79	S	S	*	*			trans	-154.2	127.7	153.7	-171.6	0	0	0	0	109.9
62	S	38.9	Very low	32.9	Very low	125 Å²	125	128.8 Å²	128.8	87%	0.874	79%	0.79	S	S	*	*			trans	-80.7	119.4	-174.9	-46.6	0	0	0	0	111.3
63	A	32.5	Very low	33.7	Very low	95 Å²	95	129.3 Å²	129.3	79%	0.785	79%	0.789	S	S	*	*			trans	-129	138.2	171	0	0	0	0	0	110.6	G65	A63-G65 PolarHBondContact O-N 2.93Å
64	S	34.6	Very low	34.7	Very low	116 Å²	116	122.7 Å²	122.7	81%	0.811	77%	0.769	S	S	*	*			trans	-53.4	122.5	-175	-173.5	0	0	0	0	112.4	V66	S64-V66 PolarHBondContact O-N 3.02Å
65	G	28.4	Very low	36.4	Very low	76 Å²	76	116.9 Å²	116.9	78%	0.784	75%	0.749	S	S	*	*			trans	-71	85	-177.3	0	0	0	0	0	112.7	A63 A67	A63-G65 PolarHBondContact O-N 2.93Å; G65-A67 PolarHBondContact O-N 3.24Å
66	V	31.8	Very low	38.3	Very low	128 Å²	128	115.6 Å²	115.6	78%	0.776	74%	0.737	S	S	*	*			trans	-62	117.8	165.9	-175.3	0	0	0	0	107.9	S64 S68	S64-V66 PolarHBondContact O-N 3.02Å; V66-S68 PolarHBondContact O-N 3.03Å
67	A	31.6	Very low	39.5	Very low	75 Å²	75	110.7 Å²	110.7	62%	0.62	71%	0.705	S	S	*	*			trans	-64.8	103.2	-173.7	0	0	0	0	0	111.7	G65 F69	G65-A67 PolarHBondContact O-N 3.24Å; A67-F69 WeakPolarHBondContact O-CD2 3.41Å; A67-F69 PolarHBondContact O-N 3.06Å
68	S	28	Very low	41.7	Very low	107 Å²	107	107.4 Å²	107.4	75%	0.748	68%	0.681	S	S	*	*			trans	-65.4	99.5	173.2	-68.2	0	0	0	0	110.5	V66 T70	V66-S68 PolarHBondContact O-N 3.03Å; S68-T70 VanDerWaalsContact C-N 3.31Å; S68-T70 PolarHBondContact O-N 2.83Å
69	F	30.6	Very low	43.7	Very low	200 Å²	200	101.9 Å²	101.9	88%	0.877	64%	0.643	S	S	*	*			trans	-65.5	87.8	173.3	-83.3	-90.7	0	0	0	110.8	A67 T71	A67-F69 WeakPolarHBondContact O-CD2 3.41Å; A67-F69 PolarHBondContact O-N 3.06Å; F69-T71 PolarHBondContact O-N 2.88Å
70	T	36.8	Very low	45.2	Very low	99 Å²	99	100.4 Å²	100.4	61%	0.607	62%	0.624	S	S	*	*			trans	-75.1	106.3	172	48.8	0	0	0	0	109.7	S68	S68-T70 VanDerWaalsContact C-N 3.31Å; S68-T70 PolarHBondContact O-N 2.83Å
71	T	48.4	Very low	46.8	Very low	128 Å²	128	95.8 Å²	95.8	79%	0.785	61%	0.605	S	S	*	*	S	Bend	trans	-61.5	143	172.9	-41.7	0	0	0	0	110.4	F69	F69-T71 PolarHBondContact O-N 2.88Å
72	N	48.6	Very low	47.9	Very low	149 Å²	149	90.5 Å²	90.5	80%	0.797	57%	0.568	S	S	*	*	S	Bend	trans	70.8	78.3	-178.8	-68.9	-52.1	0	0	0	117.3
73	H	45.8	Very low	48.7	Very low	136 Å²	136	86.8 Å²	86.8	63%	0.63	54%	0.542	S	S	*	.	S	Bend	trans	-157.6	21.1	132.2	56.1	-88.2	0	0	0	111.8
74	N	49.8	Very low	49.6	Very low	67 Å²	67	91.3 Å²	91.3	36%	0.358	55%	0.547	S	S	.	.			trans	-156.8	83.2	-174.4	-162.2	-40.2	0	0	0	109.5	V76 Q92	N74-V76 PolarHBondContact O-N 2.65Å; N74-Q92 VanDerWaalsContact ND2-CD 3.27Å; N74-Q92 PolarHBondContact ND2-OE1 2.96Å; N74-Q92 VanDerWaalsContact OD1-CB 3.29Å; N74-Q92 WeakPolarHBondContact OD1-CB 3.46Å; N74-Q92 WeakPolarHBondContact OD1-CG 3.43Å; N74-Q92 PolarHBondContact OD1-OE1 3.32Å
75	S	62.4	Low	50.6	Low	69 Å²	69	89.1 Å²	89.1	48%	0.483	54%	0.543	S	S	.	.			trans	-85.1	113.3	-178.3	65.8	0	0	0	0	110.3	V77 S93	S75-V77 PolarHBondContact O-N 3.25Å; S75-S93 PolarHBondContact N-OG 2.84Å; S75-S93 VanDerWaalsContact N-OG 3.12Å; S75-S93 WeakPolarHBondContact O-CB 3.34Å; S75-S93 PolarHBondContact O-N 3.11Å; S75-S93 PolarHBondContact O-OG 2.99Å; S75-S93 WeakPolarHBondContact OG-CB 3.33Å; S75-S93 PolarHBondContact OG-OG 2.92Å
76	V	66.3	Low	52	Low	79 Å²	79	91.7 Å²	91.7	48%	0.479	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	112.2	179.3	-162.1	0	0	0	0	109.6	N74 W90 Q92	N74-V76 PolarHBondContact O-N 2.65Å; V76-W90 HydrophobicContact CG1-CB 3.91Å; V76-W90 HydrophobicContact CG1-CE3 3.9Å; V76-Q92 HydrophobicContact CG2-CG 4.49Å
77	V	66.9	Low	53.3	Low	24 Å²	24	92.6 Å²	92.6	15%	0.145	53%	0.531	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	127.2	178.1	-169.5	0	0	0	0	109.1	S75 L79 T91 I143	S75-V77 PolarHBondContact O-N 3.25Å; V77-L79 HydrophobicContact CB-CD2 4.4Å; V77-L79 HydrophobicContact CG1-CD2 3.61Å; V77-L79 HydrophobicContact CG1-CG 4.23Å; V77-L79 PolarHBondContact O-N 2.77Å; V77-T91 PolarHBondContact N-O 2.92Å; V77-T91 PolarHBondContact O-N 3.05Å; V77-I143 HydrophobicContact CG1-CD1 3.58Å; V77-I143 HydrophobicContact CG1-CG2 4.49Å
78	C	70.8	Confident	55	Low	53 Å²	53	94.1 Å²	94.1	36%	0.358	53%	0.528	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	104.9	171.3	-173.5	0	0	0	0	109.2	W90	C78-W90 HydrophobicContact CB-CD2 4.36Å; C78-W90 HydrophobicContact CB-CE3 3.85Å; C78-W90 HydrophobicContact CB-CH2 3.97Å; C78-W90 HydrophobicContact CB-CZ2 4.43Å; C78-W90 HydrophobicContact CB-CZ3 3.66Å
79	L	72	Confident	56.9	Low	0 Å²	0	91 Å²	91	0%	0	51%	0.505	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	124	179.9	-61.2	-179.3	0	0	0	110.4	V77 V82 V89 T91 V136 M139 V140 I143	V77-L79 HydrophobicContact CB-CD2 4.4Å; V77-L79 HydrophobicContact CG1-CD2 3.61Å; V77-L79 HydrophobicContact CG1-CG 4.23Å; V77-L79 PolarHBondContact O-N 2.77Å; L79-V82 HydrophobicContact CB-CG2 4.04Å; L79-V89 PolarHBondContact N-O 3.41Å; L79-V89 PolarHBondContact O-N 3.15Å; L79-T91 HydrophobicContact CD1-CG2 4.32Å; L79-V136 HydrophobicContact CD1-CB 4.15Å; L79-V136 HydrophobicContact CD1-CG1 3.73Å; L79-V136 HydrophobicContact CD1-CG2 3.92Å; L79-M139 HydrophobicContact CD2-CB 3.93Å; L79-V140 HydrophobicContact CD1-CG2 3.92Å; L79-V140 HydrophobicContact CD2-CG2 4.1Å; L79-I143 HydrophobicContact CD2-CD1 3.79Å
80	P	62.4	Low	58.7	Low	71 Å²	71	90 Å²	90	46%	0.461	50%	0.495	S	S	.	.			trans	-74.2	132	175.7	30.3	-32.9	0	0	0	111.1	V82	P80-V82 PolarHBondContact O-N 3.26Å
81	L	65.7	Low	60.1	Low	96 Å²	96	85.6 Å²	85.6	50%	0.503	47%	0.468	S	S	.	.			trans	58.4	47.4	151.3	-44.4	176.9	0	0	0	114.8	L86 K87	L81-L86 HydrophobicContact CB-CD2 4.41Å; L81-L86 HydrophobicContact CD1-CD2 4.15Å; L81-L86 HydrophobicContact CD2-CB 3.92Å; L81-L86 HydrophobicContact CD2-CD2 4.06Å; L81-L86 WeakPolarHBondContact CD2-O 3.35Å; L81-L86 HydrophobicContact CG-CD2 4.43Å; L81-K87 WeakPolarHBondContact CA-O 3.34Å; L81-K87 PolarHBondContact N-O 3.42Å
82	V	54.4	Low	61	Low	8 Å²	8	83.8 Å²	83.8	5%	0.048	45%	0.451	C	S	.	.			trans	-65.4	-41.4	-175.2	-174.4	0	0	0	0	113	L79 P80 V89 D132 K135 V136 M139	L79-V82 HydrophobicContact CB-CG2 4.04Å; P80-V82 PolarHBondContact O-N 3.26Å; V82-V89 HydrophobicContact CB-CG2 3.97Å; V82-V89 HydrophobicContact CG2-CB 3.75Å; V82-V89 HydrophobicContact CG2-CG2 3.55Å; V82-D132 HydrophobicContact CG1-CB 4.04Å; V82-K135 VanDerWaalsContact O-CD 3.29Å; V82-K135 WeakPolarHBondContact O-CD 3.35Å; V82-K135 PolarHBondContact O-NZ 3Å; V82-K135 VanDerWaalsContact O-NZ 3.11Å; V82-V136 HydrophobicContact CG1-CG2 3.59Å; V82-V136 HydrophobicContact CG2-CG2 4.13Å; V82-M139 HydrophobicContact CB-CE 4.35Å; V82-M139 HydrophobicContact CG1-CE 4.26Å; V82-M139 HydrophobicContact CG2-CE 3.87Å
83	S	54.2	Low	61.8	Low	46 Å²	46	77.8 Å²	77.8	32%	0.322	42%	0.42	S	S	.	.	S	Bend	trans	-118.3	161.5	-171.6	-39	0	0	0	0	110.8	G85 L86 D132	S83-G85 PolarHBondContact O-N 3.39Å; S83-L86 PolarHBondContact O-N 2.98Å; S83-L86 VanDerWaalsContact O-N 3.11Å; S83-D132 WeakPolarHBondContact CB-OD2 3.28Å; S83-D132 PolarHBondContact OG-OD2 2.67Å
84	E	53.3	Low	62.7	Low	191 Å²	191	74 Å²	74	89%	0.893	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-22	-168	-63.8	170.2	174.4	0	0	114.9	L86	E84-L86 VanDerWaalsContact C-N 3.3Å; E84-L86 PolarHBondContact O-N 3.22Å
85	G	54.4	Low	63.5	Low	70 Å²	70	75.5 Å²	75.5	72%	0.722	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	22.1	174.5	0	0	0	0	0	116.2	S83 K87	S83-G85 PolarHBondContact O-N 3.39Å; G85-K87 PolarHBondContact O-N 3.35Å; G85-K87 VanDerWaalsContact O-N 3.11Å
86	L	57.6	Low	64	Low	130 Å²	130	72.3 Å²	72.3	68%	0.681	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	35.8	177.3	-64.6	177.4	0	0	0	114.8	L81 S83 E84	L81-L86 HydrophobicContact CB-CD2 4.41Å; L81-L86 HydrophobicContact CD1-CD2 4.15Å; L81-L86 HydrophobicContact CD2-CB 3.92Å; L81-L86 HydrophobicContact CD2-CD2 4.06Å; L81-L86 WeakPolarHBondContact CD2-O 3.35Å; L81-L86 HydrophobicContact CG-CD2 4.43Å; S83-L86 PolarHBondContact O-N 2.98Å; S83-L86 VanDerWaalsContact O-N 3.11Å; E84-L86 VanDerWaalsContact C-N 3.3Å; E84-L86 PolarHBondContact O-N 3.22Å
87	K	59.7	Low	64.6	Low	146 Å²	146	76.1 Å²	76.1	64%	0.635	39%	0.393	S	S	*	.			trans	-85	131.4	-175.5	-167	173.6	179.7	-178.8	0	111.9	L81 G85	L81-K87 WeakPolarHBondContact CA-O 3.34Å; L81-K87 PolarHBondContact N-O 3.42Å; G85-K87 PolarHBondContact O-N 3.35Å; G85-K87 VanDerWaalsContact O-N 3.11Å
88	L	68.1	Low	65.2	Low	108 Å²	108	80.6 Å²	80.6	57%	0.565	41%	0.413	S	S	*	.			trans	-70.1	129.8	164.7	-76.9	156.9	0	0	0	109.5
89	V	66.5	Low	65.9	Low	42 Å²	42	78.3 Å²	78.3	26%	0.255	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	129.6	-179.4	-176.9	0	0	0	0	109.5	L79 V82	L79-V89 PolarHBondContact N-O 3.41Å; L79-V89 PolarHBondContact O-N 3.15Å; V82-V89 HydrophobicContact CB-CG2 3.97Å; V82-V89 HydrophobicContact CG2-CB 3.75Å; V82-V89 HydrophobicContact CG2-CG2 3.55Å
90	W	69.1	Low	66.5	Low	179 Å²	179	80.8 Å²	80.8	68%	0.678	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.4	112	170.4	-65.6	94	0	0	0	108.2	V76 C78	V76-W90 HydrophobicContact CG1-CB 3.91Å; V76-W90 HydrophobicContact CG1-CE3 3.9Å; C78-W90 HydrophobicContact CB-CD2 4.36Å; C78-W90 HydrophobicContact CB-CE3 3.85Å; C78-W90 HydrophobicContact CB-CH2 3.97Å; C78-W90 HydrophobicContact CB-CZ2 4.43Å; C78-W90 HydrophobicContact CB-CZ3 3.66Å
91	T	66.8	Low	67.7	Low	6 Å²	6	82.4 Å²	82.4	4%	0.037	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	134.3	-177.5	-60.4	0	0	0	0	109	V77 L79 Q95 V136	V77-T91 PolarHBondContact N-O 2.92Å; V77-T91 PolarHBondContact O-N 3.05Å; L79-T91 HydrophobicContact CD1-CG2 4.32Å; T91-Q95 HydrophobicContact CG2-CB 4.25Å; T91-V136 HydrophobicContact CG2-CG1 3.81Å
92	Q	66.9	Low	68.9	Low	89 Å²	89	79.4 Å²	79.4	42%	0.416	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	136.1	173	-64.8	-175.5	-8.1	0	0	109.4	N74 V76 D94 Q95	N74-Q92 VanDerWaalsContact ND2-CD 3.27Å; N74-Q92 PolarHBondContact ND2-OE1 2.96Å; N74-Q92 VanDerWaalsContact OD1-CB 3.29Å; N74-Q92 WeakPolarHBondContact OD1-CB 3.46Å; N74-Q92 WeakPolarHBondContact OD1-CG 3.43Å; N74-Q92 PolarHBondContact OD1-OE1 3.32Å; V76-Q92 HydrophobicContact CG2-CG 4.49Å; Q92-D94 PolarHBondContact O-N 3.37Å; Q92-Q95 HydrophobicContact CB-CB 4.32Å; Q92-Q95 WeakPolarHBondContact O-CB 3.29Å; Q92-Q95 PolarHBondContact O-N 3.33Å
93	S	64.4	Low	70.5	Confident	23 Å²	23	83 Å²	83	16%	0.161	43%	0.431	C	S	.	.	G	3₁₀ helix	trans	-46.5	-36.7	176.5	43.1	0	0	0	0	113.5	S75 T96	S75-S93 PolarHBondContact N-OG 2.84Å; S75-S93 VanDerWaalsContact N-OG 3.12Å; S75-S93 WeakPolarHBondContact O-CB 3.34Å; S75-S93 PolarHBondContact O-N 3.11Å; S75-S93 PolarHBondContact O-OG 2.99Å; S75-S93 WeakPolarHBondContact OG-CB 3.33Å; S75-S93 PolarHBondContact OG-OG 2.92Å; S93-T96 PolarHBondContact O-OG1 2.83Å
94	D	64.6	Low	72.3	Confident	57 Å²	57	84.9 Å²	84.9	31%	0.305	43%	0.434	S	S	.	.	G	3₁₀ helix	trans	-80.4	-20.2	-173.8	-68.6	65.2	0	0	0	112.3	Q92 T96 R97	Q92-D94 PolarHBondContact O-N 3.37Å; D94-T96 PolarHBondContact O-N 2.63Å; D94-T96 VanDerWaalsContact O-N 3.13Å; D94-R97 PolarHBondContact O-N 3.21Å; D94-R97 VanDerWaalsContact O-N 3.09Å; D94-R97 WeakPolarHBondContact OD2-CD 3.46Å; D94-R97 IonicContact OD2-CZ 3.56Å; D94-R97 IonicContact OD2-NE 2.76Å; D94-R97 IonicContact OD2-NH1 3.43Å; D94-R97 PolarHBondContact OD2-NH1 3.44Å
95	Q	66.5	Low	74.1	Confident	98 Å²	98	75.8 Å²	75.8	46%	0.458	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-69.2	-7.7	176	-160.1	178.1	15	0	0	113.7	T91 Q92 K133	T91-Q95 HydrophobicContact CG2-CB 4.25Å; Q92-Q95 HydrophobicContact CB-CB 4.32Å; Q92-Q95 WeakPolarHBondContact O-CB 3.29Å; Q92-Q95 PolarHBondContact O-N 3.33Å; Q95-K133 PolarHBondContact O-NZ 2.92Å; Q95-K133 VanDerWaalsContact O-NZ 3.09Å
96	T	74.4	Confident	75.8	Confident	3 Å²	3	75 Å²	75	2%	0.018	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-107.3	-14.6	172.6	30.7	0	0	0	0	114	S93 D94 E98 L99 V136 W137 V140	S93-T96 PolarHBondContact O-OG1 2.83Å; D94-T96 PolarHBondContact O-N 2.63Å; D94-T96 VanDerWaalsContact O-N 3.13Å; T96-E98 VanDerWaalsContact C-N 3.25Å; T96-E98 PolarHBondContact O-N 3.17Å; T96-L99 WeakPolarHBondContact O-CB 3.46Å; T96-L99 PolarHBondContact O-N 3.2Å; T96-V136 HydrophobicContact CG2-CG1 3.67Å; T96-W137 HydrophobicContact CG2-CB 4.17Å; T96-V140 HydrophobicContact CG2-CB 4.35Å; T96-V140 HydrophobicContact CG2-CG2 4.17Å
97	R	77.9	Confident	77.4	Confident	158 Å²	158	73.4 Å²	73.4	60%	0.596	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-65.4	-26.6	-174.6	-73.9	175.5	62.8	-147.6	-7.9	113.8	D94 L99 D100	D94-R97 PolarHBondContact O-N 3.21Å; D94-R97 VanDerWaalsContact O-N 3.09Å; D94-R97 WeakPolarHBondContact OD2-CD 3.46Å; D94-R97 IonicContact OD2-CZ 3.56Å; D94-R97 IonicContact OD2-NE 2.76Å; D94-R97 IonicContact OD2-NH1 3.43Å; D94-R97 PolarHBondContact OD2-NH1 3.44Å; R97-L99 PolarHBondContact O-N 2.73Å; R97-D100 PolarHBondContact O-N 3.5Å
98	E	80.6	Confident	78.9	Confident	119 Å²	119	67.4 Å²	67.4	56%	0.556	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-59.2	-26.1	170.8	65.9	-172.7	-156.9	0	0	112.9	T96 K133	T96-E98 VanDerWaalsContact C-N 3.25Å; T96-E98 PolarHBondContact O-N 3.17Å; E98-K133 IonicContact OE1-NZ 3.65Å; E98-K133 PolarHBondContact OE1-NZ 2.93Å
99	L	84.9	Confident	80.1	Confident	4 Å²	4	62.7 Å²	62.7	2%	0.021	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-94.2	-14.9	-178.3	-50.4	179.4	0	0	0	112.7	T96 R97 S101 I102 L105 L129 K133 W137	T96-L99 WeakPolarHBondContact O-CB 3.46Å; T96-L99 PolarHBondContact O-N 3.2Å; R97-L99 PolarHBondContact O-N 2.73Å; L99-S101 PolarHBondContact O-N 2.92Å; L99-S101 VanDerWaalsContact O-N 3.15Å; L99-I102 HydrophobicContact CB-CD1 4.29Å; L99-I102 HydrophobicContact CD2-CD1 3.74Å; L99-I102 WeakPolarHBondContact O-CB 3.31Å; L99-I102 PolarHBondContact O-N 3.46Å; L99-I102 VanDerWaalsContact O-N 3.08Å; L99-L105 HydrophobicContact CB-CD1 4.04Å; L99-L129 HydrophobicContact CD1-CD1 4.48Å; L99-L129 HydrophobicContact CD2-CD1 3.83Å; L99-L129 HydrophobicContact CD2-CD2 3.73Å; L99-L129 HydrophobicContact CD2-CG 4.46Å; L99-K133 HydrophobicContact CD1-CB 4.35Å; L99-K133 HydrophobicContact CD1-CD 4.13Å; L99-W137 VanDerWaalsContact CB-CD1 3.47Å; L99-W137 HydrophobicContact CB-CG 4.1Å; L99-W137 HydrophobicContact CD1-CB 3.93Å; L99-W137 HydrophobicContact CD1-CG 4.21Å
100	D	85.1	Confident	81.3	Confident	52 Å²	52	64.5 Å²	64.5	28%	0.278	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-13.8	174.1	-70.8	36	0	0	0	112	R97 W137 Q141 K144	R97-D100 PolarHBondContact O-N 3.5Å; D100-W137 PolarHBondContact OD1-NE1 2.87Å; D100-Q141 PolarHBondContact OD1-NE2 3.2Å; D100-Q141 PolarHBondContact OD2-NE2 3.28Å; D100-K144 IonicContact OD2-NZ 2.81Å; D100-K144 PolarHBondContact OD2-NZ 3.39Å
101	S	87.1	Confident	82.3	Confident	105 Å²	105	61.1 Å²	61.1	73%	0.734	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-4.5	173.9	-57.1	0	0	0	0	114.6	L99 P103	L99-S101 PolarHBondContact O-N 2.92Å; L99-S101 VanDerWaalsContact O-N 3.15Å; S101-P103 WeakPolarHBondContact O-CD 3.14Å
102	I	89.4	Confident	83.4	Confident	33 Å²	33	61.4 Å²	61.4	17%	0.169	32%	0.322	C	S	.	.			trans	-93.4	109.3	-175.2	-58.9	175.7	0	0	0	109.5	L99 E104 L105 V106 C127 L129	L99-I102 HydrophobicContact CB-CD1 4.29Å; L99-I102 HydrophobicContact CD2-CD1 3.74Å; L99-I102 WeakPolarHBondContact O-CB 3.31Å; L99-I102 PolarHBondContact O-N 3.46Å; L99-I102 VanDerWaalsContact O-N 3.08Å; I102-E104 VanDerWaalsContact C-N 3.29Å; I102-E104 HydrophobicContact CG2-CB 4.48Å; I102-E104 VanDerWaalsContact CG2-OE2 3.26Å; I102-E104 WeakPolarHBondContact CG2-OE2 3.17Å; I102-E104 PolarHBondContact O-N 3.17Å; I102-L105 HydrophobicContact CB-CB 4.44Å; I102-L105 HydrophobicContact CB-CD1 4.1Å; I102-L105 HydrophobicContact CB-CG 4.17Å; I102-L105 HydrophobicContact CD1-CD1 4.13Å; I102-L105 HydrophobicContact CG2-CB 4.43Å; I102-L105 HydrophobicContact CG2-CD1 4.25Å; I102-L105 HydrophobicContact CG2-CG 3.91Å; I102-L105 PolarHBondContact O-N 3.27Å; I102-V106 PolarHBondContact O-N 2.63Å; I102-C127 HydrophobicContact CG2-CB 4.2Å; I102-L129 HydrophobicContact CD1-CD1 3.85Å; I102-L129 HydrophobicContact CD1-CD2 4.43Å; I102-L129 HydrophobicContact CD1-CG 4.49Å
103	P	88.8	Confident	84.5	Confident	84 Å²	84	58.1 Å²	58.1	55%	0.545	31%	0.308	S	S	.	.	H	α-helix	trans	-67.1	-27.7	-170.1	26.2	-33.1	0	0	0	113.2	S101 V106 N107	S101-P103 WeakPolarHBondContact O-CD 3.14Å; P103-V106 PolarHBondContact O-N 3.2Å; P103-N107 WeakPolarHBondContact O-CB 3.4Å; P103-N107 PolarHBondContact O-N 2.8Å
104	E	92.1	Very high	85.8	Confident	85 Å²	85	58 Å²	58	40%	0.397	30%	0.304	S	S	.	.	H	α-helix	trans	-65.6	-41.5	177.7	-62.7	70.8	-154.1	0	0	111.5	I102 A108 L123 V126	I102-E104 VanDerWaalsContact C-N 3.29Å; I102-E104 HydrophobicContact CG2-CB 4.48Å; I102-E104 VanDerWaalsContact CG2-OE2 3.26Å; I102-E104 WeakPolarHBondContact CG2-OE2 3.17Å; I102-E104 PolarHBondContact O-N 3.17Å; E104-A108 VanDerWaalsContact O-CB 3.27Å; E104-A108 WeakPolarHBondContact O-CB 3.42Å; E104-A108 PolarHBondContact O-N 3.36Å; E104-L123 HydrophobicContact CB-CD2 4.41Å; E104-V126 HydrophobicContact CG-CG1 4Å
105	L	91.2	Very high	87.1	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-67.1	-45.1	175.9	-64.9	-175.8	0	0	0	111.1	L99 I102 A108 F109 L123 L129 V134 W137 F138	L99-L105 HydrophobicContact CB-CD1 4.04Å; I102-L105 HydrophobicContact CB-CB 4.44Å; I102-L105 HydrophobicContact CB-CD1 4.1Å; I102-L105 HydrophobicContact CB-CG 4.17Å; I102-L105 HydrophobicContact CD1-CD1 4.13Å; I102-L105 HydrophobicContact CG2-CB 4.43Å; I102-L105 HydrophobicContact CG2-CD1 4.25Å; I102-L105 HydrophobicContact CG2-CG 3.91Å; I102-L105 PolarHBondContact O-N 3.27Å; L105-A108 PolarHBondContact O-N 3.18Å; L105-F109 WeakPolarHBondContact O-CB 3.47Å; L105-F109 PolarHBondContact O-N 2.85Å; L105-L123 HydrophobicContact CD2-CB 4.12Å; L105-L123 HydrophobicContact CD2-CD1 4.47Å; L105-L129 HydrophobicContact CD1-CD1 3.88Å; L105-V134 HydrophobicContact CD2-CG1 3.89Å; L105-V134 HydrophobicContact CD2-CG2 4.42Å; L105-W137 VanDerWaalsContact C-CH2 3.47Å; L105-W137 HydrophobicContact CB-CD2 4.39Å; L105-W137 HydrophobicContact CB-CE3 4.01Å; L105-W137 HydrophobicContact CB-CH2 3.77Å; L105-W137 HydrophobicContact CB-CZ2 4.15Å; L105-W137 HydrophobicContact CB-CZ3 3.69Å; L105-W137 HydrophobicContact CD1-CD2 4.21Å; L105-W137 HydrophobicContact CD1-CE3 4.35Å; L105-W137 HydrophobicContact CD1-CG 4.48Å; L105-W137 WeakPolarHBondContact O-CH2 3.29Å; L105-W137 WeakPolarHBondContact O-CZ3 3.47Å; L105-F138 HydrophobicContact CD2-CE2 4.22Å
106	V	90.3	Very high	88.2	Confident	53 Å²	53	53.3 Å²	53.3	32%	0.321	29%	0.286	S	S	.	.	H	α-helix	trans	-64.3	-42.7	178.2	176.5	0	0	0	0	111.3	I102 P103 F109 N110 W137	I102-V106 PolarHBondContact O-N 2.63Å; P103-V106 PolarHBondContact O-N 3.2Å; V106-F109 PolarHBondContact O-N 2.97Å; V106-N110 WeakPolarHBondContact O-CB 3.41Å; V106-N110 PolarHBondContact O-N 3.29Å; V106-N110 PolarHBondContact O-ND2 3.41Å; V106-W137 HydrophobicContact CG2-CH2 4.22Å; V106-W137 HydrophobicContact CG2-CZ2 4.05Å
107	N	91.3	Very high	88.9	Confident	97 Å²	97	57.7 Å²	57.7	52%	0.519	32%	0.316	S	S	.	.	H	α-helix	trans	-63.7	-47.4	176	-172.8	43.2	0	0	0	111.5	P103 F109 N110 L111	P103-N107 WeakPolarHBondContact O-CB 3.4Å; P103-N107 PolarHBondContact O-N 2.8Å; N107-F109 VanDerWaalsContact C-N 3.31Å; N107-F109 PolarHBondContact O-N 3.3Å; N107-N110 PolarHBondContact O-N 2.92Å; N107-L111 WeakPolarHBondContact O-CG 3.33Å; N107-L111 PolarHBondContact O-N 2.94Å
108	A	91.5	Very high	89.5	Confident	21 Å²	21	58.4 Å²	58.4	17%	0.174	32%	0.324	C	S	.	.	H	α-helix	trans	-62.6	-35.7	176.6	0	0	0	0	0	112.9	E104 L105 L111 F112 L123 F138	E104-A108 VanDerWaalsContact O-CB 3.27Å; E104-A108 WeakPolarHBondContact O-CB 3.42Å; E104-A108 PolarHBondContact O-N 3.36Å; L105-A108 PolarHBondContact O-N 3.18Å; A108-L111 PolarHBondContact O-N 3.4Å; A108-F112 CarbonylContact O-C 3.58Å; A108-F112 PolarHBondContact O-N 2.92Å; A108-L123 HydrophobicContact CB-CD1 3.67Å; A108-L123 HydrophobicContact CB-CD2 3.92Å; A108-L123 HydrophobicContact CB-CG 4.43Å; A108-F138 HydrophobicContact CB-CZ 3.96Å
109	F	92.1	Very high	90.1	Very high	8 Å²	8	56.9 Å²	56.9	4%	0.035	32%	0.317	C	S	.	.	H	α-helix	trans	-65.6	-41.1	173.2	-173.2	-92.8	0	0	0	112.8	L105 V106 N107 L111 F112 P113 W137 F138 Q141 R142 Y145 I147	L105-F109 WeakPolarHBondContact O-CB 3.47Å; L105-F109 PolarHBondContact O-N 2.85Å; V106-F109 PolarHBondContact O-N 2.97Å; N107-F109 VanDerWaalsContact C-N 3.31Å; N107-F109 PolarHBondContact O-N 3.3Å; F109-L111 VanDerWaalsContact C-N 3.33Å; F109-F112 CarbonylContact O-C 3.54Å; F109-P113 HydrophobicContact CD2-CB 4.22Å; F109-P113 HydrophobicContact CE2-CB 3.86Å; F109-P113 HydrophobicContact CE2-CG 4.44Å; F109-P113 HydrophobicContact CZ-CB 4.17Å; F109-P113 HydrophobicContact CZ-CG 4.36Å; F109-P113 WeakPolarHBondContact O-CD 3.45Å; F109-P113 WeakPolarHBondContact O-CG 3.3Å; F109-W137 HydrophobicContact CB-CH2 3.88Å; F109-W137 HydrophobicContact CB-CZ3 3.89Å; F109-W137 HydrophobicContact CD2-CZ3 4.25Å; F109-W137 HydrophobicContact CG-CH2 4.34Å; F109-W137 HydrophobicContact CG-CZ3 4.36Å; F109-F138 HydrophobicContact CB-CE1 4.01Å; F109-F138 HydrophobicContact CB-CZ 4.46Å; F109-F138 AromaticContact CD2-CD1 3.8Å; F109-F138 HydrophobicContact CD2-CD1 3.8Å; F109-F138 AromaticContact CD2-CE1 3.99Å; F109-F138 HydrophobicContact CD2-CE1 3.99Å; F109-Q141 HydrophobicContact CD2-CB 3.86Å; F109-Q141 HydrophobicContact CE1-CB 4.37Å; F109-Q141 HydrophobicContact CE2-CB 3.34Å; F109-Q141 HydrophobicContact CE2-CG 4.43Å; F109-Q141 HydrophobicContact CZ-CB 3.64Å; F109-R142 HydrophobicContact CE2-CG 4.08Å; F109-Y145 AromaticContact CE1-CD2 3.52Å; F109-Y145 HydrophobicContact CE1-CD2 3.52Å; F109-Y145 AromaticContact CE1-CE2 3.8Å; F109-Y145 HydrophobicContact CE1-CE2 3.8Å; F109-Y145 HydrophobicContact CE1-CG 4.4Å; F109-Y145 AromaticContact CZ-CD2 3.62Å; F109-Y145 HydrophobicContact CZ-CD2 3.62Å; F109-Y145 HydrophobicContact CZ-CE2 4.23Å; F109-Y145 HydrophobicContact CZ-CG 4.5Å; F109-I147 HydrophobicContact CE1-CD1 4.11Å; F109-I147 HydrophobicContact CE2-CD1 4.46Å; F109-I147 HydrophobicContact CZ-CD1 3.57Å
110	N	91.4	Very high	90.4	Very high	81 Å²	81	57.3 Å²	57.3	43%	0.433	32%	0.32	S	S	.	.	H	α-helix	trans	-69.3	-30.6	177.6	-69.1	-25.2	0	0	0	112.6	V106 N107	V106-N110 WeakPolarHBondContact O-CB 3.41Å; V106-N110 PolarHBondContact O-N 3.29Å; V106-N110 PolarHBondContact O-ND2 3.41Å; N107-N110 PolarHBondContact O-N 2.92Å
111	L	90.4	Very high	90.8	Very high	107 Å²	107	56.6 Å²	56.6	56%	0.56	32%	0.319	S	S	*	.	H	α-helix	trans	-71.5	-53.8	170.6	-70.6	169.5	0	0	0	111.2	N107 A108 F109	N107-L111 WeakPolarHBondContact O-CG 3.33Å; N107-L111 PolarHBondContact O-N 2.94Å; A108-L111 PolarHBondContact O-N 3.4Å; F109-L111 VanDerWaalsContact C-N 3.33Å
112	F	90.1	Very high	91.1	Very high	13 Å²	13	54.1 Å²	54.1	6%	0.057	30%	0.299	C	S	.	.			trans	-154.8	111.6	179.1	-159.4	-124.4	0	0	0	113.3	A108 F109 Y114 W149 I154 T157 R158 L161	A108-F112 CarbonylContact O-C 3.58Å; A108-F112 PolarHBondContact O-N 2.92Å; F109-F112 CarbonylContact O-C 3.54Å; F112-Y114 VanDerWaalsContact CD1-O 3.23Å; F112-Y114 WeakPolarHBondContact CD1-O 3.31Å; F112-Y114 WeakPolarHBondContact CE1-O 3.15Å; F112-Y114 PolarHBondContact O-N 3.17Å; F112-W149 HydrophobicContact CE2-CH2 4.22Å; F112-W149 AromaticContact CE2-CZ3 3.71Å; F112-W149 HydrophobicContact CE2-CZ3 3.71Å; F112-W149 HydrophobicContact CZ-CZ3 4.31Å; F112-I154 HydrophobicContact CE1-CG2 4.18Å; F112-I154 HydrophobicContact CZ-CG2 3.98Å; F112-T157 HydrophobicContact CD2-CG2 4.14Å; F112-T157 HydrophobicContact CE2-CG2 3.56Å; F112-T157 HydrophobicContact CZ-CG2 4.47Å; F112-R158 HydrophobicContact CD1-CG 4.44Å; F112-R158 HydrophobicContact CE1-CG 3.6Å; F112-R158 HydrophobicContact CZ-CG 3.86Å; F112-L161 HydrophobicContact CB-CD1 4.32Å; F112-L161 HydrophobicContact CD2-CD1 3.75Å; F112-L161 HydrophobicContact CE2-CD1 4.34Å; F112-L161 HydrophobicContact CG-CD1 4.14Å
113	P	91.1	Very high	91.3	Very high	19 Å²	19	53.7 Å²	53.7	12%	0.123	30%	0.297	C	S	.	.	S	Bend	trans	-63.7	-7	179.1	-25.7	35	0	0	0	116	F109 P115 R142 I147	F109-P113 HydrophobicContact CD2-CB 4.22Å; F109-P113 HydrophobicContact CE2-CB 3.86Å; F109-P113 HydrophobicContact CE2-CG 4.44Å; F109-P113 HydrophobicContact CZ-CB 4.17Å; F109-P113 HydrophobicContact CZ-CG 4.36Å; F109-P113 WeakPolarHBondContact O-CD 3.45Å; F109-P113 WeakPolarHBondContact O-CG 3.3Å; P113-P115 WeakPolarHBondContact O-CD 3.36Å; P113-R142 HydrophobicContact CB-CG 3.99Å; P113-R142 WeakPolarHBondContact O-CD 3.19Å; P113-I147 HydrophobicContact CB-CD1 3.96Å; P113-I147 HydrophobicContact CG-CD1 3.8Å
114	Y	91.4	Very high	91.5	Very high	21 Å²	21	50.1 Å²	50.1	8%	0.082	28%	0.275	C	S	.	.	S	Bend	trans	-121.5	60	-176.1	-66.6	-99.1	0	0	0	112.1	F112 R142 I147 W149 I154 R158	F112-Y114 VanDerWaalsContact CD1-O 3.23Å; F112-Y114 WeakPolarHBondContact CD1-O 3.31Å; F112-Y114 WeakPolarHBondContact CE1-O 3.15Å; F112-Y114 PolarHBondContact O-N 3.17Å; Y114-R142 VanDerWaalsContact CE1-NH2 3.25Å; Y114-R142 VanDerWaalsContact CZ-CZ 3.47Å; Y114-R142 PolarHBondContact OH-NE 3.33Å; Y114-R142 PolarHBondContact OH-NH2 3.32Å; Y114-I147 HydrophobicContact CE2-CG2 3.8Å; Y114-I147 PolarHBondContact OH-O 3.07Å; Y114-W149 HydrophobicContact CD2-CD2 4.45Å; Y114-W149 HydrophobicContact CD2-CE3 4.31Å; Y114-W149 HydrophobicContact CE2-CB 3.93Å; Y114-W149 AromaticContact CE2-CD2 3.87Å; Y114-W149 HydrophobicContact CE2-CD2 3.87Å; Y114-W149 HydrophobicContact CE2-CE3 4.16Å; Y114-W149 AromaticContact CE2-CG 3.78Å; Y114-W149 HydrophobicContact CE2-CG 3.78Å; Y114-W149 WeakPolarHBondContact OH-CB 3.43Å; Y114-W149 PolarHBondContact OH-N 3.47Å; Y114-I154 HydrophobicContact CD1-CD1 3.37Å; Y114-I154 HydrophobicContact CD1-CG1 3.76Å; Y114-I154 HydrophobicContact CD1-CG2 4.43Å; Y114-I154 HydrophobicContact CD2-CG1 4.09Å; Y114-I154 HydrophobicContact CE1-CD1 3.3Å; Y114-I154 HydrophobicContact CE1-CG1 3.87Å; Y114-I154 HydrophobicContact CE2-CG1 4.23Å; Y114-I154 HydrophobicContact CG-CD1 4.03Å; Y114-I154 HydrophobicContact CG-CG1 3.87Å; Y114-I154 HydrophobicContact CG-CG2 4.24Å; Y114-R158 PolarHBondContact O-NH2 3.15Å
115	P	91.1	Very high	91.6	Very high	24 Å²	24	53.8 Å²	53.8	16%	0.156	29%	0.285	C	S	.	.			trans	-60.6	148	-177	29.2	-38.6	0	0	0	112.3	P113 E119 V120 F138	P113-P115 WeakPolarHBondContact O-CD 3.36Å; P115-E119 HydrophobicContact CB-CB 4Å; P115-V120 HydrophobicContact CB-CG2 3.8Å; P115-V120 HydrophobicContact CG-CG2 3.54Å; P115-F138 HydrophobicContact CB-CE1 4.43Å; P115-F138 HydrophobicContact CG-CD1 3.57Å; P115-F138 HydrophobicContact CG-CD2 4.11Å; P115-F138 HydrophobicContact CG-CE1 3.6Å; P115-F138 HydrophobicContact CG-CE2 4.15Å; P115-F138 HydrophobicContact CG-CG 3.84Å; P115-F138 HydrophobicContact CG-CZ 3.91Å
116	S	89.9	Confident	91.6	Very high	33 Å²	33	58.1 Å²	58.1	23%	0.231	31%	0.311	C	S	.	.			trans	-73.2	166	172.9	70.4	0	0	0	0	112	K118 E119 V120	S116-K118 PolarHBondContact O-N 3.5Å; S116-E119 WeakPolarHBondContact CA-OE2 3.26Å; S116-E119 WeakPolarHBondContact CB-OE2 3.46Å; S116-E119 PolarHBondContact N-OE2 3.38Å; S116-E119 PolarHBondContact O-N 3Å; S116-E119 VanDerWaalsContact O-N 3.15Å; S116-E119 WeakPolarHBondContact OG-CG 3.36Å; S116-E119 PolarHBondContact OG-N 3.4Å; S116-E119 PolarHBondContact OG-OE2 2.92Å; S116-V120 WeakPolarHBondContact O-CG2 3.15Å; S116-V120 PolarHBondContact O-N 2.94Å
117	S	88.8	Confident	91.6	Very high	94 Å²	94	56.7 Å²	56.7	66%	0.657	30%	0.303	S	S	*	.	H	α-helix	trans	-57.4	-34.7	175.5	-165.1	0	0	0	0	112.6	S121	S117-S121 WeakPolarHBondContact O-CB 3.35Å; S117-S121 PolarHBondContact O-N 2.96Å; S117-S121 PolarHBondContact O-OG 2.98Å
118	K	90.9	Very high	91.7	Very high	173 Å²	173	58.3 Å²	58.3	75%	0.752	32%	0.316	S	S	*	.	H	α-helix	trans	-67.5	-42.4	176.8	-172.8	178.5	179.5	-178	0	112	S116 T122	S116-K118 PolarHBondContact O-N 3.5Å; K118-T122 WeakPolarHBondContact O-CB 3.33Å; K118-T122 PolarHBondContact O-N 3.26Å; K118-T122 PolarHBondContact O-OG1 3.21Å
119	E	92.3	Very high	91.6	Very high	88 Å²	88	59 Å²	59	41%	0.411	32%	0.317	S	S	.	.	H	α-helix	trans	-68.9	-48.7	176.9	-69.7	158.7	113.9	0	0	111.3	P115 S116 S121 T122 L123	P115-E119 HydrophobicContact CB-CB 4Å; S116-E119 WeakPolarHBondContact CA-OE2 3.26Å; S116-E119 WeakPolarHBondContact CB-OE2 3.46Å; S116-E119 PolarHBondContact N-OE2 3.38Å; S116-E119 PolarHBondContact O-N 3Å; S116-E119 VanDerWaalsContact O-N 3.15Å; S116-E119 WeakPolarHBondContact OG-CG 3.36Å; S116-E119 PolarHBondContact OG-N 3.4Å; S116-E119 PolarHBondContact OG-OE2 2.92Å; E119-S121 VanDerWaalsContact C-N 3.29Å; E119-S121 PolarHBondContact O-N 3.29Å; E119-T122 PolarHBondContact O-N 3.14Å; E119-L123 WeakPolarHBondContact O-CG 3.22Å; E119-L123 PolarHBondContact O-N 2.9Å
120	V	92.9	Very high	91.5	Very high	13 Å²	13	62.7 Å²	62.7	8%	0.079	34%	0.342	C	S	.	.	H	α-helix	trans	-57.3	-42.3	175.4	176.3	0	0	0	0	111.2	P115 S116 T122 A124 L131 V134 K135	P115-V120 HydrophobicContact CB-CG2 3.8Å; P115-V120 HydrophobicContact CG-CG2 3.54Å; S116-V120 WeakPolarHBondContact O-CG2 3.15Å; S116-V120 PolarHBondContact O-N 2.94Å; V120-T122 VanDerWaalsContact C-N 3.31Å; V120-T122 PolarHBondContact O-N 2.84Å; V120-A124 VanDerWaalsContact O-CB 3.3Å; V120-A124 WeakPolarHBondContact O-CB 3.44Å; V120-A124 PolarHBondContact O-N 3.4Å; V120-L131 HydrophobicContact CG1-CD1 3.84Å; V120-L131 HydrophobicContact CG1-CG 4.35Å; V120-V134 HydrophobicContact CG1-CB 4.17Å; V120-V134 HydrophobicContact CG1-CG1 3.94Å; V120-K135 HydrophobicContact CG1-CG 3.88Å
121	S	92.3	Very high	91.3	Very high	36 Å²	36	61.8 Å²	61.8	25%	0.252	34%	0.336	S	S	.	.	H	α-helix	trans	-65.7	-32.9	176.4	-60.4	0	0	0	0	112.9	S117 E119 R125	S117-S121 WeakPolarHBondContact O-CB 3.35Å; S117-S121 PolarHBondContact O-N 2.96Å; S117-S121 PolarHBondContact O-OG 2.98Å; E119-S121 VanDerWaalsContact C-N 3.29Å; E119-S121 PolarHBondContact O-N 3.29Å; S121-R125 VanDerWaalsContact C-NH1 3.34Å; S121-R125 WeakPolarHBondContact O-CG 3.49Å; S121-R125 PolarHBondContact O-N 3.12Å; S121-R125 PolarHBondContact O-NH1 3.15Å
122	T	93.8	Very high	91.1	Very high	54 Å²	54	59.2 Å²	59.2	33%	0.331	32%	0.323	S	S	.	.	H	α-helix	trans	-76.6	-44	178	-59.9	0	0	0	0	111	K118 E119 V120 A124 R125 V126	K118-T122 WeakPolarHBondContact O-CB 3.33Å; K118-T122 PolarHBondContact O-N 3.26Å; K118-T122 PolarHBondContact O-OG1 3.21Å; E119-T122 PolarHBondContact O-N 3.14Å; V120-T122 VanDerWaalsContact C-N 3.31Å; V120-T122 PolarHBondContact O-N 2.84Å; T122-A124 VanDerWaalsContact C-N 3.3Å; T122-A124 PolarHBondContact O-N 3.38Å; T122-R125 PolarHBondContact O-N 2.84Å; T122-R125 VanDerWaalsContact O-N 3.15Å; T122-R125 PolarHBondContact OG1-NH2 3.27Å; T122-V126 HydrophobicContact CG2-CG2 4.33Å; T122-V126 WeakPolarHBondContact O-CG2 3.4Å; T122-V126 PolarHBondContact O-N 2.97Å
123	L	93.6	Very high	91	Very high	23 Å²	23	61.2 Å²	61.2	12%	0.12	33%	0.332	C	S	.	.	H	α-helix	trans	-58.6	-40.9	171.9	-69.2	167.9	0	0	0	111.8	E104 L105 A108 E119 R125 V126 C127 V134 F138	E104-L123 HydrophobicContact CB-CD2 4.41Å; L105-L123 HydrophobicContact CD2-CB 4.12Å; L105-L123 HydrophobicContact CD2-CD1 4.47Å; A108-L123 HydrophobicContact CB-CD1 3.67Å; A108-L123 HydrophobicContact CB-CD2 3.92Å; A108-L123 HydrophobicContact CB-CG 4.43Å; E119-L123 WeakPolarHBondContact O-CG 3.22Å; E119-L123 PolarHBondContact O-N 2.9Å; L123-R125 PolarHBondContact O-N 2.95Å; L123-V126 PolarHBondContact O-N 3.09Å; L123-C127 VanDerWaalsContact O-CB 3.27Å; L123-C127 WeakPolarHBondContact O-CB 3.49Å; L123-C127 PolarHBondContact O-N 2.95Å; L123-C127 PolarHBondContact O-SG 3.16Å; L123-V134 HydrophobicContact CB-CG1 4.2Å; L123-F138 HydrophobicContact CD1-CE2 3.84Å; L123-F138 HydrophobicContact CD1-CZ 3.91Å
124	A	94.1	Very high	90.9	Very high	9 Å²	9	60.3 Å²	60.3	7%	0.074	33%	0.326	C	S	.	.	H	α-helix	trans	-59.3	-42.1	174.6	0	0	0	0	0	112.8	V120 T122 V128 L129 L131 V134	V120-A124 VanDerWaalsContact O-CB 3.3Å; V120-A124 WeakPolarHBondContact O-CB 3.44Å; V120-A124 PolarHBondContact O-N 3.4Å; T122-A124 VanDerWaalsContact C-N 3.3Å; T122-A124 PolarHBondContact O-N 3.38Å; A124-V128 PolarHBondContact O-N 3.37Å; A124-L129 WeakPolarHBondContact CB-O 3.43Å; A124-L129 PolarHBondContact O-N 2.9Å; A124-L131 HydrophobicContact CB-CD1 4Å; A124-V134 HydrophobicContact CB-CG2 4.03Å
125	R	93.5	Very high	90.8	Very high	162 Å²	162	61.7 Å²	61.7	61%	0.611	33%	0.333	S	S	*	.	H	α-helix	trans	-68.8	-46.6	174.7	-66.9	-171.6	-49.9	-79.1	-1.9	112.3	S121 T122 L123 V128	S121-R125 VanDerWaalsContact C-NH1 3.34Å; S121-R125 WeakPolarHBondContact O-CG 3.49Å; S121-R125 PolarHBondContact O-N 3.12Å; S121-R125 PolarHBondContact O-NH1 3.15Å; T122-R125 PolarHBondContact O-N 2.84Å; T122-R125 VanDerWaalsContact O-N 3.15Å; T122-R125 PolarHBondContact OG1-NH2 3.27Å; L123-R125 PolarHBondContact O-N 2.95Å; R125-V128 PolarHBondContact O-N 2.74Å
126	V	91.4	Very high	90.7	Very high	92 Å²	92	61.3 Å²	61.3	56%	0.558	33%	0.33	S	S	*	.	H	α-helix	trans	-64.7	-42.5	-177.4	171.6	0	0	0	0	111.8	E104 T122 L123 V128	E104-V126 HydrophobicContact CG-CG1 4Å; T122-V126 HydrophobicContact CG2-CG2 4.33Å; T122-V126 WeakPolarHBondContact O-CG2 3.4Å; T122-V126 PolarHBondContact O-N 2.97Å; L123-V126 PolarHBondContact O-N 3.09Å; V126-V128 VanDerWaalsContact C-N 3.28Å; V126-V128 PolarHBondContact O-N 3.34Å
127	C	90.8	Very high	90.7	Very high	22 Å²	22	59.9 Å²	59.9	15%	0.149	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-3.5	179.4	-51.8	0	0	0	0	113.1	I102 L123 L129	I102-C127 HydrophobicContact CG2-CB 4.2Å; L123-C127 VanDerWaalsContact O-CB 3.27Å; L123-C127 WeakPolarHBondContact O-CB 3.49Å; L123-C127 PolarHBondContact O-N 2.95Å; L123-C127 PolarHBondContact O-SG 3.16Å; C127-L129 VanDerWaalsContact C-N 3.33Å; C127-L129 HydrophobicContact CB-CB 4.41Å; C127-L129 HydrophobicContact CB-CD1 3.64Å; C127-L129 HydrophobicContact CB-CG 3.72Å; C127-L129 PolarHBondContact O-N 3.35Å
128	V	92.3	Very high	90.9	Very high	131 Å²	131	55.7 Å²	55.7	79%	0.794	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	45.6	-172.8	-159.8	0	0	0	0	112.4	A124 R125 V126	A124-V128 PolarHBondContact O-N 3.37Å; R125-V128 PolarHBondContact O-N 2.74Å; V126-V128 VanDerWaalsContact C-N 3.28Å; V126-V128 PolarHBondContact O-N 3.34Å
129	L	89.8	Confident	90.8	Very high	36 Å²	36	49.2 Å²	49.2	19%	0.188	26%	0.262	C	S	.	.			trans	-114.9	149.9	-176.4	-66.3	176.3	0	0	0	112.7	L99 I102 L105 A124 C127 L131 V134	L99-L129 HydrophobicContact CD1-CD1 4.48Å; L99-L129 HydrophobicContact CD2-CD1 3.83Å; L99-L129 HydrophobicContact CD2-CD2 3.73Å; L99-L129 HydrophobicContact CD2-CG 4.46Å; I102-L129 HydrophobicContact CD1-CD1 3.85Å; I102-L129 HydrophobicContact CD1-CD2 4.43Å; I102-L129 HydrophobicContact CD1-CG 4.49Å; L105-L129 HydrophobicContact CD1-CD1 3.88Å; A124-L129 WeakPolarHBondContact CB-O 3.43Å; A124-L129 PolarHBondContact O-N 2.9Å; C127-L129 VanDerWaalsContact C-N 3.33Å; C127-L129 HydrophobicContact CB-CB 4.41Å; C127-L129 HydrophobicContact CB-CD1 3.64Å; C127-L129 HydrophobicContact CB-CG 3.72Å; C127-L129 PolarHBondContact O-N 3.35Å; L129-L131 PolarHBondContact O-N 3.36Å; L129-V134 HydrophobicContact CB-CG2 3.87Å; L129-V134 HydrophobicContact CD1-CG2 3.91Å
130	P	88.9	Confident	90.6	Very high	86 Å²	86	45.5 Å²	45.5	56%	0.558	25%	0.245	S	C	*	.			trans	-57	136.6	164.7	-23	33.7	0	0	0	111.6	D132 K133 V134	P130-D132 PolarHBondContact O-N 2.98Å; P130-D132 VanDerWaalsContact O-N 3.16Å; P130-K133 HydrophobicContact CB-CB 4.32Å; P130-K133 HydrophobicContact CB-CG 4.38Å; P130-K133 HydrophobicContact CG-CG 4.35Å; P130-K133 WeakPolarHBondContact O-CB 3.45Å; P130-K133 PolarHBondContact O-N 2.91Å; P130-V134 PolarHBondContact O-N 2.89Å
131	L	87.6	Confident	90.4	Very high	61 Å²	61	45 Å²	45	32%	0.319	24%	0.242	S	C	.	.	H	α-helix	trans	-51.1	-43.8	-178.9	-169.7	76.9	0	0	0	112.6	V120 A124 L129 K133 V134 K135	V120-L131 HydrophobicContact CG1-CD1 3.84Å; V120-L131 HydrophobicContact CG1-CG 4.35Å; A124-L131 HydrophobicContact CB-CD1 4Å; L129-L131 PolarHBondContact O-N 3.36Å; L131-K133 VanDerWaalsContact C-N 3.34Å; L131-K133 PolarHBondContact O-N 3.39Å; L131-V134 PolarHBondContact O-N 3.2Å; L131-K135 WeakPolarHBondContact O-CG 3.31Å; L131-K135 PolarHBondContact O-N 3.43Å
132	D	86.3	Confident	90.4	Very high	53 Å²	53	46.9 Å²	46.9	28%	0.283	24%	0.244	S	C	.	.	H	α-helix	trans	-69.9	-27.7	-179.2	-77.2	9.8	0	0	0	112.9	V82 S83 P130 K135 V136	V82-D132 HydrophobicContact CG1-CB 4.04Å; S83-D132 WeakPolarHBondContact CB-OD2 3.28Å; S83-D132 PolarHBondContact OG-OD2 2.67Å; P130-D132 PolarHBondContact O-N 2.98Å; P130-D132 VanDerWaalsContact O-N 3.16Å; D132-K135 WeakPolarHBondContact OD1-CE 3.08Å; D132-K135 IonicContact OD1-NZ 3.75Å; D132-K135 PolarHBondContact OD1-NZ 2.8Å; D132-V136 WeakPolarHBondContact O-CB 3.4Å; D132-V136 WeakPolarHBondContact O-CG2 3.21Å; D132-V136 PolarHBondContact O-N 2.92Å
133	K	87.6	Confident	90.1	Very high	56 Å²	56	49 Å²	49	24%	0.243	25%	0.252	C	S	.	.	H	α-helix	trans	-64.7	-42.2	171.3	-89.1	-88.7	-176.1	167.1	0	110.9	Q95 E98 L99 P130 L131 V136 W137	Q95-K133 PolarHBondContact O-NZ 2.92Å; Q95-K133 VanDerWaalsContact O-NZ 3.09Å; E98-K133 IonicContact OE1-NZ 3.65Å; E98-K133 PolarHBondContact OE1-NZ 2.93Å; L99-K133 HydrophobicContact CD1-CB 4.35Å; L99-K133 HydrophobicContact CD1-CD 4.13Å; P130-K133 HydrophobicContact CB-CB 4.32Å; P130-K133 HydrophobicContact CB-CG 4.38Å; P130-K133 HydrophobicContact CG-CG 4.35Å; P130-K133 WeakPolarHBondContact O-CB 3.45Å; P130-K133 PolarHBondContact O-N 2.91Å; L131-K133 VanDerWaalsContact C-N 3.34Å; L131-K133 PolarHBondContact O-N 3.39Å; K133-V136 PolarHBondContact O-N 2.91Å; K133-W137 WeakPolarHBondContact O-CB 3.13Å; K133-W137 PolarHBondContact O-N 2.82Å
134	V	89.8	Confident	89.4	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-65.2	-48.1	175.8	-177.3	0	0	0	0	111	L105 V120 L123 A124 L129 P130 L131 V136 W137 F138	L105-V134 HydrophobicContact CD2-CG1 3.89Å; L105-V134 HydrophobicContact CD2-CG2 4.42Å; V120-V134 HydrophobicContact CG1-CB 4.17Å; V120-V134 HydrophobicContact CG1-CG1 3.94Å; L123-V134 HydrophobicContact CB-CG1 4.2Å; A124-V134 HydrophobicContact CB-CG2 4.03Å; L129-V134 HydrophobicContact CB-CG2 3.87Å; L129-V134 HydrophobicContact CD1-CG2 3.91Å; P130-V134 PolarHBondContact O-N 2.89Å; L131-V134 PolarHBondContact O-N 3.2Å; V134-V136 VanDerWaalsContact C-N 3.35Å; V134-V136 PolarHBondContact O-N 3.29Å; V134-W137 PolarHBondContact O-N 2.95Å; V134-F138 HydrophobicContact CG1-CD2 3.98Å; V134-F138 HydrophobicContact CG1-CE2 4.01Å; V134-F138 WeakPolarHBondContact O-CD2 3.4Å; V134-F138 PolarHBondContact O-N 3.1Å; V134-F138 VanDerWaalsContact O-N 3.08Å
135	K	89.4	Confident	88.9	Confident	50 Å²	50	56.5 Å²	56.5	22%	0.217	28%	0.28	C	S	.	.	H	α-helix	trans	-54.6	-50.1	174.8	-66.4	175.5	-169.7	161.1	0	111.7	V82 V120 L131 D132 W137 F138 M139	V82-K135 VanDerWaalsContact O-CD 3.29Å; V82-K135 WeakPolarHBondContact O-CD 3.35Å; V82-K135 PolarHBondContact O-NZ 3Å; V82-K135 VanDerWaalsContact O-NZ 3.11Å; V120-K135 HydrophobicContact CG1-CG 3.88Å; L131-K135 WeakPolarHBondContact O-CG 3.31Å; L131-K135 PolarHBondContact O-N 3.43Å; D132-K135 WeakPolarHBondContact OD1-CE 3.08Å; D132-K135 IonicContact OD1-NZ 3.75Å; D132-K135 PolarHBondContact OD1-NZ 2.8Å; K135-W137 VanDerWaalsContact C-N 3.33Å; K135-W137 PolarHBondContact O-N 3.27Å; K135-F138 PolarHBondContact O-N 3.4Å; K135-M139 HydrophobicContact CB-CE 4.19Å; K135-M139 WeakPolarHBondContact O-CE 3.45Å; K135-M139 WeakPolarHBondContact O-CG 3.42Å; K135-M139 PolarHBondContact O-N 3.01Å
136	V	88.9	Confident	88.6	Confident	15 Å²	15	51.6 Å²	51.6	9%	0.091	28%	0.28	C	S	.	.	H	α-helix	trans	-57.4	-45.8	179.3	159.7	0	0	0	0	110.9	L79 V82 T91 T96 D132 K133 V134 M139 V140	L79-V136 HydrophobicContact CD1-CB 4.15Å; L79-V136 HydrophobicContact CD1-CG1 3.73Å; L79-V136 HydrophobicContact CD1-CG2 3.92Å; V82-V136 HydrophobicContact CG1-CG2 3.59Å; V82-V136 HydrophobicContact CG2-CG2 4.13Å; T91-V136 HydrophobicContact CG2-CG1 3.81Å; T96-V136 HydrophobicContact CG2-CG1 3.67Å; D132-V136 WeakPolarHBondContact O-CB 3.4Å; D132-V136 WeakPolarHBondContact O-CG2 3.21Å; D132-V136 PolarHBondContact O-N 2.92Å; K133-V136 PolarHBondContact O-N 2.91Å; V134-V136 VanDerWaalsContact C-N 3.35Å; V134-V136 PolarHBondContact O-N 3.29Å; V136-M139 HydrophobicContact CG2-CE 4.48Å; V136-M139 PolarHBondContact O-N 3.21Å; V136-V140 HydrophobicContact CG1-CG2 4.43Å; V136-V140 WeakPolarHBondContact O-CG2 3.38Å; V136-V140 PolarHBondContact O-N 2.81Å
137	W	90.6	Very high	88.5	Confident	3 Å²	3	48.6 Å²	48.6	1%	0.011	26%	0.26	C	S	.	.	H	α-helix	trans	-60.2	-50.7	178.3	-174	83.5	0	0	0	112.6	T96 L99 D100 L105 V106 F109 K133 V134 K135 M139 V140 Q141	T96-W137 HydrophobicContact CG2-CB 4.17Å; L99-W137 VanDerWaalsContact CB-CD1 3.47Å; L99-W137 HydrophobicContact CB-CG 4.1Å; L99-W137 HydrophobicContact CD1-CB 3.93Å; L99-W137 HydrophobicContact CD1-CG 4.21Å; D100-W137 PolarHBondContact OD1-NE1 2.87Å; L105-W137 VanDerWaalsContact C-CH2 3.47Å; L105-W137 HydrophobicContact CB-CD2 4.39Å; L105-W137 HydrophobicContact CB-CE3 4.01Å; L105-W137 HydrophobicContact CB-CH2 3.77Å; L105-W137 HydrophobicContact CB-CZ2 4.15Å; L105-W137 HydrophobicContact CB-CZ3 3.69Å; L105-W137 HydrophobicContact CD1-CD2 4.21Å; L105-W137 HydrophobicContact CD1-CE3 4.35Å; L105-W137 HydrophobicContact CD1-CG 4.48Å; L105-W137 WeakPolarHBondContact O-CH2 3.29Å; L105-W137 WeakPolarHBondContact O-CZ3 3.47Å; V106-W137 HydrophobicContact CG2-CH2 4.22Å; V106-W137 HydrophobicContact CG2-CZ2 4.05Å; F109-W137 HydrophobicContact CB-CH2 3.88Å; F109-W137 HydrophobicContact CB-CZ3 3.89Å; F109-W137 HydrophobicContact CD2-CZ3 4.25Å; F109-W137 HydrophobicContact CG-CH2 4.34Å; F109-W137 HydrophobicContact CG-CZ3 4.36Å; K133-W137 WeakPolarHBondContact O-CB 3.13Å; K133-W137 PolarHBondContact O-N 2.82Å; V134-W137 PolarHBondContact O-N 2.95Å; K135-W137 VanDerWaalsContact C-N 3.33Å; K135-W137 PolarHBondContact O-N 3.27Å; W137-M139 VanDerWaalsContact C-N 3.28Å; W137-M139 PolarHBondContact O-N 2.78Å; W137-V140 PolarHBondContact O-N 3.46Å; W137-V140 VanDerWaalsContact O-N 3.15Å; W137-Q141 HydrophobicContact CD2-CG 3.81Å; W137-Q141 HydrophobicContact CE3-CG 4.1Å; W137-Q141 HydrophobicContact CG-CG 4.42Å; W137-Q141 HydrophobicContact CH2-CG 3.9Å; W137-Q141 HydrophobicContact CZ2-CG 3.62Å; W137-Q141 HydrophobicContact CZ3-CG 4.13Å; W137-Q141 WeakPolarHBondContact O-CG 3.29Å; W137-Q141 PolarHBondContact O-N 3.21Å
138	F	91.8	Very high	88.3	Confident	7 Å²	7	52.7 Å²	52.7	3%	0.031	29%	0.289	C	S	.	.	H	α-helix	trans	-58.8	-37.9	176.9	-89.1	-91.5	0	0	0	112.6	L105 A108 F109 P115 L123 V134 K135 R142	L105-F138 HydrophobicContact CD2-CE2 4.22Å; A108-F138 HydrophobicContact CB-CZ 3.96Å; F109-F138 HydrophobicContact CB-CE1 4.01Å; F109-F138 HydrophobicContact CB-CZ 4.46Å; F109-F138 AromaticContact CD2-CD1 3.8Å; F109-F138 HydrophobicContact CD2-CD1 3.8Å; F109-F138 AromaticContact CD2-CE1 3.99Å; F109-F138 HydrophobicContact CD2-CE1 3.99Å; P115-F138 HydrophobicContact CB-CE1 4.43Å; P115-F138 HydrophobicContact CG-CD1 3.57Å; P115-F138 HydrophobicContact CG-CD2 4.11Å; P115-F138 HydrophobicContact CG-CE1 3.6Å; P115-F138 HydrophobicContact CG-CE2 4.15Å; P115-F138 HydrophobicContact CG-CG 3.84Å; P115-F138 HydrophobicContact CG-CZ 3.91Å; L123-F138 HydrophobicContact CD1-CE2 3.84Å; L123-F138 HydrophobicContact CD1-CZ 3.91Å; V134-F138 HydrophobicContact CG1-CD2 3.98Å; V134-F138 HydrophobicContact CG1-CE2 4.01Å; V134-F138 WeakPolarHBondContact O-CD2 3.4Å; V134-F138 PolarHBondContact O-N 3.1Å; V134-F138 VanDerWaalsContact O-N 3.08Å; K135-F138 PolarHBondContact O-N 3.4Å; F138-R142 WeakPolarHBondContact O-CB 3.46Å; F138-R142 WeakPolarHBondContact O-CG 3.03Å; F138-R142 PolarHBondContact O-N 3.29Å
139	M	89.3	Confident	87.9	Confident	36 Å²	36	51 Å²	51	18%	0.177	27%	0.269	C	S	.	.	H	α-helix	trans	-68.2	-42.2	175.4	-69.9	-173.8	-76	0	0	112.7	L79 V82 K135 V136 W137 R142 I143	L79-M139 HydrophobicContact CD2-CB 3.93Å; V82-M139 HydrophobicContact CB-CE 4.35Å; V82-M139 HydrophobicContact CG1-CE 4.26Å; V82-M139 HydrophobicContact CG2-CE 3.87Å; K135-M139 HydrophobicContact CB-CE 4.19Å; K135-M139 WeakPolarHBondContact O-CE 3.45Å; K135-M139 WeakPolarHBondContact O-CG 3.42Å; K135-M139 PolarHBondContact O-N 3.01Å; V136-M139 HydrophobicContact CG2-CE 4.48Å; V136-M139 PolarHBondContact O-N 3.21Å; W137-M139 VanDerWaalsContact C-N 3.28Å; W137-M139 PolarHBondContact O-N 2.78Å; M139-R142 PolarHBondContact O-N 2.96Å; M139-I143 WeakPolarHBondContact O-CG1 3.42Å; M139-I143 PolarHBondContact O-N 3.14Å; M139-I143 VanDerWaalsContact O-N 3.12Å
140	V	88.1	Confident	87.5	Confident	10 Å²	10	51.4 Å²	51.4	6%	0.061	28%	0.275	C	S	.	.	H	α-helix	trans	-66.2	-44	176.7	173.7	0	0	0	0	111.2	L79 T96 V136 W137 R142 I143 K144	L79-V140 HydrophobicContact CD1-CG2 3.92Å; L79-V140 HydrophobicContact CD2-CG2 4.1Å; T96-V140 HydrophobicContact CG2-CB 4.35Å; T96-V140 HydrophobicContact CG2-CG2 4.17Å; V136-V140 HydrophobicContact CG1-CG2 4.43Å; V136-V140 WeakPolarHBondContact O-CG2 3.38Å; V136-V140 PolarHBondContact O-N 2.81Å; W137-V140 PolarHBondContact O-N 3.46Å; W137-V140 VanDerWaalsContact O-N 3.15Å; V140-R142 PolarHBondContact O-N 3.39Å; V140-I143 PolarHBondContact O-N 2.84Å; V140-I143 VanDerWaalsContact O-N 3.17Å; V140-K144 WeakPolarHBondContact O-CB 3.37Å; V140-K144 PolarHBondContact O-N 3.49Å
141	Q	88.8	Confident	87.1	Confident	4 Å²	4	51.8 Å²	51.8	2%	0.019	28%	0.279	C	S	.	.	H	α-helix	trans	-62.3	-43.7	176.6	-64.2	-60	-18.7	0	0	111.5	D100 F109 W137 I143 K144 Y145	D100-Q141 PolarHBondContact OD1-NE2 3.2Å; D100-Q141 PolarHBondContact OD2-NE2 3.28Å; F109-Q141 HydrophobicContact CD2-CB 3.86Å; F109-Q141 HydrophobicContact CE1-CB 4.37Å; F109-Q141 HydrophobicContact CE2-CB 3.34Å; F109-Q141 HydrophobicContact CE2-CG 4.43Å; F109-Q141 HydrophobicContact CZ-CB 3.64Å; W137-Q141 HydrophobicContact CD2-CG 3.81Å; W137-Q141 HydrophobicContact CE3-CG 4.1Å; W137-Q141 HydrophobicContact CG-CG 4.42Å; W137-Q141 HydrophobicContact CH2-CG 3.9Å; W137-Q141 HydrophobicContact CZ2-CG 3.62Å; W137-Q141 HydrophobicContact CZ3-CG 4.13Å; W137-Q141 WeakPolarHBondContact O-CG 3.29Å; W137-Q141 PolarHBondContact O-N 3.21Å; Q141-I143 VanDerWaalsContact C-N 3.26Å; Q141-I143 PolarHBondContact O-N 3Å; Q141-K144 PolarHBondContact O-N 2.93Å; Q141-Y145 HydrophobicContact CB-CD2 4.31Å; Q141-Y145 HydrophobicContact CB-CE2 4.45Å; Q141-Y145 VanDerWaalsContact O-CD2 3.24Å; Q141-Y145 WeakPolarHBondContact O-CD2 3.2Å; Q141-Y145 PolarHBondContact O-N 2.87Å
142	R	91.5	Very high	87.1	Confident	75 Å²	75	53.6 Å²	53.6	28%	0.283	29%	0.286	S	S	.	.	H	α-helix	trans	-57.3	-38.3	174	-82.7	179	50.6	-143.5	-4.2	112.8	F109 P113 Y114 F138 M139 V140 G146 I147	F109-R142 HydrophobicContact CE2-CG 4.08Å; P113-R142 HydrophobicContact CB-CG 3.99Å; P113-R142 WeakPolarHBondContact O-CD 3.19Å; Y114-R142 VanDerWaalsContact CE1-NH2 3.25Å; Y114-R142 VanDerWaalsContact CZ-CZ 3.47Å; Y114-R142 PolarHBondContact OH-NE 3.33Å; Y114-R142 PolarHBondContact OH-NH2 3.32Å; F138-R142 WeakPolarHBondContact O-CB 3.46Å; F138-R142 WeakPolarHBondContact O-CG 3.03Å; F138-R142 PolarHBondContact O-N 3.29Å; M139-R142 PolarHBondContact O-N 2.96Å; V140-R142 PolarHBondContact O-N 3.39Å; R142-G146 PolarHBondContact O-N 2.94Å; R142-G146 VanDerWaalsContact O-N 3.14Å; R142-I147 HydrophobicContact CB-CB 4.34Å; R142-I147 HydrophobicContact CG-CB 4.22Å; R142-I147 PolarHBondContact O-N 3.4Å
143	I	87.3	Confident	87.1	Confident	97 Å²	97	55.6 Å²	55.6	50%	0.497	29%	0.294	S	S	.	.	H	α-helix	trans	-70.2	-46.2	176.1	-68.7	165.7	0	0	0	110.9	V77 L79 M139 V140 Q141 Y145 G146	V77-I143 HydrophobicContact CG1-CD1 3.58Å; V77-I143 HydrophobicContact CG1-CG2 4.49Å; L79-I143 HydrophobicContact CD2-CD1 3.79Å; M139-I143 WeakPolarHBondContact O-CG1 3.42Å; M139-I143 PolarHBondContact O-N 3.14Å; M139-I143 VanDerWaalsContact O-N 3.12Å; V140-I143 PolarHBondContact O-N 2.84Å; V140-I143 VanDerWaalsContact O-N 3.17Å; Q141-I143 VanDerWaalsContact C-N 3.26Å; Q141-I143 PolarHBondContact O-N 3Å; I143-Y145 VanDerWaalsContact C-N 3.34Å; I143-Y145 PolarHBondContact O-N 2.97Å; I143-G146 PolarHBondContact O-N 3.2Å; I143-G146 VanDerWaalsContact O-N 3.11Å
144	K	80.3	Confident	87.2	Confident	101 Å²	101	54.1 Å²	54.1	44%	0.439	29%	0.288	S	S	.	.	H	α-helix	trans	-58.7	-38.9	177.7	171.8	177.1	155.9	-153	0	113	D100 V140 Q141	D100-K144 IonicContact OD2-NZ 2.81Å; D100-K144 PolarHBondContact OD2-NZ 3.39Å; V140-K144 WeakPolarHBondContact O-CB 3.37Å; V140-K144 PolarHBondContact O-N 3.49Å; Q141-K144 PolarHBondContact O-N 2.93Å
145	Y	84.1	Confident	87	Confident	90 Å²	90	58.5 Å²	58.5	35%	0.353	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	6.5	176.3	-66.6	-69	0	0	0	114.1	F109 Q141 I143 I147 L227	F109-Y145 AromaticContact CE1-CD2 3.52Å; F109-Y145 HydrophobicContact CE1-CD2 3.52Å; F109-Y145 AromaticContact CE1-CE2 3.8Å; F109-Y145 HydrophobicContact CE1-CE2 3.8Å; F109-Y145 HydrophobicContact CE1-CG 4.4Å; F109-Y145 AromaticContact CZ-CD2 3.62Å; F109-Y145 HydrophobicContact CZ-CD2 3.62Å; F109-Y145 HydrophobicContact CZ-CE2 4.23Å; F109-Y145 HydrophobicContact CZ-CG 4.5Å; Q141-Y145 HydrophobicContact CB-CD2 4.31Å; Q141-Y145 HydrophobicContact CB-CE2 4.45Å; Q141-Y145 VanDerWaalsContact O-CD2 3.24Å; Q141-Y145 WeakPolarHBondContact O-CD2 3.2Å; Q141-Y145 PolarHBondContact O-N 2.87Å; I143-Y145 VanDerWaalsContact C-N 3.34Å; I143-Y145 PolarHBondContact O-N 2.97Å; Y145-I147 VanDerWaalsContact C-N 3.32Å; Y145-I147 PolarHBondContact O-N 3.1Å; Y145-L227 HydrophobicContact CD1-CD1 4.18Å; Y145-L227 HydrophobicContact CG-CD1 4.34Å
146	G	87.1	Confident	86.8	Confident	59 Å²	59	60.5 Å²	60.5	61%	0.608	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	67	23.7	175.6	0	0	0	0	0	115.7	R142 I143 S148	R142-G146 PolarHBondContact O-N 2.94Å; R142-G146 VanDerWaalsContact O-N 3.14Å; I143-G146 PolarHBondContact O-N 3.2Å; I143-G146 VanDerWaalsContact O-N 3.11Å; G146-S148 PolarHBondContact O-N 2.94Å; G146-S148 VanDerWaalsContact O-N 3.09Å
147	I	87.8	Confident	86.6	Confident	28 Å²	28	61.6 Å²	61.6	14%	0.144	33%	0.326	C	S	.	.			trans	-81.3	91.8	-169.9	-48.8	-176.3	0	0	0	111.4	F109 P113 Y114 R142 Y145 W149	F109-I147 HydrophobicContact CE1-CD1 4.11Å; F109-I147 HydrophobicContact CE2-CD1 4.46Å; F109-I147 HydrophobicContact CZ-CD1 3.57Å; P113-I147 HydrophobicContact CB-CD1 3.96Å; P113-I147 HydrophobicContact CG-CD1 3.8Å; Y114-I147 HydrophobicContact CE2-CG2 3.8Å; Y114-I147 PolarHBondContact OH-O 3.07Å; R142-I147 HydrophobicContact CB-CB 4.34Å; R142-I147 HydrophobicContact CG-CB 4.22Å; R142-I147 PolarHBondContact O-N 3.4Å; Y145-I147 VanDerWaalsContact C-N 3.32Å; Y145-I147 PolarHBondContact O-N 3.1Å; I147-W149 HydrophobicContact CG2-CG 4.44Å
148	S	86.6	Confident	86.3	Confident	108 Å²	108	65.4 Å²	65.4	76%	0.755	34%	0.34	S	S	*	.			trans	-104.7	102.7	170.3	60.8	0	0	0	0	111.4	G146	G146-S148 PolarHBondContact O-N 2.94Å; G146-S148 VanDerWaalsContact O-N 3.09Å
149	W	84.6	Confident	85.8	Confident	97 Å²	97	72.9 Å²	72.9	37%	0.367	37%	0.368	S	S	.	.			trans	-112.8	151	170.7	-65.7	10.7	0	0	0	109.5	F112 Y114 I147 E153 I154 T157	F112-W149 HydrophobicContact CE2-CH2 4.22Å; F112-W149 AromaticContact CE2-CZ3 3.71Å; F112-W149 HydrophobicContact CE2-CZ3 3.71Å; F112-W149 HydrophobicContact CZ-CZ3 4.31Å; Y114-W149 HydrophobicContact CD2-CD2 4.45Å; Y114-W149 HydrophobicContact CD2-CE3 4.31Å; Y114-W149 HydrophobicContact CE2-CB 3.93Å; Y114-W149 AromaticContact CE2-CD2 3.87Å; Y114-W149 HydrophobicContact CE2-CD2 3.87Å; Y114-W149 HydrophobicContact CE2-CE3 4.16Å; Y114-W149 AromaticContact CE2-CG 3.78Å; Y114-W149 HydrophobicContact CE2-CG 3.78Å; Y114-W149 WeakPolarHBondContact OH-CB 3.43Å; Y114-W149 PolarHBondContact OH-N 3.47Å; I147-W149 HydrophobicContact CG2-CG 4.44Å; W149-E153 HydrophobicContact CB-CB 4.34Å; W149-E153 HydrophobicContact CE3-CB 4.36Å; W149-I154 HydrophobicContact CB-CD1 4.32Å; W149-I154 HydrophobicContact CB-CG1 3.89Å; W149-I154 HydrophobicContact CE3-CG1 4.03Å; W149-T157 HydrophobicContact CH2-CG2 4.13Å; W149-T157 HydrophobicContact CZ3-CG2 4.05Å; W149-T157 WeakPolarHBondContact CZ3-OG1 3.37Å
150	S	81.6	Confident	85.3	Confident	44 Å²	44	77.9 Å²	77.9	31%	0.308	39%	0.389	S	S	.	.			trans	-76.2	160.8	169.2	63.2	0	0	0	0	112.1	E152 E153 I154	S150-E152 PolarHBondContact O-N 2.93Å; S150-E153 VanDerWaalsContact CB-OE2 3.25Å; S150-E153 WeakPolarHBondContact CB-OE2 3.32Å; S150-E153 PolarHBondContact N-OE2 2.93Å; S150-E153 PolarHBondContact O-N 2.95Å; S150-E153 VanDerWaalsContact OG-CD 3.27Å; S150-E153 VanDerWaalsContact OG-CG 3.31Å; S150-E153 WeakPolarHBondContact OG-CG 3.29Å; S150-E153 PolarHBondContact OG-N 2.82Å; S150-E153 PolarHBondContact OG-OE2 3.35Å; S150-I154 VanDerWaalsContact O-CD1 3.28Å; S150-I154 WeakPolarHBondContact O-CD1 3.38Å; S150-I154 WeakPolarHBondContact O-CG1 3.47Å; S150-I154 PolarHBondContact O-N 2.93Å; S150-I154 VanDerWaalsContact O-N 3.08Å
151	S	81.2	Confident	84.6	Confident	94 Å²	94	81.2 Å²	81.2	66%	0.657	41%	0.406	S	S	*	.	H	α-helix	trans	-56.9	-37.5	174.3	-56.8	0	0	0	0	111.9	E155	S151-E155 WeakPolarHBondContact O-CB 3.4Å; S151-E155 PolarHBondContact O-N 3.4Å; S151-E155 VanDerWaalsContact O-N 3.12Å
152	E	86.1	Confident	83.8	Confident	98 Å²	98	84.1 Å²	84.1	46%	0.458	43%	0.43	S	S	.	.	H	α-helix	trans	-64	-47	177.1	-68.1	83.8	169	0	0	112.3	S150 E155 E156 R307	S150-E152 PolarHBondContact O-N 2.93Å; E152-E155 PolarHBondContact O-N 2.64Å; E152-E156 WeakPolarHBondContact O-CB 3.2Å; E152-E156 PolarHBondContact O-N 3.36Å; E152-R307 IonicContact OE1-NH1 3.74Å; E152-R307 PolarHBondContact OE1-NH1 3.47Å
153	E	87.7	Confident	81.8	Confident	96 Å²	96	86 Å²	86	45%	0.449	45%	0.45	S	S	.	.	H	α-helix	trans	-65.6	-40	177.4	-71.8	159.1	130.3	0	0	112.3	W149 S150 E155 E156 T157	W149-E153 HydrophobicContact CB-CB 4.34Å; W149-E153 HydrophobicContact CE3-CB 4.36Å; S150-E153 VanDerWaalsContact CB-OE2 3.25Å; S150-E153 WeakPolarHBondContact CB-OE2 3.32Å; S150-E153 PolarHBondContact N-OE2 2.93Å; S150-E153 PolarHBondContact O-N 2.95Å; S150-E153 VanDerWaalsContact OG-CD 3.27Å; S150-E153 VanDerWaalsContact OG-CG 3.31Å; S150-E153 WeakPolarHBondContact OG-CG 3.29Å; S150-E153 PolarHBondContact OG-N 2.82Å; S150-E153 PolarHBondContact OG-OE2 3.35Å; E153-E155 VanDerWaalsContact C-N 3.35Å; E153-E155 PolarHBondContact O-N 2.94Å; E153-E156 PolarHBondContact O-N 3.31Å; E153-T157 PolarHBondContact O-N 3.17Å; E153-T157 PolarHBondContact O-OG1 2.83Å; E153-T157 VanDerWaalsContact O-OG1 3.1Å
154	I	88.6	Confident	80	Confident	25 Å²	25	86.6 Å²	86.6	13%	0.128	46%	0.46	C	S	.	.	H	α-helix	trans	-60.2	-46.5	176.7	-65.3	158.1	0	0	0	110.4	F112 Y114 W149 S150 R158	F112-I154 HydrophobicContact CE1-CG2 4.18Å; F112-I154 HydrophobicContact CZ-CG2 3.98Å; Y114-I154 HydrophobicContact CD1-CD1 3.37Å; Y114-I154 HydrophobicContact CD1-CG1 3.76Å; Y114-I154 HydrophobicContact CD1-CG2 4.43Å; Y114-I154 HydrophobicContact CD2-CG1 4.09Å; Y114-I154 HydrophobicContact CE1-CD1 3.3Å; Y114-I154 HydrophobicContact CE1-CG1 3.87Å; Y114-I154 HydrophobicContact CE2-CG1 4.23Å; Y114-I154 HydrophobicContact CG-CD1 4.03Å; Y114-I154 HydrophobicContact CG-CG1 3.87Å; Y114-I154 HydrophobicContact CG-CG2 4.24Å; W149-I154 HydrophobicContact CB-CD1 4.32Å; W149-I154 HydrophobicContact CB-CG1 3.89Å; W149-I154 HydrophobicContact CE3-CG1 4.03Å; S150-I154 VanDerWaalsContact O-CD1 3.28Å; S150-I154 WeakPolarHBondContact O-CD1 3.38Å; S150-I154 WeakPolarHBondContact O-CG1 3.47Å; S150-I154 PolarHBondContact O-N 2.93Å; S150-I154 VanDerWaalsContact O-N 3.08Å; I154-R158 WeakPolarHBondContact O-CG 3.46Å; I154-R158 PolarHBondContact O-N 2.98Å
155	E	86.8	Confident	78.2	Confident	91 Å²	91	90.6 Å²	90.6	43%	0.425	48%	0.48	S	S	.	.	H	α-helix	trans	-75.1	-34	-177	-171.8	55.1	-151.6	0	0	112.4	S151 E152 E153 R158 R159	S151-E155 WeakPolarHBondContact O-CB 3.4Å; S151-E155 PolarHBondContact O-N 3.4Å; S151-E155 VanDerWaalsContact O-N 3.12Å; E152-E155 PolarHBondContact O-N 2.64Å; E153-E155 VanDerWaalsContact C-N 3.35Å; E153-E155 PolarHBondContact O-N 2.94Å; E155-R158 PolarHBondContact O-N 3.12Å; E155-R159 PolarHBondContact O-N 3.46Å
156	E	83.6	Confident	76.3	Confident	93 Å²	93	93.2 Å²	93.2	44%	0.435	50%	0.5	S	S	.	.	H	α-helix	trans	-63.1	-44.8	170.7	-171.5	-174.8	160.5	0	0	111.6	E152 E153 R159 K160	E152-E156 WeakPolarHBondContact O-CB 3.2Å; E152-E156 PolarHBondContact O-N 3.36Å; E153-E156 PolarHBondContact O-N 3.31Å; E156-R159 PolarHBondContact O-N 2.97Å; E156-K160 WeakPolarHBondContact O-CG 3.5Å; E156-K160 PolarHBondContact O-N 2.88Å; E156-K160 VanDerWaalsContact O-N 3.1Å; E156-K160 VanDerWaalsContact OE1-CE 3.26Å; E156-K160 WeakPolarHBondContact OE1-CE 3.37Å; E156-K160 IonicContact OE1-NZ 2.71Å; E156-K160 PolarHBondContact OE1-NZ 2.94Å
157	T	85.4	Confident	73.5	Confident	38 Å²	38	96.5 Å²	96.5	23%	0.233	51%	0.512	C	S	.	.	H	α-helix	trans	-68.9	-37.3	177.4	-56.7	0	0	0	0	112.1	F112 W149 E153 R159 K160 L161	F112-T157 HydrophobicContact CD2-CG2 4.14Å; F112-T157 HydrophobicContact CE2-CG2 3.56Å; F112-T157 HydrophobicContact CZ-CG2 4.47Å; W149-T157 HydrophobicContact CH2-CG2 4.13Å; W149-T157 HydrophobicContact CZ3-CG2 4.05Å; W149-T157 WeakPolarHBondContact CZ3-OG1 3.37Å; E153-T157 PolarHBondContact O-N 3.17Å; E153-T157 PolarHBondContact O-OG1 2.83Å; E153-T157 VanDerWaalsContact O-OG1 3.1Å; T157-R159 VanDerWaalsContact C-N 3.3Å; T157-R159 PolarHBondContact O-N 3.35Å; T157-K160 PolarHBondContact O-N 2.96Å; T157-K160 VanDerWaalsContact O-N 3.08Å; T157-L161 HydrophobicContact CG2-CD1 4Å; T157-L161 HydrophobicContact CG2-CG 4.27Å; T157-L161 WeakPolarHBondContact O-CG 3.37Å; T157-L161 PolarHBondContact O-N 2.96Å
158	R	83.5	Confident	71.1	Confident	82 Å²	82	103.6 Å²	103.6	31%	0.309	54%	0.544	S	S	.	.	H	α-helix	trans	-57.4	-43	170.2	-80.6	-177.2	175.6	166.4	3.5	112.1	F112 Y114 I154 E155 K160 L161 A162	F112-R158 HydrophobicContact CD1-CG 4.44Å; F112-R158 HydrophobicContact CE1-CG 3.6Å; F112-R158 HydrophobicContact CZ-CG 3.86Å; Y114-R158 PolarHBondContact O-NH2 3.15Å; I154-R158 WeakPolarHBondContact O-CG 3.46Å; I154-R158 PolarHBondContact O-N 2.98Å; E155-R158 PolarHBondContact O-N 3.12Å; R158-K160 PolarHBondContact O-N 3.2Å; R158-L161 PolarHBondContact O-N 3.31Å; R158-A162 WeakPolarHBondContact O-CB 3.46Å; R158-A162 PolarHBondContact O-N 3.29Å
159	R	83.1	Confident	68.4	Low	164 Å²	164	105.3 Å²	105.3	62%	0.619	55%	0.545	S	S	*	.	H	α-helix	trans	-65.9	-24.4	176.1	-162.6	178.8	-55.5	120.1	16	113.6	E155 E156 T157	E155-R159 PolarHBondContact O-N 3.46Å; E156-R159 PolarHBondContact O-N 2.97Å; T157-R159 VanDerWaalsContact C-N 3.3Å; T157-R159 PolarHBondContact O-N 3.35Å
160	K	78.6	Confident	66.1	Low	141 Å²	141	105.2 Å²	105.2	61%	0.613	56%	0.56	S	S	*	*	H	α-helix	trans	-84.6	-25.4	173.7	-68.7	171.8	-175.6	172.4	0	113.5	E156 T157 R158	E156-K160 WeakPolarHBondContact O-CG 3.5Å; E156-K160 PolarHBondContact O-N 2.88Å; E156-K160 VanDerWaalsContact O-N 3.1Å; E156-K160 VanDerWaalsContact OE1-CE 3.26Å; E156-K160 WeakPolarHBondContact OE1-CE 3.37Å; E156-K160 IonicContact OE1-NZ 2.71Å; E156-K160 PolarHBondContact OE1-NZ 2.94Å; T157-K160 PolarHBondContact O-N 2.96Å; T157-K160 VanDerWaalsContact O-N 3.08Å; R158-K160 PolarHBondContact O-N 3.2Å
161	L	72.8	Confident	63.8	Low	81 Å²	81	109.5 Å²	109.5	42%	0.424	58%	0.584	S	S	.	*	H	α-helix	trans	-88.8	-24.1	175.4	-67.3	175	0	0	0	112.6	F112 T157 R158 V163	F112-L161 HydrophobicContact CB-CD1 4.32Å; F112-L161 HydrophobicContact CD2-CD1 3.75Å; F112-L161 HydrophobicContact CE2-CD1 4.34Å; F112-L161 HydrophobicContact CG-CD1 4.14Å; T157-L161 HydrophobicContact CG2-CD1 4Å; T157-L161 HydrophobicContact CG2-CG 4.27Å; T157-L161 WeakPolarHBondContact O-CG 3.37Å; T157-L161 PolarHBondContact O-N 2.96Å; R158-L161 PolarHBondContact O-N 3.31Å; L161-V163 VanDerWaalsContact C-N 3.33Å; L161-V163 PolarHBondContact O-N 3.08Å
162	A	71.1	Confident	61.5	Low	64 Å²	64	113.6 Å²	113.6	53%	0.529	59%	0.593	S	S	.	*	S	Bend	trans	-70.4	90	164.3	0	0	0	0	0	109.1	R158	R158-A162 WeakPolarHBondContact O-CB 3.46Å; R158-A162 PolarHBondContact O-N 3.29Å
163	V	49.4	Very low	58.9	Low	114 Å²	114	114.8 Å²	114.8	69%	0.691	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-53.9	129	173.9	176.8	0	0	0	0	109.3	L161 E165	L161-V163 VanDerWaalsContact C-N 3.33Å; L161-V163 PolarHBondContact O-N 3.08Å; V163-E165 PolarHBondContact O-N 3.4Å
164	P	50.4	Low	56.1	Low	111 Å²	111	117.6 Å²	117.6	72%	0.721	63%	0.625	S	S	*	*	P	Polyproline II helix	trans	-63.2	120	167.2	-19.7	32.6	0	0	0	109.7	L166	P164-L166 PolarHBondContact O-N 3.4Å
165	E	41.4	Very low	53.2	Low	184 Å²	184	120.1 Å²	120.1	86%	0.86	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-55.1	134.3	161.4	-75.7	-67.9	155.3	0	0	108.7	V163	V163-E165 PolarHBondContact O-N 3.4Å
166	L	45.2	Very low	50.5	Low	145 Å²	145	120.6 Å²	120.6	76%	0.759	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-71.8	135.6	-171.8	-84.8	165.3	0	0	0	111.8	P164 E168	P164-L166 PolarHBondContact O-N 3.4Å; L166-E168 HydrophobicContact CD2-CG 4.15Å
167	C	28.2	Very low	47.8	Very low	129 Å²	129	123.1 Å²	123.1	87%	0.872	69%	0.693	S	S	*	*			trans	-143.7	73.4	155.2	-168.1	0	0	0	0	108.7
168	E	37.8	Very low	45.3	Very low	176 Å²	176	129.4 Å²	129.4	82%	0.822	72%	0.724	S	S	*	*			trans	-84.7	116.2	163.2	-70.4	-171.6	147.8	0	0	108.8	L166	L166-E168 HydrophobicContact CD2-CG 4.15Å
169	D	29.9	Very low	42.6	Very low	145 Å²	145	134 Å²	134	78%	0.775	75%	0.747	S	S	*	*			trans	-144.2	145	130.1	-159.3	9.1	0	0	0	111.4
170	S	36.4	Very low	40	Very low	95 Å²	95	132.5 Å²	132.5	66%	0.664	76%	0.756	S	S	*	*			trans	-44.4	164.8	168.2	-27.2	0	0	0	0	114
171	T	31.8	Very low	37.6	Very low	133 Å²	133	134 Å²	134	82%	0.816	76%	0.763	S	S	*	*			cis	-148.4	169.4	16.1	41.1	0	0	0	0	111.2
172	E	34.4	Very low	35.4	Very low	180 Å²	180	134.8 Å²	134.8	84%	0.841	78%	0.775	S	S	*	*			trans	-65	148.2	165.8	-55.9	177.5	103.1	0	0	113.3
173	T	30.5	Very low	33.5	Very low	124 Å²	124	141.4 Å²	141.4	76%	0.761	79%	0.792	S	S	*	*				178	139.6	123.1	26.7	0	0	0	0	114.4
174	N	29.7	Very low	32.4	Very low	154 Å²	154	142.2 Å²	142.2	82%	0.824	79%	0.792	S	S	*	*			trans	33	109.7	146.4	-59	-46.1	0	0	0	122.2
175	G	26.6	Very low	31.4	Very low	78 Å²	78	144.9 Å²	144.9	80%	0.804	80%	0.799	S	S	*	*				92.2	148	109.4	0	0	0	0	0	121.6
176	A	30	Very low	30.8	Very low	102 Å²	102	142.2 Å²	142.2	84%	0.843	79%	0.791	S	S	*	*			trans	66.4	101.1	160.5	0	0	0	0	0	120.8
177	N	28.5	Very low	30.1	Very low	146 Å²	146	143.6 Å²	143.6	78%	0.781	79%	0.794	S	S	*	*			trans	-1	124.1	132.8	171.2	35.5	0	0	0	118
178	L	31.4	Very low	30.4	Very low	169 Å²	169	146 Å²	146	89%	0.885	79%	0.792	S	S	*	*			trans	-160.9	-174.8	132.8	-108.8	167.9	0	0	0	112.4
179	K	28.4	Very low	30.2	Very low	178 Å²	178	147.1 Å²	147.1	77%	0.774	79%	0.794	S	S	*	*			trans	-117.1	179.7	-157.5	-163.6	162	179.4	169.9	0	113.1
180	T	27.4	Very low	30.1	Very low	133 Å²	133	146.1 Å²	146.1	82%	0.816	79%	0.789	S	S	*	*			trans	72.3	155.4	167.5	55.1	0	0	0	0	117.5
181	K	27.8	Very low	29.8	Very low	174 Å²	174	146.4 Å²	146.4	76%	0.757	79%	0.791	S	S	*	*			cis	-174.1	118.7	-22.5	162.2	72.8	176.9	-173.1	0	109.4
182	S	27.2	Very low	29.6	Very low	97 Å²	97	146.4 Å²	146.4	68%	0.678	79%	0.786	S	S	*	*			trans	62.3	173.3	168.1	-58.4	0	0	0	0	114.3
183	K	31.3	Very low	29.5	Very low	203 Å²	203	145.7 Å²	145.7	88%	0.883	78%	0.782	S	S	*	*			cis	-127.3	164.5	5.6	-71.6	178.4	176.8	179	0	112.1
184	N	26.1	Very low	29.7	Very low	131 Å²	131	148.2 Å²	148.2	70%	0.701	79%	0.785	S	S	*	*			trans	-80	148.5	162.7	162.6	-73.6	0	0	0	109.8
185	L	29.2	Very low	29.8	Very low	166 Å²	166	149 Å²	149	87%	0.869	78%	0.784	S	S	*	*			trans	-149.2	162.9	145.1	-140.7	90.3	0	0	0	108.6
186	D	29.2	Very low	29.8	Very low	128 Å²	128	150.3 Å²	150.3	68%	0.684	78%	0.78	S	S	*	*			trans	-136.3	-162.8	-167.9	-145.7	-48	0	0	0	109.7
187	E	30.6	Very low	29.7	Very low	175 Å²	175	152.2 Å²	152.2	82%	0.818	78%	0.776	S	S	*	*			trans	83.8	87.4	168.5	-52.8	-167.9	137.7	0	0	117.7
188	E	33.7	Very low	29.7	Very low	179 Å²	179	152.6 Å²	152.6	84%	0.836	78%	0.777	S	S	*	*				31.4	126.1	109.1	-61.7	-92.3	122.6	0	0	118.8
189	K	34.3	Very low	29.8	Very low	199 Å²	199	151.9 Å²	151.9	87%	0.865	77%	0.773	S	S	*	*				-154.8	138.7	127.9	-140	-166.7	173.8	-159.7	0	115
190	D	27.6	Very low	29.7	Very low	125 Å²	125	146.6 Å²	146.6	67%	0.668	77%	0.769	S	S	*	*			trans	-100.1	149.8	176.3	-174.1	27	0	0	0	112.1
191	S	29.7	Very low	29.6	Very low	100 Å²	100	149.9 Å²	149.9	70%	0.699	77%	0.772	S	S	*	*			trans	178.6	140.5	165.6	-71.1	0	0	0	0	112
192	D	28.7	Very low	29.8	Very low	133 Å²	133	148 Å²	148	71%	0.711	78%	0.775	S	S	*	*			trans	-91.8	-157.8	-171.4	-55.1	-96.6	0	0	0	115.9
193	E	31.7	Very low	30.5	Very low	165 Å²	165	148.8 Å²	148.8	77%	0.771	78%	0.778	S	S	*	*			trans	95.3	95.2	157.6	-37.8	-57.8	-166.3	0	0	121.3
194	E	35.1	Very low	30.4	Very low	177 Å²	177	147.5 Å²	147.5	83%	0.827	78%	0.775	S	S	*	*				63.6	158.7	124.6	-71.6	-77.6	106.4	0	0	125.8
195	E	31.9	Very low	30.5	Very low	170 Å²	170	145.2 Å²	145.2	79%	0.794	77%	0.766	S	S	*	*			trans	82.8	89.4	151.9	-147.4	165.6	-175.2	0	0	124.1
196	C	26.5	Very low	30.7	Very low	106 Å²	106	147.6 Å²	147.6	72%	0.716	77%	0.769	S	S	*	*				44.4	132	120.9	-54.9	0	0	0	0	126.2
197	D	26.9	Very low	30.7	Very low	143 Å²	143	149.8 Å²	149.8	77%	0.765	78%	0.777	S	S	*	*			trans	73.1	135.2	135.2	-75.4	-19.7	0	0	0	126
198	L	30.1	Very low	30.7	Very low	153 Å²	153	146.5 Å²	146.5	80%	0.801	78%	0.78	S	S	*	*			trans	25.9	130.7	150.2	-76.6	64.5	0	0	0	119.2
199	I	32.3	Very low	30.3	Very low	155 Å²	155	147 Å²	147	80%	0.795	78%	0.779	S	S	*	*				-159.8	157.7	54.2	-68.5	178.1	0	0	0	107.8
200	G	25.7	Very low	29.9	Very low	67 Å²	67	142.6 Å²	142.6	69%	0.691	77%	0.772	S	S	*	*			cis	136.3	-177.6	2.6	0	0	0	0	0	113.2
201	F	26	Very low	29.7	Very low	201 Å²	201	145.6 Å²	145.6	88%	0.882	78%	0.782	S	S	*	*			trans	68.1	127.3	177.8	-86	-86.6	0	0	0	121.1
202	V	32.7	Very low	29.9	Very low	135 Å²	135	145.4 Å²	145.4	82%	0.818	78%	0.781	S	S	*	*			trans	-118.3	134.8	165.5	168.3	0	0	0	0	105.1
203	P	41.4	Very low	30.4	Very low	113 Å²	113	144.5 Å²	144.5	73%	0.734	78%	0.783	S	S	*	*				-151.8	-168	87.1	45	-24.5	0	0	0	113.3
204	E	29.3	Very low	30.1	Very low	177 Å²	177	144 Å²	144	83%	0.827	79%	0.785	S	S	*	*			cis	-150.2	-158.8	5.8	-149.1	-161.6	178.1	0	0	112
205	T	28.1	Very low	30.3	Very low	83 Å²	83	140.1 Å²	140.1	51%	0.509	78%	0.778	S	S	.	*			trans	-75.3	155.8	-175.8	51.6	0	0	0	0	117.8
206	K	32.5	Very low	30.2	Very low	215 Å²	215	141 Å²	141	94%	0.935	78%	0.782	S	S	*	*				-138.1	157.8	126.6	-67.6	-163.6	178.7	178.4	0	110.3
207	M	30.4	Very low	30.5	Very low	175 Å²	175	145.1 Å²	145.1	86%	0.862	79%	0.787	S	S	*	*			trans	-115.4	149.1	-163.9	-56.5	179.1	-173.4	0	0	114.5
208	A	29.3	Very low	30.6	Very low	106 Å²	106	144.2 Å²	144.2	88%	0.876	79%	0.792	S	S	*	*			trans	-145.9	168.6	159.7	0	0	0	0	0	109.7
209	K	25.8	Very low	30.8	Very low	188 Å²	188	141.9 Å²	141.9	82%	0.817	79%	0.785	S	S	*	*			trans	-139.9	124.1	-149.6	177.1	75.1	172.4	-175.2	0	114.5
210	C	26.1	Very low	31.2	Very low	107 Å²	107	139.3 Å²	139.3	72%	0.723	78%	0.778	S	S	*	*			trans	63.5	159.2	170.9	-62.4	0	0	0	0	115.3
211	E	23.6	Very low	31.6	Very low	188 Å²	188	141.4 Å²	141.4	88%	0.879	78%	0.779	S	S	*	*			cis	-134.8	-175.1	15	-157.2	158.4	113.7	0	0	111.9
212	S	34.6	Very low	31.9	Very low	97 Å²	97	136.1 Å²	136.1	68%	0.678	77%	0.766	S	S	*	*			trans	-137.7	156.1	-177.4	-163.6	0	0	0	0	110.2
213	P	38.5	Very low	32.2	Very low	113 Å²	113	138.1 Å²	138.1	73%	0.734	76%	0.764	S	S	*	*				-141.5	155.3	93	38.3	-24.9	0	0	0	116.6
214	D	26	Very low	31.9	Very low	154 Å²	154	143.7 Å²	143.7	82%	0.824	77%	0.771	S	S	*	*			trans	69.3	158	153.2	-73.8	-52	0	0	0	121.9
215	S	38.3	Very low	32.1	Very low	97 Å²	97	139 Å²	139	68%	0.678	76%	0.758	S	S	*	*			trans	-145.2	129.9	-155.3	-171.5	0	0	0	0	112.7
216	H	30.1	Very low	32.5	Very low	188 Å²	188	140.5 Å²	140.5	87%	0.87	77%	0.771	S	S	*	*			trans	-124.3	96.4	174.6	-66.1	-37.1	0	0	0	111	S218	H216-S218 PolarHBondContact O-N 3.18Å; H216-S218 VanDerWaalsContact O-N 3.12Å
217	K	32.5	Very low	33.2	Very low	193 Å²	193	134 Å²	134	84%	0.839	75%	0.746	S	S	*	*			trans	-66.4	104.3	166.2	-92.5	-177.7	171.8	177.2	0	109.6	T219	K217-T219 PolarHBondContact O-N 3.18Å; K217-T219 PolarHBondContact O-OG1 2.97Å
218	S	29.4	Very low	33.5	Very low	124 Å²	124	130.5 Å²	130.5	87%	0.867	74%	0.736	S	S	*	*			trans	-61	134.2	169	-165.5	0	0	0	0	109.9	H216	H216-S218 PolarHBondContact O-N 3.18Å; H216-S218 VanDerWaalsContact O-N 3.12Å
219	T	33.3	Very low	34	Very low	104 Å²	104	130.2 Å²	130.2	64%	0.638	73%	0.726	S	S	*	*			trans	-120.5	134.3	-176.2	-59.9	0	0	0	0	107.9	K217	K217-T219 PolarHBondContact O-N 3.18Å; K217-T219 PolarHBondContact O-OG1 2.97Å
220	P	41.8	Very low	34.4	Very low	101 Å²	101	125.5 Å²	125.5	66%	0.656	71%	0.714	S	S	*	*			trans	-60.4	152.3	178	26.1	-35.1	0	0	0	111.2	C222	P220-C222 VanDerWaalsContact C-N 3.34Å; P220-C222 PolarHBondContact O-N 2.81Å
221	P	33.3	Very low	34.8	Very low	110 Å²	110	127.6 Å²	127.6	71%	0.714	71%	0.713	S	S	*	*			trans	-71.8	83.3	-170.3	28.9	-36	0	0	0	112.5	F223	P221-F223 PolarHBondContact O-N 3.3Å
222	C	33.6	Very low	35.5	Very low	91 Å²	91	126.2 Å²	126.2	62%	0.615	71%	0.712	S	S	*	*			trans	-64.8	100.5	173.5	-70.4	0	0	0	0	110.9	P220 R224	P220-C222 VanDerWaalsContact C-N 3.34Å; P220-C222 PolarHBondContact O-N 2.81Å; C222-R224 PolarHBondContact O-N 2.96Å
223	F	39.1	Very low	35.6	Very low	177 Å²	177	125.4 Å²	125.4	78%	0.776	71%	0.707	S	S	*	*			trans	-64.9	81.6	164.7	-107.3	-86.4	0	0	0	110.1	P221 S225	P221-F223 PolarHBondContact O-N 3.3Å; F223-S225 VanDerWaalsContact C-N 3.28Å; F223-S225 PolarHBondContact O-N 3.23Å
224	R	33.8	Very low	35.4	Very low	230 Å²	230	131.2 Å²	131.2	87%	0.868	72%	0.716	S	S	*	*			trans	-67.7	88.1	169.3	-91.1	-170.1	167.6	-167.9	-2.1	109.4	C222 S226	C222-R224 PolarHBondContact O-N 2.96Å; R224-S226 VanDerWaalsContact C-N 3.25Å; R224-S226 PolarHBondContact O-N 3.17Å
225	S	34.3	Very low	35.8	Very low	79 Å²	79	133.3 Å²	133.3	55%	0.552	72%	0.718	S	S	*	*			trans	-63.8	92.3	158.6	-170.8	0	0	0	0	108.1	F223 L227	F223-S225 VanDerWaalsContact C-N 3.28Å; F223-S225 PolarHBondContact O-N 3.23Å; S225-L227 PolarHBondContact O-N 2.8Å
226	S	36.6	Very low	35.6	Very low	113 Å²	113	139.1 Å²	139.1	79%	0.79	73%	0.726	S	S	*	*			trans	-75.3	61.6	-178.5	-178.6	0	0	0	0	111.1	R224	R224-S226 VanDerWaalsContact C-N 3.25Å; R224-S226 PolarHBondContact O-N 3.17Å
227	L	47.3	Very low	35.7	Very low	79 Å²	79	142.2 Å²	142.2	41%	0.414	73%	0.73	S	S	.	*	P	Polyproline II helix	trans	-62.6	123.4	168.9	-63.5	178.8	0	0	0	108.5	Y145 S225	Y145-L227 HydrophobicContact CD1-CD1 4.18Å; Y145-L227 HydrophobicContact CG-CD1 4.34Å; S225-L227 PolarHBondContact O-N 2.8Å
228	P	37.1	Very low	35.5	Very low	101 Å²	101	137.5 Å²	137.5	66%	0.656	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-66.3	148.1	176.4	28.1	-34	0	0	0	110.3
229	P	39.6	Very low	36	Very low	100 Å²	100	137.6 Å²	137.6	65%	0.649	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-61.7	152.1	175	27.5	-35	0	0	0	111	Q231	P229-Q231 PolarHBondContact O-N 3.31Å
230	P	34.1	Very low	35.9	Very low	89 Å²	89	136.5 Å²	136.5	58%	0.578	72%	0.721	S	S	*	*			trans	-63.8	108	-175.8	25.6	-34.2	0	0	0	111.7	D232	P230-D232 PolarHBondContact O-N 3.02Å
231	Q	33.4	Very low	35.5	Very low	151 Å²	151	138.8 Å²	138.8	71%	0.706	73%	0.728	S	S	*	*			trans	-82	91.9	168.9	-76	-75.7	-10.6	0	0	109.2	P229 S233	P229-Q231 PolarHBondContact O-N 3.31Å; Q231-S233 PolarHBondContact O-N 2.86Å
232	D	38.5	Very low	35.5	Very low	160 Å²	160	139.8 Å²	139.8	86%	0.856	73%	0.732	S	S	*	*			trans	-69.7	69	174.2	-81.9	-36.7	0	0	0	111.8	P230	P230-D232 PolarHBondContact O-N 3.02Å
233	S	37	Very low	35.8	Very low	80 Å²	80	141.4 Å²	141.4	56%	0.559	74%	0.741	S	S	*	*			trans	-151.8	38.9	-178.6	70.4	0	0	0	0	114.9	Q231 F235	Q231-S233 PolarHBondContact O-N 2.86Å; S233-F235 PolarHBondContact O-N 2.84Å
234	Y	34.9	Very low	35.3	Very low	235 Å²	235	137.3 Å²	137.3	92%	0.922	74%	0.74	S	S	*	*			trans	-77.1	57.3	170.7	-96.5	-81.7	0	0	0	113.4
235	F	34.8	Very low	35.1	Very low	198 Å²	198	133.2 Å²	133.2	87%	0.868	74%	0.741	S	S	*	*	S	Bend	trans	-121.3	103.7	162.5	-96.2	-83.5	0	0	0	109.9	S233	S233-F235 PolarHBondContact O-N 2.84Å
236	Y	33.1	Very low	34.9	Very low	218 Å²	218	135 Å²	135	86%	0.855	75%	0.749	S	S	*	*			trans	49.9	91.8	152.8	-138	-86.1	0	0	0	118.3
237	R	32	Very low	34.7	Very low	253 Å²	253	136.2 Å²	136.2	96%	0.955	75%	0.751	S	S	*	*			trans	-106.4	131.3	149.3	-91.4	-157.1	-175.1	-143.2	7.9	110.2
238	S	28.3	Very low	33.9	Very low	95 Å²	95	136.7 Å²	136.7	66%	0.664	77%	0.767	S	S	*	*			trans	-92.2	147.9	168.7	-169.3	0	0	0	0	109.9
239	P	40.8	Very low	33.4	Very low	125 Å²	125	139.3 Å²	139.3	81%	0.812	78%	0.775	S	S	*	*			trans	-79.1	137.2	175.6	-9.1	26.9	0	0	0	112.1
240	A	31.3	Very low	33.1	Very low	82 Å²	82	140.5 Å²	140.5	68%	0.678	78%	0.781	S	S	*	*			trans	-160.3	118.8	159.9	0	0	0	0	0	110.2
241	D	32	Very low	32.9	Very low	149 Å²	149	141.5 Å²	141.5	80%	0.797	79%	0.79	S	S	*	*			trans	37.7	119.7	133.5	-37.9	-41	0	0	0	118.8
242	T	33.4	Very low	33.5	Very low	131 Å²	131	139.7 Å²	139.7	80%	0.804	79%	0.791	S	S	*	*				171	180	69.3	37.9	0	0	0	0	108.7
243	P	40.6	Very low	32.8	Very low	124 Å²	124	138.5 Å²	138.5	81%	0.805	78%	0.784	S	S	*	*			cis	-122.9	-166.5	-37.9	35.1	-17.4	0	0	0	111.3
244	A	28.4	Very low	32.6	Very low	91 Å²	91	141.8 Å²	141.8	75%	0.752	80%	0.795	S	S	*	*			trans	-102.2	163.1	177.1	0	0	0	0	0	114.1
245	T	29.4	Very low	32.3	Very low	145 Å²	145	134.9 Å²	134.9	89%	0.89	78%	0.781	S	S	*	*			trans	-136.5	153.3	168.2	-62.4	0	0	0	0	109.3
246	T	30.6	Very low	31.9	Very low	116 Å²	116	133.5 Å²	133.5	71%	0.712	78%	0.778	S	S	*	*			trans	-130.7	166.8	-160.5	-45.2	0	0	0	0	112.4
247	T	31.2	Very low	31.7	Very low	138 Å²	138	128.9 Å²	128.9	85%	0.847	78%	0.777	S	S	*	*			trans	77.1	146.2	172.1	76.4	0	0	0	0	115.3
248	A	31.4	Very low	31.8	Very low	90 Å²	90	122.9 Å²	122.9	74%	0.744	77%	0.774	S	S	*	*			cis	-143.7	138.5	-4.9	0	0	0	0	0	108.3
249	D	26.7	Very low	32.1	Very low	156 Å²	156	123.8 Å²	123.8	83%	0.834	78%	0.78	S	S	*	*				83.4	163.1	94.9	-162.8	25.4	0	0	0	114.9
250	V	33.5	Very low	31.9	Very low	125 Å²	125	126.6 Å²	126.6	76%	0.758	78%	0.783	S	S	*	*			trans	84.4	122.8	-177.9	-169.5	0	0	0	0	117.4
251	S	30.3	Very low	32	Very low	110 Å²	110	131.4 Å²	131.4	77%	0.769	79%	0.791	S	S	*	*			trans	-150.2	169.7	166.7	-76.4	0	0	0	0	106.6
252	P	45.9	Very low	32.1	Very low	113 Å²	113	135.3 Å²	135.3	73%	0.734	80%	0.796	S	S	*	*			cis	-119.5	-142.6	10.1	30.9	-5.8	0	0	0	110
253	D	23.3	Very low	32.1	Very low	134 Å²	134	138 Å²	138	72%	0.717	79%	0.792	S	S	*	*			cis	-163.1	172.8	7.7	-145.9	-17.7	0	0	0	113.9
254	L	32.3	Very low	31.8	Very low	149 Å²	149	141.7 Å²	141.7	78%	0.78	80%	0.798	S	S	*	*			trans	70.6	138.6	160.1	-62.7	-173.9	0	0	0	122.7
255	S	29.7	Very low	32	Very low	91 Å²	91	140.2 Å²	140.2	64%	0.636	79%	0.791	S	S	*	*			trans	77.6	103.5	153.8	-76	0	0	0	0	122.4
256	E	26.1	Very low	32.6	Very low	169 Å²	169	144.4 Å²	144.4	79%	0.79	79%	0.79	S	S	*	*				57.4	105.2	125	-65.9	170.1	100.6	0	0	120.8
257	S	27.5	Very low	33.6	Very low	120 Å²	120	146 Å²	146	84%	0.839	78%	0.784	S	S	*	*				-168	139	101.1	-83.8	0	0	0	0	113.1
258	S	35.9	Very low	35.5	Very low	127 Å²	127	148.9 Å²	148.9	89%	0.888	79%	0.785	S	S	*	*			trans	-89.8	121	-179.3	-179	0	0	0	0	112.3
259	S	34.3	Very low	38.1	Very low	114 Å²	114	146.6 Å²	146.6	80%	0.797	76%	0.759	S	S	*	*			trans	-162.3	17.5	164.5	53.8	0	0	0	0	116.9
260	Q	36.3	Very low	41.1	Very low	185 Å²	185	142.1 Å²	142.1	86%	0.864	74%	0.74	S	S	*	*			trans	-119.3	84.7	174.3	-72.2	-165	3.1	0	0	113.8
261	Q	32.3	Very low	43.6	Very low	182 Å²	182	145.2 Å²	145.2	85%	0.85	74%	0.743	S	S	*	*			trans	178.8	73.9	143.7	-102.8	172.9	51.7	0	0	113.9
262	Y	35.2	Very low	46.4	Very low	232 Å²	232	143.3 Å²	143.3	91%	0.91	73%	0.733	S	S	*	*			trans	-168.1	145.9	152.9	-80.9	-63.8	0	0	0	105
263	R	32.5	Very low	48.7	Very low	188 Å²	188	140.1 Å²	140.1	71%	0.709	71%	0.709	S	S	*	*			cis	-152.2	100.6	36	-62.6	171.7	-176.5	-179.4	2.4	112.8
264	H	35	Very low	52	Low	201 Å²	201	135.7 Å²	135.7	93%	0.931	69%	0.685	S	S	*	*			trans	-122.1	23.2	157.6	-76.1	-16.5	0	0	0	113	R266	H264-R266 PolarHBondContact O-N 2.7Å
265	G	33	Very low	54.8	Low	59 Å²	59	131.2 Å²	131.2	61%	0.608	67%	0.669	S	S	*	*	S	Bend	trans	-60.6	129.4	160.8	0	0	0	0	0	110.2	Y267	G265-Y267 PolarHBondContact O-N 3.25Å
266	R	41.9	Very low	57.8	Low	234 Å²	234	127.2 Å²	127.2	88%	0.883	64%	0.642	S	S	*	*			trans	-62.1	117.2	-178.4	-81.2	175.5	-87	179.8	-6.6	110.6	H264 K268	H264-R266 PolarHBondContact O-N 2.7Å; R266-K268 VanDerWaalsContact C-N 3.28Å; R266-K268 PolarHBondContact O-N 3.35Å
267	Y	50.7	Low	61.1	Low	149 Å²	149	119.2 Å²	119.2	58%	0.584	60%	0.604	S	S	*	*			trans	-60.2	84.1	170.3	-83.9	-101.4	0	0	0	111.1	G265 K269	G265-Y267 PolarHBondContact O-N 3.25Å; Y267-K269 PolarHBondContact O-N 3.24Å
268	K	72.4	Confident	64.2	Low	199 Å²	199	119.2 Å²	119.2	87%	0.865	59%	0.586	S	S	*	*			trans	-72.7	92	168.8	-72.1	-177.3	179.9	177.2	0	108.5	R266 S270	R266-K268 VanDerWaalsContact C-N 3.28Å; R266-K268 PolarHBondContact O-N 3.35Å; K268-S270 PolarHBondContact O-N 2.97Å
269	K	85.2	Confident	66.8	Low	42 Å²	42	120.6 Å²	120.6	18%	0.183	58%	0.576	C	S	.	*			trans	-56.3	126.8	173.5	-66.3	178.4	176.9	174.9	0	109.1	Y267 L274 L301 D305	Y267-K269 PolarHBondContact O-N 3.24Å; K269-L274 HydrophobicContact CB-CD2 3.99Å; K269-L274 HydrophobicContact CB-CG 3.98Å; K269-L274 WeakPolarHBondContact O-CD1 3.5Å; K269-L301 HydrophobicContact CD-CD1 3.83Å; K269-L301 HydrophobicContact CD-CD2 4.46Å; K269-L301 HydrophobicContact CG-CD1 4.17Å; K269-L301 HydrophobicContact CG-CD2 4.18Å; K269-D305 WeakPolarHBondContact CE-OD1 3.31Å; K269-D305 PolarHBondContact NZ-O 2.99Å; K269-D305 IonicContact NZ-OD1 3.66Å; K269-D305 PolarHBondContact NZ-OD1 3.37Å
270	S	89.9	Confident	69.6	Low	62 Å²	62	115.1 Å²	115.1	43%	0.434	54%	0.538	S	S	.	.			trans	-59.7	155.5	-175.9	173.4	0	0	0	0	111.7	K268 A272 Q273 L274	K268-S270 PolarHBondContact O-N 2.97Å; S270-A272 PolarHBondContact O-N 2.72Å; S270-A272 PolarHBondContact OG-N 3.15Å; S270-Q273 PolarHBondContact O-N 3.07Å; S270-Q273 VanDerWaalsContact O-N 3.16Å; S270-L274 WeakPolarHBondContact O-CB 3.46Å; S270-L274 WeakPolarHBondContact O-CG 3.23Å; S270-L274 PolarHBondContact O-N 3.38Å
271	K	86.8	Confident	72.3	Confident	190 Å²	190	106.7 Å²	106.7	83%	0.826	50%	0.498	S	S	*	.	H	α-helix	trans	-54	-38.6	175.3	-172.1	-177.3	176.4	-170.4	0	111.4	A275	K271-A275 WeakPolarHBondContact O-CB 3.43Å; K271-A275 PolarHBondContact O-N 3.15Å
272	A	89	Confident	75	Confident	69 Å²	69	102.4 Å²	102.4	57%	0.57	48%	0.481	S	S	*	.	H	α-helix	trans	-67.9	-49.6	175.9	0	0	0	0	0	112.3	S270 L274 A275 A276	S270-A272 PolarHBondContact O-N 2.72Å; S270-A272 PolarHBondContact OG-N 3.15Å; A272-L274 VanDerWaalsContact C-N 3.29Å; A272-L274 PolarHBondContact O-N 2.98Å; A272-A275 WeakPolarHBondContact O-CA 3.46Å; A272-A275 WeakPolarHBondContact O-CB 3.33Å; A272-A275 PolarHBondContact O-N 3.48Å; A272-A276 PolarHBondContact O-N 3.34Å
273	Q	92.6	Very high	77.4	Confident	47 Å²	47	98.1 Å²	98.1	22%	0.22	46%	0.463	C	S	.	.	H	α-helix	trans	-56.1	-43.7	175.8	-65	173.4	-32	0	0	111.4	S270 A275 L277 T299 L301	S270-Q273 PolarHBondContact O-N 3.07Å; S270-Q273 VanDerWaalsContact O-N 3.16Å; Q273-A275 VanDerWaalsContact C-N 3.33Å; Q273-A275 PolarHBondContact O-N 3.36Å; Q273-L277 WeakPolarHBondContact O-CB 3.49Å; Q273-L277 WeakPolarHBondContact O-CD1 3.26Å; Q273-L277 WeakPolarHBondContact O-CG 3.48Å; Q273-L277 PolarHBondContact O-N 2.99Å; Q273-T299 HydrophobicContact CB-CG2 4.36Å; Q273-T299 WeakPolarHBondContact CG-O 3.48Å; Q273-T299 PolarHBondContact NE2-O 3.36Å; Q273-L301 HydrophobicContact CB-CD1 4.24Å
274	L	92.7	Very high	80	Confident	41 Å²	41	92 Å²	92	22%	0.215	44%	0.443	C	S	.	.	H	α-helix	trans	-68.6	-28.1	176	-70.2	173.2	0	0	0	113.2	K269 S270 A272 R278	K269-L274 HydrophobicContact CB-CD2 3.99Å; K269-L274 HydrophobicContact CB-CG 3.98Å; K269-L274 WeakPolarHBondContact O-CD1 3.5Å; S270-L274 WeakPolarHBondContact O-CB 3.46Å; S270-L274 WeakPolarHBondContact O-CG 3.23Å; S270-L274 PolarHBondContact O-N 3.38Å; A272-L274 VanDerWaalsContact C-N 3.29Å; A272-L274 PolarHBondContact O-N 2.98Å; L274-R278 WeakPolarHBondContact O-CB 3.38Å; L274-R278 VanDerWaalsContact O-CD 3.28Å; L274-R278 WeakPolarHBondContact O-CD 3.46Å; L274-R278 WeakPolarHBondContact O-CG 3.47Å; L274-R278 PolarHBondContact O-N 3.35Å; L274-R278 VanDerWaalsContact O-N 3.13Å
275	A	91.8	Very high	82.4	Confident	54 Å²	54	86.4 Å²	86.4	45%	0.446	42%	0.419	S	S	.	.	H	α-helix	trans	-72.2	-47.7	174.7	0	0	0	0	0	111.4	K271 A272 Q273 R278 K279	K271-A275 WeakPolarHBondContact O-CB 3.43Å; K271-A275 PolarHBondContact O-N 3.15Å; A272-A275 WeakPolarHBondContact O-CA 3.46Å; A272-A275 WeakPolarHBondContact O-CB 3.33Å; A272-A275 PolarHBondContact O-N 3.48Å; Q273-A275 VanDerWaalsContact C-N 3.33Å; Q273-A275 PolarHBondContact O-N 3.36Å; A275-R278 PolarHBondContact O-N 3.16Å; A275-K279 WeakPolarHBondContact O-CB 3.36Å; A275-K279 PolarHBondContact O-N 2.96Å
276	A	92.2	Very high	85.1	Confident	8 Å²	8	92.1 Å²	92.1	7%	0.066	42%	0.423	C	S	.	.	H	α-helix	trans	-56.5	-50.4	174	0	0	0	0	0	112	A272 R278 K279 S280 L295 E298 T299	A272-A276 PolarHBondContact O-N 3.34Å; A276-R278 VanDerWaalsContact C-N 3.32Å; A276-R278 PolarHBondContact O-N 3.27Å; A276-K279 PolarHBondContact O-N 2.95Å; A276-S280 PolarHBondContact O-N 3.35Å; A276-L295 HydrophobicContact CB-CD2 4.43Å; A276-E298 VanDerWaalsContact CB-CD 3.41Å; A276-E298 HydrophobicContact CB-CG 3.87Å; A276-T299 HydrophobicContact CB-CG2 3.7Å
277	L	94.9	Very high	87.2	Confident	0 Å²	0	82 Å²	82	0%	0	39%	0.388	C	S	.	.	H	α-helix	trans	-57.9	-40.4	176.2	-72.6	169.8	0	0	0	112.6	Q273 F281 L295 T299 L301 I306 W309 F310	Q273-L277 WeakPolarHBondContact O-CB 3.49Å; Q273-L277 WeakPolarHBondContact O-CD1 3.26Å; Q273-L277 WeakPolarHBondContact O-CG 3.48Å; Q273-L277 PolarHBondContact O-N 2.99Å; L277-F281 WeakPolarHBondContact O-CB 3.36Å; L277-F281 PolarHBondContact O-N 3.26Å; L277-L295 HydrophobicContact CD2-CD1 4.32Å; L277-L295 HydrophobicContact CD2-CD2 4.36Å; L277-T299 HydrophobicContact CG-CG2 4.48Å; L277-L301 HydrophobicContact CD1-CD1 3.83Å; L277-I306 HydrophobicContact CD2-CG1 4.28Å; L277-I306 HydrophobicContact CD2-CG2 4.07Å; L277-W309 HydrophobicContact CB-CD2 4.01Å; L277-W309 HydrophobicContact CB-CE3 3.8Å; L277-W309 HydrophobicContact CB-CH2 3.74Å; L277-W309 HydrophobicContact CB-CZ2 3.92Å; L277-W309 HydrophobicContact CB-CZ3 3.67Å; L277-W309 HydrophobicContact CD1-CD2 3.86Å; L277-W309 HydrophobicContact CD1-CE3 4.31Å; L277-W309 HydrophobicContact CD1-CG 3.92Å; L277-W309 HydrophobicContact CD2-CD2 4.44Å; L277-W309 HydrophobicContact CD2-CE3 4.12Å; L277-W309 HydrophobicContact CG-CD2 4.34Å; L277-W309 HydrophobicContact CG-CE3 4.3Å; L277-W309 WeakPolarHBondContact O-CZ3 3.48Å; L277-F310 HydrophobicContact CD2-CD2 4.36Å; L277-F310 HydrophobicContact CD2-CE2 3.74Å
278	R	93.2	Very high	88.9	Confident	120 Å²	120	77.3 Å²	77.3	45%	0.453	38%	0.379	S	S	.	.	H	α-helix	trans	-70.8	-41.7	175.9	-75.3	168	-179.3	157.2	-1.6	113	L274 A275 A276 S280 F281 L282 W309 L324	L274-R278 WeakPolarHBondContact O-CB 3.38Å; L274-R278 VanDerWaalsContact O-CD 3.28Å; L274-R278 WeakPolarHBondContact O-CD 3.46Å; L274-R278 WeakPolarHBondContact O-CG 3.47Å; L274-R278 PolarHBondContact O-N 3.35Å; L274-R278 VanDerWaalsContact O-N 3.13Å; A275-R278 PolarHBondContact O-N 3.16Å; A276-R278 VanDerWaalsContact C-N 3.32Å; A276-R278 PolarHBondContact O-N 3.27Å; R278-S280 VanDerWaalsContact C-N 3.27Å; R278-S280 PolarHBondContact O-N 2.93Å; R278-F281 PolarHBondContact O-N 3.33Å; R278-L282 WeakPolarHBondContact O-CG 3.24Å; R278-L282 PolarHBondContact O-N 2.98Å; R278-W309 HydrophobicContact CG-CH2 3.9Å; R278-W309 HydrophobicContact CG-CZ2 3.98Å; R278-L324 HydrophobicContact CG-CD1 4.24Å
279	K	91	Very high	89.7	Confident	156 Å²	156	72.4 Å²	72.4	68%	0.678	36%	0.36	S	S	*	.	H	α-helix	trans	-57.9	-43.3	175.9	-177.3	-179.1	178.8	-176.9	0	110.5	A275 A276	A275-K279 WeakPolarHBondContact O-CB 3.36Å; A275-K279 PolarHBondContact O-N 2.96Å; A276-K279 PolarHBondContact O-N 2.95Å
280	S	93.1	Very high	90	Very high	0 Å²	0	75.1 Å²	75.1	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-66.7	-47.7	173.7	-175.8	0	0	0	0	112.5	A276 R278 L282 R283 E284 E291	A276-S280 PolarHBondContact O-N 3.35Å; R278-S280 VanDerWaalsContact C-N 3.27Å; R278-S280 PolarHBondContact O-N 2.93Å; S280-L282 PolarHBondContact O-N 3.12Å; S280-R283 WeakPolarHBondContact O-CA 3.45Å; S280-R283 WeakPolarHBondContact O-CB 3.43Å; S280-R283 PolarHBondContact O-N 3.21Å; S280-E284 PolarHBondContact O-N 3.5Å; S280-E291 WeakPolarHBondContact CB-OE1 3.34Å; S280-E291 WeakPolarHBondContact OG-CG 3.42Å; S280-E291 PolarHBondContact OG-OE1 3.27Å
281	F	93.4	Very high	90.1	Very high	8 Å²	8	72.7 Å²	72.7	4%	0.035	36%	0.363	C	S	.	.	H	α-helix	trans	-59.6	-29.3	178.7	-168.1	-82.5	0	0	0	114.6	L277 R278 R283 N285 W309 F310 R314 L324	L277-F281 WeakPolarHBondContact O-CB 3.36Å; L277-F281 PolarHBondContact O-N 3.26Å; R278-F281 PolarHBondContact O-N 3.33Å; F281-R283 VanDerWaalsContact C-N 3.33Å; F281-N285 HydrophobicContact CE1-CB 4.42Å; F281-N285 HydrophobicContact CE2-CB 4.42Å; F281-N285 HydrophobicContact CZ-CB 4.24Å; F281-W309 HydrophobicContact CB-CH2 4.22Å; F281-W309 HydrophobicContact CB-CZ3 3.99Å; F281-W309 AromaticContact CD2-CZ3 3.97Å; F281-W309 HydrophobicContact CD2-CZ3 3.97Å; F281-W309 HydrophobicContact CG-CZ3 4.28Å; F281-F310 HydrophobicContact CB-CE1 3.87Å; F281-F310 HydrophobicContact CB-CZ 4.34Å; F281-F310 AromaticContact CD2-CD1 3.5Å; F281-F310 HydrophobicContact CD2-CD1 3.5Å; F281-F310 VanDerWaalsContact CD2-CD1 3.5Å; F281-F310 AromaticContact CD2-CE1 3.74Å; F281-F310 HydrophobicContact CD2-CE1 3.74Å; F281-F310 HydrophobicContact CD2-CG 4.31Å; F281-F310 HydrophobicContact CE2-CD1 4.19Å; F281-F310 HydrophobicContact CG-CD1 4.43Å; F281-F310 HydrophobicContact CG-CE1 4.25Å; F281-R314 HydrophobicContact CE2-CG 3.92Å; F281-R314 HydrophobicContact CZ-CG 4.06Å; F281-L324 HydrophobicContact CD1-CD2 3.47Å; F281-L324 VanDerWaalsContact CD1-CD2 3.47Å; F281-L324 HydrophobicContact CE1-CD2 3.97Å; F281-L324 HydrophobicContact CG-CD2 4.34Å
282	L	88.9	Confident	90.4	Very high	92 Å²	92	64 Å²	64	48%	0.482	33%	0.325	S	S	.	.	H	α-helix	trans	-72.7	-24.9	174	-72.1	170.2	0	0	0	113	R278 S280 L324 A327	R278-L282 WeakPolarHBondContact O-CG 3.24Å; R278-L282 PolarHBondContact O-N 2.98Å; S280-L282 PolarHBondContact O-N 3.12Å; L282-L324 HydrophobicContact CD2-CD2 4.14Å; L282-L324 HydrophobicContact CD2-CG 4.39Å; L282-L324 HydrophobicContact CG-CD2 4.44Å; L282-A327 HydrophobicContact CD2-CB 4.1Å
283	R	85.4	Confident	90.5	Very high	142 Å²	142	66.2 Å²	66.2	54%	0.536	32%	0.322	S	S	.	.	H	α-helix	trans	-88.2	-49.5	175.2	-167.1	-174.1	77.1	-137.6	5.4	111.5	S280 F281 E291	S280-R283 WeakPolarHBondContact O-CA 3.45Å; S280-R283 WeakPolarHBondContact O-CB 3.43Å; S280-R283 PolarHBondContact O-N 3.21Å; F281-R283 VanDerWaalsContact C-N 3.33Å; R283-E291 IonicContact CZ-OE2 3.78Å; R283-E291 IonicContact NH1-OE1 2.71Å; R283-E291 IonicContact NH1-OE2 3.46Å; R283-E291 PolarHBondContact NH1-OE2 3.37Å; R283-E291 IonicContact NH2-OE1 2.81Å; R283-E291 IonicContact NH2-OE2 3.9Å; R283-E291 PolarHBondContact NH2-OE2 3.38Å
284	E	86.3	Confident	90.7	Very high	60 Å²	60	68.3 Å²	68.3	28%	0.28	33%	0.328	S	S	.	.			trans	-135.6	111.5	-177.9	-75.9	160.7	-115.8	0	0	110	S280 W286 F310	S280-E284 PolarHBondContact O-N 3.5Å; E284-W286 PolarHBondContact O-N 2.99Å; E284-F310 WeakPolarHBondContact O-CE1 3.35Å
285	N	86.8	Confident	90.7	Very high	83 Å²	83	66.3 Å²	66.3	44%	0.444	32%	0.318	S	S	.	.	S	Bend	trans	-78.6	-7.8	173.9	51.2	49.7	0	0	0	113.2	F281 R314	F281-N285 HydrophobicContact CE1-CB 4.42Å; F281-N285 HydrophobicContact CE2-CB 4.42Å; F281-N285 HydrophobicContact CZ-CB 4.24Å; N285-R314 WeakPolarHBondContact O-CD 3.46Å; N285-R314 PolarHBondContact O-NH1 3.39Å
286	W	88.1	Confident	90.9	Very high	179 Å²	179	67.5 Å²	67.5	68%	0.678	31%	0.314	S	S	*	.	S	Bend	trans	-131	80.9	168	-66.8	96.1	0	0	0	109.3	E284 R314	E284-W286 PolarHBondContact O-N 2.99Å; W286-R314 VanDerWaalsContact CZ3-CZ 3.41Å; W286-R314 VanDerWaalsContact CZ3-NH2 3.3Å
287	P	86.3	Confident	91	Very high	22 Å²	22	73 Å²	73	14%	0.143	34%	0.338	C	S	.	.			trans	-65.8	137.9	-175.1	28.7	-37.3	0	0	0	110.8	E291 L292 F310	P287-E291 HydrophobicContact CB-CB 4.07Å; P287-E291 HydrophobicContact CB-CG 3.72Å; P287-L292 HydrophobicContact CB-CD1 3.89Å; P287-L292 HydrophobicContact CG-CD1 3.83Å; P287-L292 WeakPolarHBondContact O-CD1 3.13Å; P287-F310 HydrophobicContact CB-CE1 4.22Å; P287-F310 HydrophobicContact CB-CZ 4.33Å; P287-F310 VanDerWaalsContact CD-CE1 3.5Å; P287-F310 HydrophobicContact CG-CD1 3.56Å; P287-F310 HydrophobicContact CG-CD2 4.05Å; P287-F310 HydrophobicContact CG-CE1 3.53Å; P287-F310 HydrophobicContact CG-CE2 4.03Å; P287-F310 HydrophobicContact CG-CG 3.82Å; P287-F310 HydrophobicContact CG-CZ 3.78Å
288	A	87.9	Confident	90.9	Very high	50 Å²	50	77.2 Å²	77.2	41%	0.413	36%	0.358	S	S	.	.			trans	-78	162.4	177	0	0	0	0	0	112.2	P290 E291 L292	A288-P290 VanDerWaalsContact C-CD 3.43Å; A288-P290 VanDerWaalsContact C-N 3.33Å; A288-P290 HydrophobicContact CB-CG 4.28Å; A288-P290 VanDerWaalsContact O-N 3.14Å; A288-E291 WeakPolarHBondContact O-CA 3.33Å; A288-E291 PolarHBondContact O-N 3.48Å; A288-L292 WeakPolarHBondContact O-CD1 3.33Å; A288-L292 PolarHBondContact O-N 3.22Å
289	E	88.9	Confident	90.8	Very high	96 Å²	96	71.9 Å²	71.9	45%	0.449	34%	0.339	S	S	.	.	H	α-helix	trans	-48	-38.1	179.8	-71.6	-70.5	114.8	0	0	115.8	L292 K293 R303 R307	E289-L292 PolarHBondContact O-N 3.05Å; E289-K293 PolarHBondContact O-N 3Å; E289-K293 VanDerWaalsContact O-N 3.08Å; E289-R303 VanDerWaalsContact CD-NH2 3.28Å; E289-R303 PolarHBondContact O-NH2 3.49Å; E289-R303 IonicContact OE1-NE 3.26Å; E289-R303 IonicContact OE1-NH2 2.98Å; E289-R303 IonicContact OE2-CZ 2.68Å; E289-R303 VanDerWaalsContact OE2-CZ 3.26Å; E289-R303 IonicContact OE2-NE 2.85Å; E289-R303 PolarHBondContact OE2-NE 2.94Å; E289-R303 IonicContact OE2-NH2 2.69Å; E289-R303 PolarHBondContact OE2-NH2 3.49Å; E289-R307 IonicContact OE1-CZ 2.86Å; E289-R307 IonicContact OE1-NE 3.75Å; E289-R307 IonicContact OE1-NH2 2.67Å; E289-R307 PolarHBondContact OE1-NH2 3.01Å; E289-R307 IonicContact OE2-NH2 3.21Å
290	P	91.2	Very high	90.8	Very high	98 Å²	98	67.7 Å²	67.7	64%	0.636	34%	0.34	S	S	*	.	H	α-helix	trans	-65.8	-40.1	171.8	24.1	-34.5	0	0	0	113.7	A288 L292 K293 R294	A288-P290 VanDerWaalsContact C-CD 3.43Å; A288-P290 VanDerWaalsContact C-N 3.33Å; A288-P290 HydrophobicContact CB-CG 4.28Å; A288-P290 VanDerWaalsContact O-N 3.14Å; P290-L292 VanDerWaalsContact C-N 3.34Å; P290-L292 PolarHBondContact O-N 3.46Å; P290-K293 WeakPolarHBondContact O-CB 3.35Å; P290-K293 PolarHBondContact O-N 2.95Å; P290-K293 VanDerWaalsContact O-N 3.13Å; P290-R294 PolarHBondContact O-N 2.9Å
291	E	91.3	Very high	90.8	Very high	12 Å²	12	68.2 Å²	68.2	6%	0.056	34%	0.342	C	S	.	.	H	α-helix	trans	-68.2	-33.9	175.8	176.6	61.5	-163.7	0	0	111.3	S280 R283 P287 A288 K293 R294 L295	S280-E291 WeakPolarHBondContact CB-OE1 3.34Å; S280-E291 WeakPolarHBondContact OG-CG 3.42Å; S280-E291 PolarHBondContact OG-OE1 3.27Å; R283-E291 IonicContact CZ-OE2 3.78Å; R283-E291 IonicContact NH1-OE1 2.71Å; R283-E291 IonicContact NH1-OE2 3.46Å; R283-E291 PolarHBondContact NH1-OE2 3.37Å; R283-E291 IonicContact NH2-OE1 2.81Å; R283-E291 IonicContact NH2-OE2 3.9Å; R283-E291 PolarHBondContact NH2-OE2 3.38Å; P287-E291 HydrophobicContact CB-CB 4.07Å; P287-E291 HydrophobicContact CB-CG 3.72Å; A288-E291 WeakPolarHBondContact O-CA 3.33Å; A288-E291 PolarHBondContact O-N 3.48Å; E291-K293 VanDerWaalsContact C-N 3.3Å; E291-K293 PolarHBondContact O-N 3.06Å; E291-R294 PolarHBondContact O-N 3.39Å; E291-R294 IonicContact OE1-CZ 2.7Å; E291-R294 IonicContact OE1-NE 3.85Å; E291-R294 PolarHBondContact OE1-NE 3.38Å; E291-R294 IonicContact OE1-NH2 3.3Å; E291-R294 PolarHBondContact OE1-NH2 3.03Å; E291-R294 IonicContact OE2-CZ 2.77Å; E291-R294 IonicContact OE2-NE 3.52Å; E291-R294 PolarHBondContact OE2-NE 2.86Å; E291-R294 IonicContact OE2-NH2 3.2Å; E291-L295 HydrophobicContact CG-CD1 4.11Å; E291-L295 HydrophobicContact CG-CG 4.43Å; E291-L295 VanDerWaalsContact O-CB 3.3Å; E291-L295 WeakPolarHBondContact O-CB 3.31Å; E291-L295 WeakPolarHBondContact O-CG 3.31Å; E291-L295 PolarHBondContact O-N 2.92Å; E291-L295 WeakPolarHBondContact OE1-CG 3.49Å
292	L	92.9	Very high	90.8	Very high	6 Å²	6	70.4 Å²	70.4	3%	0.031	36%	0.359	C	S	.	.	H	α-helix	trans	-61.4	-38.7	169.7	-84.9	77.4	0	0	0	111.8	P287 A288 E289 P290 Q296 R303 I306 R307	P287-L292 HydrophobicContact CB-CD1 3.89Å; P287-L292 HydrophobicContact CG-CD1 3.83Å; P287-L292 WeakPolarHBondContact O-CD1 3.13Å; A288-L292 WeakPolarHBondContact O-CD1 3.33Å; A288-L292 PolarHBondContact O-N 3.22Å; E289-L292 PolarHBondContact O-N 3.05Å; P290-L292 VanDerWaalsContact C-N 3.34Å; P290-L292 PolarHBondContact O-N 3.46Å; L292-Q296 WeakPolarHBondContact O-CB 3.31Å; L292-Q296 PolarHBondContact O-N 2.94Å; L292-R303 HydrophobicContact CD2-CG 3.83Å; L292-I306 HydrophobicContact CG-CG2 4.44Å; L292-R307 HydrophobicContact CD2-CG 3.49Å; L292-R307 VanDerWaalsContact CD2-CG 3.49Å
293	K	92.5	Very high	90.9	Very high	117 Å²	117	68.6 Å²	68.6	51%	0.509	35%	0.346	S	S	.	.	H	α-helix	trans	-67.1	-48.7	176.9	-166.4	-174.6	-175.7	-92.9	0	110.6	E289 P290 E291 L295 Q296 E297	E289-K293 PolarHBondContact O-N 3Å; E289-K293 VanDerWaalsContact O-N 3.08Å; P290-K293 WeakPolarHBondContact O-CB 3.35Å; P290-K293 PolarHBondContact O-N 2.95Å; P290-K293 VanDerWaalsContact O-N 3.13Å; E291-K293 VanDerWaalsContact C-N 3.3Å; E291-K293 PolarHBondContact O-N 3.06Å; K293-L295 VanDerWaalsContact C-N 3.31Å; K293-L295 PolarHBondContact O-N 3.09Å; K293-Q296 WeakPolarHBondContact O-CB 3.49Å; K293-Q296 PolarHBondContact O-N 2.73Å; K293-E297 WeakPolarHBondContact CE-OE1 3.44Å; K293-E297 WeakPolarHBondContact CG-OE1 3.32Å; K293-E297 IonicContact NZ-OE1 2.61Å; K293-E297 PolarHBondContact NZ-OE1 3.21Å; K293-E297 WeakPolarHBondContact O-CG 3.49Å; K293-E297 PolarHBondContact O-N 3.16Å
294	R	95.3	Very high	91.2	Very high	90 Å²	90	66.2 Å²	66.2	34%	0.34	34%	0.344	S	S	.	.	H	α-helix	trans	-58.8	-39.4	176.5	-161.8	-158.3	65.9	66.2	11.1	112.5	P290 E291 E298	P290-R294 PolarHBondContact O-N 2.9Å; E291-R294 PolarHBondContact O-N 3.39Å; E291-R294 IonicContact OE1-CZ 2.7Å; E291-R294 IonicContact OE1-NE 3.85Å; E291-R294 PolarHBondContact OE1-NE 3.38Å; E291-R294 IonicContact OE1-NH2 3.3Å; E291-R294 PolarHBondContact OE1-NH2 3.03Å; E291-R294 IonicContact OE2-CZ 2.77Å; E291-R294 IonicContact OE2-NE 3.52Å; E291-R294 PolarHBondContact OE2-NE 2.86Å; E291-R294 IonicContact OE2-NH2 3.2Å; R294-E298 IonicContact CZ-OE2 3.71Å; R294-E298 IonicContact NH1-OE1 3.8Å; R294-E298 IonicContact NH1-OE2 3.51Å; R294-E298 PolarHBondContact NH1-OE2 3.3Å; R294-E298 IonicContact NH2-OE2 2.77Å; R294-E298 PolarHBondContact NH2-OE2 2.79Å; R294-E298 VanDerWaalsContact O-CB 3.26Å; R294-E298 WeakPolarHBondContact O-CB 3.49Å; R294-E298 PolarHBondContact O-N 3.29Å
295	L	94.3	Very high	91.5	Very high	0 Å²	0	65.1 Å²	65.1	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-71.6	-34.6	173.7	-77.9	170.3	0	0	0	113.2	A276 L277 E291 K293 E297 T299 I306 F310	A276-L295 HydrophobicContact CB-CD2 4.43Å; L277-L295 HydrophobicContact CD2-CD1 4.32Å; L277-L295 HydrophobicContact CD2-CD2 4.36Å; E291-L295 HydrophobicContact CG-CD1 4.11Å; E291-L295 HydrophobicContact CG-CG 4.43Å; E291-L295 VanDerWaalsContact O-CB 3.3Å; E291-L295 WeakPolarHBondContact O-CB 3.31Å; E291-L295 WeakPolarHBondContact O-CG 3.31Å; E291-L295 PolarHBondContact O-N 2.92Å; E291-L295 WeakPolarHBondContact OE1-CG 3.49Å; K293-L295 VanDerWaalsContact C-N 3.31Å; K293-L295 PolarHBondContact O-N 3.09Å; L295-E297 VanDerWaalsContact C-N 3.31Å; L295-T299 HydrophobicContact CD2-CG2 4.46Å; L295-T299 VanDerWaalsContact O-CB 3.28Å; L295-T299 WeakPolarHBondContact O-CB 3.14Å; L295-T299 WeakPolarHBondContact O-CG2 3.43Å; L295-T299 PolarHBondContact O-N 3.06Å; L295-T299 PolarHBondContact O-OG1 3.5Å; L295-I306 HydrophobicContact CB-CD1 3.96Å; L295-I306 HydrophobicContact CB-CG2 4.38Å; L295-I306 HydrophobicContact CD1-CG2 3.93Å; L295-F310 HydrophobicContact CD1-CE2 3.68Å; L295-F310 HydrophobicContact CD1-CZ 3.88Å
296	Q	95.1	Very high	91.8	Very high	79 Å²	79	61.2 Å²	61.2	37%	0.369	32%	0.319	S	S	.	.	H	α-helix	trans	-64.9	-38.6	174.5	175.3	171.8	-9.2	0	0	110.7	L292 K293 G300 I306	L292-Q296 WeakPolarHBondContact O-CB 3.31Å; L292-Q296 PolarHBondContact O-N 2.94Å; K293-Q296 WeakPolarHBondContact O-CB 3.49Å; K293-Q296 PolarHBondContact O-N 2.73Å; Q296-G300 VanDerWaalsContact O-CA 3.32Å; Q296-G300 WeakPolarHBondContact O-CA 3.28Å; Q296-G300 PolarHBondContact O-N 3.24Å; Q296-I306 HydrophobicContact CB-CD1 3.91Å
297	E	93.6	Very high	92.1	Very high	122 Å²	122	56.6 Å²	56.6	57%	0.57	30%	0.301	S	S	*	.	H	α-helix	trans	-69	-50	171.9	-67.7	157.8	179.7	0	0	111.9	K293 L295 T299	K293-E297 WeakPolarHBondContact CE-OE1 3.44Å; K293-E297 WeakPolarHBondContact CG-OE1 3.32Å; K293-E297 IonicContact NZ-OE1 2.61Å; K293-E297 PolarHBondContact NZ-OE1 3.21Å; K293-E297 WeakPolarHBondContact O-CG 3.49Å; K293-E297 PolarHBondContact O-N 3.16Å; L295-E297 VanDerWaalsContact C-N 3.31Å; E297-T299 PolarHBondContact O-N 3.13Å
298	E	93.4	Very high	92.4	Very high	89 Å²	89	62.8 Å²	62.8	42%	0.416	33%	0.326	S	S	.	.	H	α-helix	trans	-66.4	-30.4	-179.4	-178.9	178.9	-155	0	0	114	A276 R294	A276-E298 VanDerWaalsContact CB-CD 3.41Å; A276-E298 HydrophobicContact CB-CG 3.87Å; R294-E298 IonicContact CZ-OE2 3.71Å; R294-E298 IonicContact NH1-OE1 3.8Å; R294-E298 IonicContact NH1-OE2 3.51Å; R294-E298 PolarHBondContact NH1-OE2 3.3Å; R294-E298 IonicContact NH2-OE2 2.77Å; R294-E298 PolarHBondContact NH2-OE2 2.79Å; R294-E298 VanDerWaalsContact O-CB 3.26Å; R294-E298 WeakPolarHBondContact O-CB 3.49Å; R294-E298 PolarHBondContact O-N 3.29Å
299	T	91.1	Very high	92.7	Very high	9 Å²	9	61.9 Å²	61.9	6%	0.055	31%	0.312	C	S	.	.	H	α-helix	trans	-112.3	-15.4	-173	70.4	0	0	0	0	114.8	Q273 A276 L277 L295 E297 L301	Q273-T299 HydrophobicContact CB-CG2 4.36Å; Q273-T299 WeakPolarHBondContact CG-O 3.48Å; Q273-T299 PolarHBondContact NE2-O 3.36Å; A276-T299 HydrophobicContact CB-CG2 3.7Å; L277-T299 HydrophobicContact CG-CG2 4.48Å; L295-T299 HydrophobicContact CD2-CG2 4.46Å; L295-T299 VanDerWaalsContact O-CB 3.28Å; L295-T299 WeakPolarHBondContact O-CB 3.14Å; L295-T299 WeakPolarHBondContact O-CG2 3.43Å; L295-T299 PolarHBondContact O-N 3.06Å; L295-T299 PolarHBondContact O-OG1 3.5Å; E297-T299 PolarHBondContact O-N 3.13Å; T299-L301 PolarHBondContact O-N 2.88Å; T299-L301 WeakPolarHBondContact OG1-CB 3.35Å; T299-L301 PolarHBondContact OG1-N 3.13Å
300	G	91.4	Very high	93	Very high	67 Å²	67	57.4 Å²	57.4	69%	0.691	29%	0.291	S	S	*	.			trans	62.6	14	-172.2	0	0	0	0	0	114.3	Q296	Q296-G300 VanDerWaalsContact O-CA 3.32Å; Q296-G300 WeakPolarHBondContact O-CA 3.28Å; Q296-G300 PolarHBondContact O-N 3.24Å
301	L	92.4	Very high	93.1	Very high	11 Å²	11	55.5 Å²	55.5	6%	0.058	28%	0.28	C	S	.	.			trans	-87.9	149.3	178	-65.3	175.5	0	0	0	111	K269 Q273 L277 T299 D305 I306	K269-L301 HydrophobicContact CD-CD1 3.83Å; K269-L301 HydrophobicContact CD-CD2 4.46Å; K269-L301 HydrophobicContact CG-CD1 4.17Å; K269-L301 HydrophobicContact CG-CD2 4.18Å; Q273-L301 HydrophobicContact CB-CD1 4.24Å; L277-L301 HydrophobicContact CD1-CD1 3.83Å; T299-L301 PolarHBondContact O-N 2.88Å; T299-L301 WeakPolarHBondContact OG1-CB 3.35Å; T299-L301 PolarHBondContact OG1-N 3.13Å; L301-D305 HydrophobicContact CB-CB 4.18Å; L301-I306 HydrophobicContact CB-CD1 4.3Å; L301-I306 HydrophobicContact CB-CG1 3.99Å
302	S	92.9	Very high	93	Very high	55 Å²	55	58.3 Å²	58.3	39%	0.385	30%	0.295	S	S	.	.			trans	-61.2	149.4	175.3	78.9	0	0	0	0	111.5	N304 D305 I306	S302-N304 PolarHBondContact O-N 3.39Å; S302-N304 VanDerWaalsContact O-N 3.11Å; S302-D305 WeakPolarHBondContact O-CA 3.42Å; S302-D305 WeakPolarHBondContact O-CB 3.34Å; S302-D305 PolarHBondContact O-N 2.9Å; S302-D305 VanDerWaalsContact OG-CB 3.3Å; S302-D305 WeakPolarHBondContact OG-CB 3.49Å; S302-D305 PolarHBondContact OG-N 3.33Å; S302-D305 PolarHBondContact OG-OD2 3.02Å; S302-I306 WeakPolarHBondContact O-CG1 3.5Å; S302-I306 PolarHBondContact O-N 2.95Å
303	R	91.9	Very high	93	Very high	53 Å²	53	58.7 Å²	58.7	20%	0.2	30%	0.299	C	S	.	.	H	α-helix	trans	-51.5	-37.2	174.9	-162	170.7	-155.2	71.5	-2.8	112.1	E289 L292 I306 R307	E289-R303 VanDerWaalsContact CD-NH2 3.28Å; E289-R303 PolarHBondContact O-NH2 3.49Å; E289-R303 IonicContact OE1-NE 3.26Å; E289-R303 IonicContact OE1-NH2 2.98Å; E289-R303 IonicContact OE2-CZ 2.68Å; E289-R303 VanDerWaalsContact OE2-CZ 3.26Å; E289-R303 IonicContact OE2-NE 2.85Å; E289-R303 PolarHBondContact OE2-NE 2.94Å; E289-R303 IonicContact OE2-NH2 2.69Å; E289-R303 PolarHBondContact OE2-NH2 3.49Å; L292-R303 HydrophobicContact CD2-CG 3.83Å; R303-I306 PolarHBondContact O-N 3.15Å; R303-R307 WeakPolarHBondContact O-CB 3.39Å; R303-R307 VanDerWaalsContact O-CG 3.27Å; R303-R307 WeakPolarHBondContact O-CG 3.45Å; R303-R307 PolarHBondContact O-N 3.15Å
304	N	92.6	Very high	93	Very high	92 Å²	92	55 Å²	55	49%	0.492	28%	0.282	S	S	.	.	H	α-helix	trans	-75.3	-35.7	178.7	-68.3	-13.6	0	0	0	112.5	S302 I306 R307 K308	S302-N304 PolarHBondContact O-N 3.39Å; S302-N304 VanDerWaalsContact O-N 3.11Å; N304-I306 VanDerWaalsContact C-N 3.28Å; N304-I306 PolarHBondContact O-N 3.31Å; N304-R307 PolarHBondContact O-N 2.81Å; N304-R307 PolarHBondContact OD1-NH1 2.74Å; N304-K308 WeakPolarHBondContact O-CB 3.41Å; N304-K308 PolarHBondContact O-N 2.88Å
305	D	91.8	Very high	92.6	Very high	38 Å²	38	57 Å²	57	20%	0.203	29%	0.29	C	S	.	.	H	α-helix	trans	-61.6	-35.4	170.9	-92.5	-68.3	0	0	0	113.5	K269 L301 S302 W309	K269-D305 WeakPolarHBondContact CE-OD1 3.31Å; K269-D305 PolarHBondContact NZ-O 2.99Å; K269-D305 IonicContact NZ-OD1 3.66Å; K269-D305 PolarHBondContact NZ-OD1 3.37Å; L301-D305 HydrophobicContact CB-CB 4.18Å; S302-D305 WeakPolarHBondContact O-CA 3.42Å; S302-D305 WeakPolarHBondContact O-CB 3.34Å; S302-D305 PolarHBondContact O-N 2.9Å; S302-D305 VanDerWaalsContact OG-CB 3.3Å; S302-D305 WeakPolarHBondContact OG-CB 3.49Å; S302-D305 PolarHBondContact OG-N 3.33Å; S302-D305 PolarHBondContact OG-OD2 3.02Å; D305-W309 VanDerWaalsContact O-CB 3.27Å; D305-W309 WeakPolarHBondContact O-CB 3.35Å; D305-W309 PolarHBondContact O-N 2.82Å; D305-W309 VanDerWaalsContact O-N 3.08Å
306	I	93.7	Very high	92.2	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-72.1	-56.5	176.4	-63.2	164.2	0	0	0	108.7	L277 L292 L295 Q296 L301 S302 R303 N304 K308 W309 F310	L277-I306 HydrophobicContact CD2-CG1 4.28Å; L277-I306 HydrophobicContact CD2-CG2 4.07Å; L292-I306 HydrophobicContact CG-CG2 4.44Å; L295-I306 HydrophobicContact CB-CD1 3.96Å; L295-I306 HydrophobicContact CB-CG2 4.38Å; L295-I306 HydrophobicContact CD1-CG2 3.93Å; Q296-I306 HydrophobicContact CB-CD1 3.91Å; L301-I306 HydrophobicContact CB-CD1 4.3Å; L301-I306 HydrophobicContact CB-CG1 3.99Å; S302-I306 WeakPolarHBondContact O-CG1 3.5Å; S302-I306 PolarHBondContact O-N 2.95Å; R303-I306 PolarHBondContact O-N 3.15Å; N304-I306 VanDerWaalsContact C-N 3.28Å; N304-I306 PolarHBondContact O-N 3.31Å; I306-K308 PolarHBondContact O-N 3.48Å; I306-W309 PolarHBondContact O-N 3.35Å; I306-F310 HydrophobicContact CG2-CD2 3.9Å; I306-F310 HydrophobicContact CG2-CE2 3.89Å; I306-F310 WeakPolarHBondContact O-CD2 3.47Å; I306-F310 PolarHBondContact O-N 3.27Å
307	R	93.3	Very high	91.7	Very high	82 Å²	82	59.5 Å²	59.5	31%	0.309	30%	0.303	S	S	.	.	H	α-helix	trans	-50.4	-43.4	175.7	-72.7	168.7	175.5	177	-5.8	112.4	E152 E289 L292 R303 N304 S311	E152-R307 IonicContact OE1-NH1 3.74Å; E152-R307 PolarHBondContact OE1-NH1 3.47Å; E289-R307 IonicContact OE1-CZ 2.86Å; E289-R307 IonicContact OE1-NE 3.75Å; E289-R307 IonicContact OE1-NH2 2.67Å; E289-R307 PolarHBondContact OE1-NH2 3.01Å; E289-R307 IonicContact OE2-NH2 3.21Å; L292-R307 HydrophobicContact CD2-CG 3.49Å; L292-R307 VanDerWaalsContact CD2-CG 3.49Å; R303-R307 WeakPolarHBondContact O-CB 3.39Å; R303-R307 VanDerWaalsContact O-CG 3.27Å; R303-R307 WeakPolarHBondContact O-CG 3.45Å; R303-R307 PolarHBondContact O-N 3.15Å; N304-R307 PolarHBondContact O-N 2.81Å; N304-R307 PolarHBondContact OD1-NH1 2.74Å; R307-S311 WeakPolarHBondContact O-CB 3.15Å; R307-S311 PolarHBondContact O-N 2.69Å; R307-S311 PolarHBondContact O-OG 3.05Å
308	K	92.8	Very high	91	Very high	152 Å²	152	63.1 Å²	63.1	66%	0.661	31%	0.312	S	S	*	.	H	α-helix	trans	-68	-40.4	177.8	-169.1	174.9	-169	-64.7	0	112.5	N304 I306 S311 D312	N304-K308 WeakPolarHBondContact O-CB 3.41Å; N304-K308 PolarHBondContact O-N 2.88Å; I306-K308 PolarHBondContact O-N 3.48Å; K308-S311 PolarHBondContact O-N 3.47Å; K308-D312 WeakPolarHBondContact O-CB 3.07Å; K308-D312 PolarHBondContact O-N 3.26Å
309	W	94.8	Very high	90.2	Very high	31 Å²	31	62.3 Å²	62.3	12%	0.117	31%	0.312	C	S	.	.	H	α-helix	trans	-68	-39.3	176.9	-176.2	94	0	0	0	112.7	L277 R278 F281 D305 I306 S311 D312 S313	L277-W309 HydrophobicContact CB-CD2 4.01Å; L277-W309 HydrophobicContact CB-CE3 3.8Å; L277-W309 HydrophobicContact CB-CH2 3.74Å; L277-W309 HydrophobicContact CB-CZ2 3.92Å; L277-W309 HydrophobicContact CB-CZ3 3.67Å; L277-W309 HydrophobicContact CD1-CD2 3.86Å; L277-W309 HydrophobicContact CD1-CE3 4.31Å; L277-W309 HydrophobicContact CD1-CG 3.92Å; L277-W309 HydrophobicContact CD2-CD2 4.44Å; L277-W309 HydrophobicContact CD2-CE3 4.12Å; L277-W309 HydrophobicContact CG-CD2 4.34Å; L277-W309 HydrophobicContact CG-CE3 4.3Å; L277-W309 WeakPolarHBondContact O-CZ3 3.48Å; R278-W309 HydrophobicContact CG-CH2 3.9Å; R278-W309 HydrophobicContact CG-CZ2 3.98Å; F281-W309 HydrophobicContact CB-CH2 4.22Å; F281-W309 HydrophobicContact CB-CZ3 3.99Å; F281-W309 AromaticContact CD2-CZ3 3.97Å; F281-W309 HydrophobicContact CD2-CZ3 3.97Å; F281-W309 HydrophobicContact CG-CZ3 4.28Å; D305-W309 VanDerWaalsContact O-CB 3.27Å; D305-W309 WeakPolarHBondContact O-CB 3.35Å; D305-W309 PolarHBondContact O-N 2.82Å; D305-W309 VanDerWaalsContact O-N 3.08Å; I306-W309 PolarHBondContact O-N 3.35Å; W309-S311 VanDerWaalsContact C-N 3.34Å; W309-D312 PolarHBondContact O-N 3.27Å; W309-S313 WeakPolarHBondContact CH2-OG 3.47Å; W309-S313 WeakPolarHBondContact CZ2-OG 3.37Å; W309-S313 WeakPolarHBondContact CZ3-OG 3.33Å; W309-S313 VanDerWaalsContact O-CB 3.3Å; W309-S313 WeakPolarHBondContact O-CB 3.46Å; W309-S313 PolarHBondContact O-N 3.22Å; W309-S313 PolarHBondContact O-OG 3.49Å
310	F	94.8	Very high	88.9	Confident	2 Å²	2	65 Å²	65	1%	0.009	34%	0.342	C	S	.	.	H	α-helix	trans	-65.5	-39.1	173.9	-87.4	-97.8	0	0	0	111.7	L277 F281 E284 P287 L295 I306 S313 R314	L277-F310 HydrophobicContact CD2-CD2 4.36Å; L277-F310 HydrophobicContact CD2-CE2 3.74Å; F281-F310 HydrophobicContact CB-CE1 3.87Å; F281-F310 HydrophobicContact CB-CZ 4.34Å; F281-F310 AromaticContact CD2-CD1 3.5Å; F281-F310 HydrophobicContact CD2-CD1 3.5Å; F281-F310 VanDerWaalsContact CD2-CD1 3.5Å; F281-F310 AromaticContact CD2-CE1 3.74Å; F281-F310 HydrophobicContact CD2-CE1 3.74Å; F281-F310 HydrophobicContact CD2-CG 4.31Å; F281-F310 HydrophobicContact CE2-CD1 4.19Å; F281-F310 HydrophobicContact CG-CD1 4.43Å; F281-F310 HydrophobicContact CG-CE1 4.25Å; E284-F310 WeakPolarHBondContact O-CE1 3.35Å; P287-F310 HydrophobicContact CB-CE1 4.22Å; P287-F310 HydrophobicContact CB-CZ 4.33Å; P287-F310 VanDerWaalsContact CD-CE1 3.5Å; P287-F310 HydrophobicContact CG-CD1 3.56Å; P287-F310 HydrophobicContact CG-CD2 4.05Å; P287-F310 HydrophobicContact CG-CE1 3.53Å; P287-F310 HydrophobicContact CG-CE2 4.03Å; P287-F310 HydrophobicContact CG-CG 3.82Å; P287-F310 HydrophobicContact CG-CZ 3.78Å; L295-F310 HydrophobicContact CD1-CE2 3.68Å; L295-F310 HydrophobicContact CD1-CZ 3.88Å; I306-F310 HydrophobicContact CG2-CD2 3.9Å; I306-F310 HydrophobicContact CG2-CE2 3.89Å; I306-F310 WeakPolarHBondContact O-CD2 3.47Å; I306-F310 PolarHBondContact O-N 3.27Å; F310-S313 PolarHBondContact O-N 3.16Å; F310-R314 WeakPolarHBondContact O-CG 3.33Å; F310-R314 PolarHBondContact O-N 3.27Å
311	S	93	Very high	87.4	Confident	58 Å²	58	71.3 Å²	71.3	41%	0.406	35%	0.345	S	S	.	.	H	α-helix	trans	-65.3	-43.8	176.3	-58.4	0	0	0	0	112.6	R307 K308 W309 R314 Y315	R307-S311 WeakPolarHBondContact O-CB 3.15Å; R307-S311 PolarHBondContact O-N 2.69Å; R307-S311 PolarHBondContact O-OG 3.05Å; K308-S311 PolarHBondContact O-N 3.47Å; W309-S311 VanDerWaalsContact C-N 3.34Å; S311-R314 PolarHBondContact O-N 3.28Å; S311-R314 PolarHBondContact OG-NH2 3.05Å; S311-Y315 PolarHBondContact O-N 3.27Å
312	D	90.1	Very high	85.6	Confident	71 Å²	71	71.8 Å²	71.8	38%	0.38	35%	0.352	S	S	.	.	H	α-helix	trans	-62.9	-44.3	172.9	-176.8	22.1	0	0	0	111.6	K308 W309 R314 Y315 Q316	K308-D312 WeakPolarHBondContact O-CB 3.07Å; K308-D312 PolarHBondContact O-N 3.26Å; W309-D312 PolarHBondContact O-N 3.27Å; D312-R314 PolarHBondContact O-N 2.68Å; D312-Y315 CarbonylContact O-C 3.56Å; D312-Y315 WeakPolarHBondContact O-CA 3.33Å; D312-Y315 WeakPolarHBondContact O-CB 3.19Å; D312-Y315 PolarHBondContact O-N 2.89Å; D312-Q316 WeakPolarHBondContact O-CG 3.1Å; D312-Q316 PolarHBondContact O-N 2.78Å; D312-Q316 PolarHBondContact OD1-NE2 3.31Å; D312-Q316 PolarHBondContact OD2-NE2 3.32Å; D312-Q316 VanDerWaalsContact OD2-NE2 3.08Å
313	S	92.4	Very high	83.8	Confident	15 Å²	15	75 Å²	75	11%	0.105	38%	0.375	C	S	.	.	H	α-helix	trans	-62.9	-40.3	177.3	-61.4	0	0	0	0	112.8	W309 F310 Y315 Q316 L317	W309-S313 WeakPolarHBondContact CH2-OG 3.47Å; W309-S313 WeakPolarHBondContact CZ2-OG 3.37Å; W309-S313 WeakPolarHBondContact CZ3-OG 3.33Å; W309-S313 VanDerWaalsContact O-CB 3.3Å; W309-S313 WeakPolarHBondContact O-CB 3.46Å; W309-S313 PolarHBondContact O-N 3.22Å; W309-S313 PolarHBondContact O-OG 3.49Å; F310-S313 PolarHBondContact O-N 3.16Å; S313-Y315 VanDerWaalsContact C-N 3.34Å; S313-Q316 PolarHBondContact O-N 3.29Å; S313-L317 WeakPolarHBondContact O-CB 3.29Å; S313-L317 PolarHBondContact O-N 3.12Å
314	R	92.4	Very high	82.1	Confident	39 Å²	39	74.6 Å²	74.6	15%	0.147	38%	0.376	C	S	.	.	H	α-helix	trans	-62.9	-38	170.7	-73.7	-173.4	-63.5	-100	2.9	112.3	F281 N285 W286 F310 S311 D312 R318	F281-R314 HydrophobicContact CE2-CG 3.92Å; F281-R314 HydrophobicContact CZ-CG 4.06Å; N285-R314 WeakPolarHBondContact O-CD 3.46Å; N285-R314 PolarHBondContact O-NH1 3.39Å; W286-R314 VanDerWaalsContact CZ3-CZ 3.41Å; W286-R314 VanDerWaalsContact CZ3-NH2 3.3Å; F310-R314 WeakPolarHBondContact O-CG 3.33Å; F310-R314 PolarHBondContact O-N 3.27Å; S311-R314 PolarHBondContact O-N 3.28Å; S311-R314 PolarHBondContact OG-NH2 3.05Å; D312-R314 PolarHBondContact O-N 2.68Å; R314-R318 PolarHBondContact O-N 3.2Å; R314-R318 VanDerWaalsContact O-N 3.15Å
315	Y	87.6	Confident	80	Confident	133 Å²	133	72.6 Å²	72.6	52%	0.522	37%	0.373	S	S	.	.	H	α-helix	trans	-67.4	-46.7	176.3	177.9	-102.7	0	0	0	111.9	S311 D312 S313 L317 R318 V319	S311-Y315 PolarHBondContact O-N 3.27Å; D312-Y315 CarbonylContact O-C 3.56Å; D312-Y315 WeakPolarHBondContact O-CA 3.33Å; D312-Y315 WeakPolarHBondContact O-CB 3.19Å; D312-Y315 PolarHBondContact O-N 2.89Å; S313-Y315 VanDerWaalsContact C-N 3.34Å; Y315-L317 VanDerWaalsContact C-N 3.28Å; Y315-L317 PolarHBondContact O-N 2.81Å; Y315-R318 PolarHBondContact O-N 2.93Å; Y315-R318 VanDerWaalsContact O-N 3.15Å; Y315-V319 HydrophobicContact CD1-CG2 4.35Å; Y315-V319 HydrophobicContact CD2-CG2 4.15Å; Y315-V319 HydrophobicContact CE1-CG2 4Å; Y315-V319 HydrophobicContact CE2-CG2 3.79Å; Y315-V319 HydrophobicContact CG-CG2 4.41Å; Y315-V319 WeakPolarHBondContact O-CB 3.43Å; Y315-V319 WeakPolarHBondContact O-CG2 3.18Å; Y315-V319 PolarHBondContact O-N 2.67Å
316	Q	86.3	Confident	77.7	Confident	75 Å²	75	74.9 Å²	74.9	35%	0.35	40%	0.397	S	S	.	.	H	α-helix	trans	-62.1	-33.8	177.2	-69.2	175.4	31.2	0	0	112.9	D312 S313 G320 R321 G322	D312-Q316 WeakPolarHBondContact O-CG 3.1Å; D312-Q316 PolarHBondContact O-N 2.78Å; D312-Q316 PolarHBondContact OD1-NE2 3.31Å; D312-Q316 PolarHBondContact OD2-NE2 3.32Å; D312-Q316 VanDerWaalsContact OD2-NE2 3.08Å; S313-Q316 PolarHBondContact O-N 3.29Å; Q316-G320 PolarHBondContact O-N 3.35Å; Q316-R321 PolarHBondContact O-N 2.93Å; Q316-G322 PolarHBondContact O-N 2.87Å
317	L	83	Confident	75.3	Confident	56 Å²	56	77.2 Å²	77.2	29%	0.293	42%	0.417	S	S	.	.	H	α-helix	trans	-63.7	-51.1	171.2	-176.9	63.6	0	0	0	110.9	S313 Y315 V319 G320 A325	S313-L317 WeakPolarHBondContact O-CB 3.29Å; S313-L317 PolarHBondContact O-N 3.12Å; Y315-L317 VanDerWaalsContact C-N 3.28Å; Y315-L317 PolarHBondContact O-N 2.81Å; L317-V319 VanDerWaalsContact C-N 3.29Å; L317-V319 PolarHBondContact O-N 2.88Å; L317-G320 PolarHBondContact O-N 2.96Å; L317-G320 VanDerWaalsContact O-N 3.16Å; L317-A325 HydrophobicContact CD1-CB 3.93Å
318	R	79.3	Confident	73.2	Confident	198 Å²	198	77.6 Å²	77.6	75%	0.747	42%	0.422	S	S	*	.	H	α-helix	trans	-60.6	-35.1	178.3	-169	-170.6	-62.1	135.8	-1.2	113.2	R314 Y315 G320	R314-R318 PolarHBondContact O-N 3.2Å; R314-R318 VanDerWaalsContact O-N 3.15Å; Y315-R318 PolarHBondContact O-N 2.93Å; Y315-R318 VanDerWaalsContact O-N 3.15Å; R318-G320 VanDerWaalsContact C-N 3.28Å; R318-G320 PolarHBondContact O-N 2.86Å
319	V	76.6	Confident	70.8	Confident	71 Å²	71	75.6 Å²	75.6	43%	0.43	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	2.6	-178.1	178.9	0	0	0	0	112.3	Y315 L317 R321	Y315-V319 HydrophobicContact CD1-CG2 4.35Å; Y315-V319 HydrophobicContact CD2-CG2 4.15Å; Y315-V319 HydrophobicContact CE1-CG2 4Å; Y315-V319 HydrophobicContact CE2-CG2 3.79Å; Y315-V319 HydrophobicContact CG-CG2 4.41Å; Y315-V319 WeakPolarHBondContact O-CB 3.43Å; Y315-V319 WeakPolarHBondContact O-CG2 3.18Å; Y315-V319 PolarHBondContact O-N 2.67Å; L317-V319 VanDerWaalsContact C-N 3.29Å; L317-V319 PolarHBondContact O-N 2.88Å; V319-R321 HydrophobicContact CG1-CG 3.99Å; V319-R321 PolarHBondContact O-N 2.77Å
320	G	64.1	Low	68.3	Low	66 Å²	66	82.6 Å²	82.6	68%	0.68	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.7	25.5	178.6	0	0	0	0	0	113.6	Q316 L317 R318	Q316-G320 PolarHBondContact O-N 3.35Å; L317-G320 PolarHBondContact O-N 2.96Å; L317-G320 VanDerWaalsContact O-N 3.16Å; R318-G320 VanDerWaalsContact C-N 3.28Å; R318-G320 PolarHBondContact O-N 2.86Å
321	R	60.3	Low	65.7	Low	200 Å²	200	87.2 Å²	87.2	76%	0.755	49%	0.486	S	S	*	.			trans	-104.2	-20.4	179.9	-76.5	-74.2	-169	-116.4	2.3	113	Q316 V319	Q316-R321 PolarHBondContact O-N 2.93Å; V319-R321 HydrophobicContact CG1-CG 3.99Å; V319-R321 PolarHBondContact O-N 2.77Å
322	G	54.6	Low	63	Low	20 Å²	20	92.8 Å²	92.8	21%	0.206	51%	0.506	C	S	.	.			trans	-79.9	122.1	-178.6	0	0	0	0	0	113.4	Q316 L324	Q316-G322 PolarHBondContact O-N 2.87Å; G322-L324 PolarHBondContact O-N 2.94Å
323	S	55	Low	60.6	Low	124 Å²	124	98.4 Å²	98.4	87%	0.867	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	6.3	173.2	-168.2	0	0	0	0	114.7
324	L	55.2	Low	57.8	Low	43 Å²	43	102.3 Å²	102.3	23%	0.225	56%	0.563	C	S	.	*	T	Hydrogen-bonded Turn	trans	-87.9	-18.6	-175.9	-122.2	79.4	0	0	0	114	R278 F281 L282 G322 A326 A327	R278-L324 HydrophobicContact CG-CD1 4.24Å; F281-L324 HydrophobicContact CD1-CD2 3.47Å; F281-L324 VanDerWaalsContact CD1-CD2 3.47Å; F281-L324 HydrophobicContact CE1-CD2 3.97Å; F281-L324 HydrophobicContact CG-CD2 4.34Å; L282-L324 HydrophobicContact CD2-CD2 4.14Å; L282-L324 HydrophobicContact CD2-CG 4.39Å; L282-L324 HydrophobicContact CG-CD2 4.44Å; G322-L324 PolarHBondContact O-N 2.94Å; L324-A326 VanDerWaalsContact C-N 3.26Å; L324-A326 PolarHBondContact O-N 2.95Å; L324-A327 PolarHBondContact O-N 3.42Å
325	A	49.6	Very low	55.1	Low	50 Å²	50	105.8 Å²	105.8	41%	0.413	59%	0.593	S	S	.	*	G	3₁₀ helix	trans	-61.7	-32.6	-174.1	0	0	0	0	0	113.2	L317 A327 Q328	L317-A325 HydrophobicContact CD1-CB 3.93Å; A325-A327 PolarHBondContact O-N 3.2Å; A325-Q328 PolarHBondContact O-N 3.19Å
326	A	42.6	Very low	52.6	Low	87 Å²	87	106.9 Å²	106.9	72%	0.719	61%	0.613	S	S	*	*	G	3₁₀ helix	trans	-68.5	-12.9	-178.3	0	0	0	0	0	114.7	L324	L324-A326 VanDerWaalsContact C-N 3.26Å; L324-A326 PolarHBondContact O-N 2.95Å
327	A	42.9	Very low	49.8	Very low	49 Å²	49	107 Å²	107	41%	0.405	64%	0.635	S	S	.	*	G	3₁₀ helix	trans	-90.5	-12.4	179.4	0	0	0	0	0	113.8	L282 L324 A325 T329	L282-A327 HydrophobicContact CD2-CB 4.1Å; L324-A327 PolarHBondContact O-N 3.42Å; A325-A327 PolarHBondContact O-N 3.2Å; A327-T329 VanDerWaalsContact C-N 3.25Å; A327-T329 PolarHBondContact O-N 2.61Å
328	Q	50.4	Low	47.2	Very low	89 Å²	89	109.3 Å²	109.3	42%	0.416	66%	0.656	S	S	.	*	G	3₁₀ helix	trans	-74.5	-12.2	-170.7	-64.6	-178.1	-7.9	0	0	113.8	A325 F330	A325-Q328 PolarHBondContact O-N 3.19Å; Q328-F330 VanDerWaalsContact C-N 3.27Å; Q328-F330 PolarHBondContact O-N 3.04Å
329	T	41	Very low	44.7	Very low	111 Å²	111	109.6 Å²	109.6	68%	0.681	66%	0.662	S	S	*	*	G	3₁₀ helix	trans	-71.3	-14.2	-177.6	49.8	0	0	0	0	114.8	A327	A327-T329 VanDerWaalsContact C-N 3.25Å; A327-T329 PolarHBondContact O-N 2.61Å
330	F	43.4	Very low	42.4	Very low	177 Å²	177	113.1 Å²	113.1	78%	0.776	67%	0.674	S	S	*	*	G	3₁₀ helix	trans	-91	-14.7	-177.3	-73.7	-83.1	0	0	0	114.8	Q328 H332	Q328-F330 VanDerWaalsContact C-N 3.27Å; Q328-F330 PolarHBondContact O-N 3.04Å; F330-H332 VanDerWaalsContact C-N 3.32Å; F330-H332 PolarHBondContact O-N 3.06Å
331	S	39.3	Very low	40.7	Very low	99 Å²	99	117.3 Å²	117.3	69%	0.692	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	-0.9	-171.3	-164.6	0	0	0	0	115.4
332	H	36.8	Very low	39.9	Very low	176 Å²	176	112.2 Å²	112.2	82%	0.815	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.8	11.6	-173.5	-79.3	-65.1	0	0	0	114.8	F330	F330-H332 VanDerWaalsContact C-N 3.32Å; F330-H332 PolarHBondContact O-N 3.06Å
333	Q	39.3	Very low	38.7	Very low	189 Å²	189	119.6 Å²	119.6	88%	0.883	70%	0.698	S	S	*	*	S	Bend	trans	-127.6	48.6	-174.5	-159.8	164.3	72.2	0	0	113
334	A	34.3	Very low	37.5	Very low	97 Å²	97	119 Å²	119	80%	0.802	69%	0.694	S	S	*	*			trans	-147.8	52	-179.7	0	0	0	0	0	113.1
335	S	35.4	Very low	36.3	Very low	112 Å²	112	125.2 Å²	125.2	78%	0.783	72%	0.721	S	S	*	*			trans	-154.2	37.1	-178.9	73.5	0	0	0	0	116.4
336	V	35.4	Very low	35.3	Very low	155 Å²	155	129 Å²	129	94%	0.939	74%	0.739	S	S	*	*			trans	-140.6	119.2	166.2	-169.9	0	0	0	0	110.6
337	G	28.1	Very low	34.5	Very low	78 Å²	78	133 Å²	133	80%	0.804	74%	0.743	S	S	*	*			trans	153.2	130.8	179.2	0	0	0	0	0	109.6
338	S	26.8	Very low	34.5	Very low	104 Å²	104	135.3 Å²	135.3	73%	0.727	75%	0.754	S	S	*	*			cis	-139.4	152.3	3.7	-177.9	0	0	0	0	111.5
339	K	27.6	Very low	33.4	Very low	204 Å²	204	138.2 Å²	138.2	89%	0.887	77%	0.772	S	S	*	*			trans	-153.8	105.3	157.5	-149.9	172.8	-174.2	179.5	0	110.7
340	H	29	Very low	32.9	Very low	145 Å²	145	137.9 Å²	137.9	67%	0.671	77%	0.774	S	S	*	*			trans	-59.9	159	162.6	-76.8	-110.7	0	0	0	110.1
341	E	28	Very low	32	Very low	154 Å²	154	136.9 Å²	136.9	72%	0.72	78%	0.776	S	S	*	*			cis	-171	-171.1	-10.7	-118	-171.5	85.1	0	0	105.8
342	P	44	Very low	31.6	Very low	94 Å²	94	137.6 Å²	137.6	61%	0.61	78%	0.777	S	S	*	*			cis	-127.8	-170.7	-44	32.1	-13.5	0	0	0	113.1
343	Q	28.6	Very low	31.3	Very low	175 Å²	175	135.5 Å²	135.5	82%	0.818	77%	0.771	S	S	*	*			trans	100.4	144.1	137.9	-151.6	165.3	9.4	0	0	120.3
344	S	30	Very low	30.9	Very low	112 Å²	112	135.5 Å²	135.5	78%	0.783	77%	0.771	S	S	*	*			trans	72	135.1	-178.5	77	0	0	0	0	116.3
345	Q	29.6	Very low	30.8	Very low	172 Å²	172	139.9 Å²	139.9	80%	0.804	77%	0.772	S	S	*	*			cis	-161	151.6	-14.1	-173.8	165.7	2.2	0	0	111.6
346	T	29.5	Very low	30.5	Very low	129 Å²	129	139.8 Å²	139.8	79%	0.791	77%	0.772	S	S	*	*			trans	66.4	121.6	162	36.5	0	0	0	0	122.8
347	Q	26.1	Very low	30.3	Very low	172 Å²	172	142.4 Å²	142.4	80%	0.804	77%	0.765	S	S	*	*			trans	-125.2	177.1	150.4	-93.1	-95.8	18.4	0	0	105.1
348	P	43	Very low	30.5	Very low	97 Å²	97	145.5 Å²	145.5	63%	0.63	76%	0.758	S	S	*	*			cis	-142.1	-166.8	-3.8	33.1	-8	0	0	0	116.1
349	L	27.4	Very low	30.7	Very low	150 Å²	150	146.7 Å²	146.7	79%	0.785	76%	0.761	S	S	*	*			trans	74.2	108.9	151.6	-59.5	-167.3	0	0	0	124.1
350	S	29.3	Very low	30.7	Very low	105 Å²	105	144.2 Å²	144.2	73%	0.734	76%	0.757	S	S	*	*				41.1	137.3	111.6	-50.9	0	0	0	0	124.2
351	L	25.6	Very low	30.7	Very low	156 Å²	156	140.6 Å²	140.6	82%	0.817	76%	0.76	S	S	*	*				175.4	134.7	120.8	-94.8	163.3	0	0	0	115.4
352	T	30.1	Very low	30.8	Very low	114 Å²	114	140.7 Å²	140.7	70%	0.699	77%	0.77	S	S	*	*			trans	41.5	148.7	131.1	-125.2	0	0	0	0	121.6
353	N	29.8	Very low	30.4	Very low	132 Å²	132	145.5 Å²	145.5	71%	0.706	78%	0.782	S	S	*	*			cis	-169.2	176.2	-1.5	-148.5	-54	0	0	0	110.8
354	Q	30.7	Very low	30.4	Very low	188 Å²	188	143.3 Å²	143.3	88%	0.879	79%	0.785	S	S	*	*			trans	155.1	165.9	137.2	-80.6	-159.9	50	0	0	115.5
355	K	33.3	Very low	30.6	Very low	189 Å²	189	145.8 Å²	145.8	82%	0.822	78%	0.784	S	S	*	*			trans	-161.9	136.4	-145.6	164.2	-171.5	170.5	-174.5	0	117.5
356	S	29.5	Very low	30.6	Very low	111 Å²	111	145.8 Å²	145.8	78%	0.776	78%	0.784	S	S	*	*			trans	179.9	143.4	148.9	38	0	0	0	0	109.7
357	R	31.2	Very low	30.5	Very low	210 Å²	210	142.8 Å²	142.8	79%	0.792	78%	0.779	S	S	*	*			cis	79.7	124.1	47.9	-95.7	-152.9	168.2	-158.3	8.8	114
358	Q	32	Very low	30.9	Very low	142 Å²	142	140 Å²	140	66%	0.664	78%	0.779	S	S	*	*			cis	-124.7	-123.5	-8.4	-71.9	173.1	-133.9	0	0	112.2
359	V	30.7	Very low	30.5	Very low	129 Å²	129	147.1 Å²	147.1	78%	0.782	79%	0.793	S	S	*	*			cis	-147.9	174.5	9.3	178.9	0	0	0	0	109.7
360	N	28	Very low	30.8	Very low	152 Å²	152	147.3 Å²	147.3	81%	0.813	80%	0.795	S	S	*	*			trans	-54.3	160.6	178.5	-51.6	-10.6	0	0	0	116.2
361	G	29.6	Very low	31.1	Very low	70 Å²	70	150 Å²	150	72%	0.722	80%	0.801	S	S	*	*			cis	161.7	-178.2	-5.5	0	0	0	0	0	114.5
362	V	29.3	Very low	31.5	Very low	156 Å²	156	145.1 Å²	145.1	95%	0.945	79%	0.788	S	S	*	*			trans	86.6	132.3	171.6	-169.4	0	0	0	0	119.2
363	K	36.1	Very low	32.5	Very low	195 Å²	195	147.8 Å²	147.8	85%	0.848	80%	0.796	S	S	*	*			trans	-65.2	155.6	-166.6	-58.9	168	173.1	177.3	0	118.3
364	S	29	Very low	33.3	Very low	128 Å²	128	151.7 Å²	151.7	90%	0.895	80%	0.801	S	S	*	*				-148.1	150.1	118.1	-83.5	0	0	0	0	111.3
365	H	32.7	Very low	33.8	Very low	165 Å²	165	148.4 Å²	148.4	76%	0.764	79%	0.789	S	S	*	*			trans	-97.9	152.7	172.1	-151.5	-120.6	0	0	0	106.1
366	E	29.5	Very low	34.5	Very low	171 Å²	171	143.6 Å²	143.6	80%	0.799	78%	0.78	S	S	*	*				179.4	152.9	50.2	-177.8	154.1	-126.1	0	0	107
367	G	28.7	Very low	35.3	Very low	66 Å²	66	145 Å²	145	68%	0.68	77%	0.774	S	S	*	*			cis	-169.2	126.4	-12.8	0	0	0	0	0	108.6
368	S	32.9	Very low	36.2	Very low	115 Å²	115	141.8 Å²	141.8	80%	0.804	77%	0.766	S	S	*	*			trans	-124	100.7	-177.6	-169.6	0	0	0	0	110.4
369	R	35.8	Very low	36.7	Very low	245 Å²	245	140.9 Å²	140.9	93%	0.925	76%	0.76	S	S	*	*			trans	-95.6	97	-176.2	-89.9	-177.6	150.3	169.2	-6.2	111.5	N371	R369-N371 PolarHBondContact O-N 2.85Å
370	N	34.1	Very low	37.5	Very low	154 Å²	154	141 Å²	141	82%	0.824	75%	0.752	S	S	*	*			trans	-64.5	114.2	161.7	-75.3	-35.3	0	0	0	110.2
371	N	35.3	Very low	38.4	Very low	163 Å²	163	136.6 Å²	136.6	87%	0.872	73%	0.731	S	S	*	*			trans	-124	133.8	150	-89.3	-26.1	0	0	0	105.5	R369	R369-N371 PolarHBondContact O-N 2.85Å
372	G	34.3	Very low	39.5	Very low	52 Å²	52	139.2 Å²	139.2	54%	0.536	72%	0.722	S	S	.	*			cis	137	78.1	17.8	0	0	0	0	0	106.4	R374	G372-R374 PolarHBondContact O-N 2.71Å
373	I	49.5	Very low	40.3	Very low	170 Å²	170	137.8 Å²	137.8	87%	0.872	71%	0.708	S	S	*	*			trans	-72.1	95.5	-165.4	-58.9	167.4	0	0	0	109.6
374	R	47.8	Very low	40.4	Very low	215 Å²	215	131.6 Å²	131.6	81%	0.811	69%	0.69	S	S	*	*			trans	-102.8	3.1	-179.5	-68	-169.1	-67.7	169.7	0.5	114.5	G372	G372-R374 PolarHBondContact O-N 2.71Å
375	N	41.9	Very low	40.8	Very low	118 Å²	118	130.2 Å²	130.2	63%	0.631	67%	0.672	S	S	*	*	H	α-helix	trans	-93.4	6	-168.4	-64.2	5.5	0	0	0	114.9	F379	N375-F379 WeakPolarHBondContact O-CD2 3.42Å
376	S	46.9	Very low	41.2	Very low	88 Å²	88	125.9 Å²	125.9	62%	0.615	66%	0.661	S	S	*	*	H	α-helix	trans	-76.9	-51.7	176.3	-158.4	0	0	0	0	111.7	Q380	S376-Q380 PolarHBondContact O-N 2.83Å
377	H	46.2	Very low	41.7	Very low	142 Å²	142	125.4 Å²	125.4	66%	0.657	66%	0.663	S	S	*	*	H	α-helix	trans	-68.2	-41.6	-172.8	-163.8	-61.4	0	0	0	112.9	F379 Q380 T381	H377-F379 PolarHBondContact O-N 3.03Å; H377-Q380 PolarHBondContact O-N 3.49Å; H377-Q380 VanDerWaalsContact O-N 3.12Å; H377-T381 PolarHBondContact CE1-OG1 2.82Å; H377-T381 PolarHBondContact ND1-OG1 3.08Å; H377-T381 PolarHBondContact O-N 3.34Å; H377-T381 PolarHBondContact O-OG1 2.82Å
378	F	50.5	Low	42.5	Very low	142 Å²	142	129 Å²	129	62%	0.623	66%	0.662	S	S	*	*	H	α-helix	trans	-59.6	-43.8	-178.5	-178.6	-97.5	0	0	0	112.6	Q380 F382	F378-Q380 VanDerWaalsContact C-N 3.33Å; F378-Q380 PolarHBondContact O-N 2.94Å; F378-F382 VanDerWaalsContact O-CB 3.31Å; F378-F382 WeakPolarHBondContact O-CB 3.34Å; F378-F382 PolarHBondContact O-N 3.49Å
379	F	42.1	Very low	42.6	Very low	123 Å²	123	127.3 Å²	127.3	54%	0.539	66%	0.655	S	S	.	*	H	α-helix	trans	-70.2	-29.3	176.8	-84	-89.6	0	0	0	112.9	N375 H377 L383	N375-F379 WeakPolarHBondContact O-CD2 3.42Å; H377-F379 PolarHBondContact O-N 3.03Å; F379-L383 VanDerWaalsContact O-CG 3.31Å; F379-L383 WeakPolarHBondContact O-CG 3.36Å; F379-L383 PolarHBondContact O-N 3.06Å
380	Q	48.1	Very low	42.6	Very low	132 Å²	132	126.2 Å²	126.2	62%	0.617	66%	0.657	S	S	*	*	H	α-helix	trans	-70.7	-47.9	176.8	-162.4	159.3	4.2	0	0	110.9	S376 H377 F378 F382 L383 S384	S376-Q380 PolarHBondContact O-N 2.83Å; H377-Q380 PolarHBondContact O-N 3.49Å; H377-Q380 VanDerWaalsContact O-N 3.12Å; F378-Q380 VanDerWaalsContact C-N 3.33Å; F378-Q380 PolarHBondContact O-N 2.94Å; Q380-F382 PolarHBondContact O-N 2.95Å; Q380-L383 PolarHBondContact O-N 3.43Å; Q380-S384 PolarHBondContact O-N 3.28Å; Q380-S384 VanDerWaalsContact O-N 3.16Å; Q380-S384 PolarHBondContact O-OG 3.42Å
381	T	45.8	Very low	42.8	Very low	59 Å²	59	122.6 Å²	122.6	36%	0.362	66%	0.656	S	S	.	*	H	α-helix	trans	-61.3	-42.7	173.5	-49.4	0	0	0	0	112.1	H377 L383 S384 N385	H377-T381 PolarHBondContact CE1-OG1 2.82Å; H377-T381 PolarHBondContact ND1-OG1 3.08Å; H377-T381 PolarHBondContact O-N 3.34Å; H377-T381 PolarHBondContact O-OG1 2.82Å; T381-L383 VanDerWaalsContact C-N 3.26Å; T381-L383 PolarHBondContact O-N 2.97Å; T381-S384 PolarHBondContact O-N 3.01Å; T381-N385 WeakPolarHBondContact CG2-OD1 3.41Å; T381-N385 PolarHBondContact O-N 2.86Å; T381-N385 PolarHBondContact O-OD1 3.41Å
382	F	52.6	Low	42.5	Very low	124 Å²	124	123.8 Å²	123.8	54%	0.544	66%	0.656	S	S	.	*	H	α-helix	trans	-60.1	-34.6	178.4	-176.2	-96.3	0	0	0	113.1	F378 Q380 S386	F378-F382 VanDerWaalsContact O-CB 3.31Å; F378-F382 WeakPolarHBondContact O-CB 3.34Å; F378-F382 PolarHBondContact O-N 3.49Å; Q380-F382 PolarHBondContact O-N 2.95Å; F382-S386 WeakPolarHBondContact O-CB 3.46Å; F382-S386 PolarHBondContact O-N 3Å; F382-S386 PolarHBondContact O-OG 3.25Å
383	L	46.2	Very low	42.3	Very low	126 Å²	126	130.2 Å²	130.2	66%	0.66	67%	0.67	S	S	*	*	H	α-helix	trans	-79.5	-29.4	178.1	-71.1	172.8	0	0	0	113.5	F379 Q380 T381	F379-L383 VanDerWaalsContact O-CG 3.31Å; F379-L383 WeakPolarHBondContact O-CG 3.36Å; F379-L383 PolarHBondContact O-N 3.06Å; Q380-L383 PolarHBondContact O-N 3.43Å; T381-L383 VanDerWaalsContact C-N 3.26Å; T381-L383 PolarHBondContact O-N 2.97Å
384	S	39.7	Very low	41.2	Very low	66 Å²	66	129.7 Å²	129.7	46%	0.462	67%	0.668	S	S	.	*	H	α-helix	trans	-66.9	-61.2	170.9	-67.8	0	0	0	0	111.3	Q380 T381 S386 L387	Q380-S384 PolarHBondContact O-N 3.28Å; Q380-S384 VanDerWaalsContact O-N 3.16Å; Q380-S384 PolarHBondContact O-OG 3.42Å; T381-S384 PolarHBondContact O-N 3.01Å; S384-S386 PolarHBondContact O-N 2.94Å; S384-L387 PolarHBondContact O-N 3.09Å
385	N	36.7	Very low	40.3	Very low	98 Å²	98	127.5 Å²	127.5	52%	0.524	67%	0.667	S	S	.	*	H	α-helix	trans	-62.6	-22.5	-174	-65.3	53.3	0	0	0	113.5	T381 L387	T381-N385 WeakPolarHBondContact CG2-OD1 3.41Å; T381-N385 PolarHBondContact O-N 2.86Å; T381-N385 PolarHBondContact O-OD1 3.41Å; N385-L387 PolarHBondContact O-N 3.13Å
386	S	40.8	Very low	39.8	Very low	75 Å²	75	129.9 Å²	129.9	52%	0.524	67%	0.674	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.9	-6.5	175.1	-66.5	0	0	0	0	114.3	F382 S384	F382-S386 WeakPolarHBondContact O-CB 3.46Å; F382-S386 PolarHBondContact O-N 3Å; F382-S386 PolarHBondContact O-OG 3.25Å; S384-S386 PolarHBondContact O-N 2.94Å
387	L	40.3	Very low	39	Very low	160 Å²	160	131.3 Å²	131.3	84%	0.838	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.2	-13.6	-176.5	-153.7	69.6	0	0	0	113.8	S384 N385	S384-L387 PolarHBondContact O-N 3.09Å; N385-L387 PolarHBondContact O-N 3.13Å
388	E	44.1	Very low	38	Very low	143 Å²	143	132.8 Å²	132.8	67%	0.668	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.5	-19.8	-176.3	-67.9	161.9	144.3	0	0	112.6	F390	E388-F390 PolarHBondContact O-N 2.82Å
389	A	35.3	Very low	36.8	Very low	79 Å²	79	130.1 Å²	130.1	65%	0.653	69%	0.693	S	S	*	*	S	Bend	trans	-79.1	42.6	-173.9	0	0	0	0	0	115.6
390	F	37.3	Very low	36.1	Very low	222 Å²	222	131.3 Å²	131.3	97%	0.974	70%	0.704	S	S	*	*	S	Bend	trans	-159.5	61.5	164.3	-98.2	-65.9	0	0	0	110.3	E388	E388-F390 PolarHBondContact O-N 2.82Å
391	G	37.6	Very low	35	Very low	77 Å²	77	133 Å²	133	79%	0.794	71%	0.712	S	S	*	*			trans	-161.3	20	-171.1	0	0	0	0	0	117.5
392	E	29.1	Very low	34.1	Very low	188 Å²	188	136.3 Å²	136.3	88%	0.879	73%	0.733	S	S	*	*			trans	-138.1	118.5	-179.7	-173.6	176.3	-162.6	0	0	112.6
393	K	30.9	Very low	33.2	Very low	188 Å²	188	136.9 Å²	136.9	82%	0.817	75%	0.746	S	S	*	*				176.4	103.5	109.7	-173	170.9	-171.8	176.1	0	111.7
394	L	26.3	Very low	32.4	Very low	159 Å²	159	138.5 Å²	138.5	83%	0.832	75%	0.75	S	S	*	*	S	Bend	trans	159.1	132.9	152.2	-92.4	155.9	0	0	0	109
395	Q	27.3	Very low	31.9	Very low	168 Å²	168	143.1 Å²	143.1	79%	0.785	76%	0.764	S	S	*	*			cis	-156.4	136.6	-35.7	170.8	164.6	-14.1	0	0	106.7
396	E	31.3	Very low	31.6	Very low	168 Å²	168	145.2 Å²	145.2	79%	0.785	78%	0.775	S	S	*	*			trans	-82.4	136.2	176.8	-176.7	179.5	-125.1	0	0	111.2
397	P	31.6	Very low	31.2	Very low	118 Å²	118	147.1 Å²	147.1	77%	0.766	79%	0.788	S	S	*	*			trans	-109.7	103.7	159.5	33.6	-22.2	0	0	0	110.3	A399	P397-A399 PolarHBondContact O-N 3.02Å
398	Q	25.4	Very low	30.6	Very low	174 Å²	174	142.4 Å²	142.4	81%	0.813	78%	0.778	S	S	*	*			trans	-66.6	126	162.2	-178.8	-178.3	109	0	0	108.6
399	A	24.1	Very low	29.9	Very low	86 Å²	86	142.9 Å²	142.9	71%	0.711	79%	0.785	S	S	*	*			trans	-84	130.1	172.2	0	0	0	0	0	110.4	P397	P397-A399 PolarHBondContact O-N 3.02Å
400	N	26.8	Very low	29.6	Very low	147 Å²	147	143.5 Å²	143.5	79%	0.786	78%	0.781	S	S	*	*			trans	-162.9	143.4	139.6	-114.4	10.5	0	0	0	113.2
401	E	25.9	Very low	29.2	Very low	167 Å²	167	141.8 Å²	141.8	78%	0.78	77%	0.774	S	S	*	*			trans	63.2	107.6	159.1	-57.7	-166.3	140.9	0	0	122.1
402	V	27.7	Very low	28.9	Very low	130 Å²	130	145.3 Å²	145.3	79%	0.788	77%	0.767	S	S	*	*				60.6	114.3	124.5	-174.6	0	0	0	0	119.6
403	V	31.9	Very low	28.9	Very low	136 Å²	136	142.7 Å²	142.7	82%	0.824	76%	0.755	S	S	*	*				-162.9	157.2	107.2	150.6	0	0	0	0	109.2
404	E	30.3	Very low	28.8	Very low	160 Å²	160	141.6 Å²	141.6	75%	0.748	75%	0.753	S	S	*	*			trans	-69.1	161.2	-176.3	-60.3	172.6	128.1	0	0	116
405	E	29.2	Very low	29	Very low	163 Å²	163	141.9 Å²	141.9	76%	0.762	75%	0.75	S	S	*	*			trans	56.9	155.1	138	-73.7	-168.2	170.8	0	0	121.2
406	L	31	Very low	29	Very low	142 Å²	142	141.3 Å²	141.3	74%	0.743	75%	0.747	S	S	*	*			cis	-154.5	170.4	2.7	-129.2	169.7	0	0	0	109.7
407	S	31.9	Very low	28.8	Very low	114 Å²	114	139.2 Å²	139.2	80%	0.797	75%	0.746	S	S	*	*			trans	71.2	139.5	166.7	-152.2	0	0	0	0	117.6
408	G	28.3	Very low	28.6	Very low	62 Å²	62	137.7 Å²	137.7	64%	0.639	74%	0.743	S	S	*	*			cis	145.9	97.6	-10.5	0	0	0	0	0	113.9
409	D	27.9	Very low	28.7	Very low	153 Å²	153	138.8 Å²	138.8	82%	0.818	75%	0.748	S	S	*	*			trans	-174.6	150.4	138.7	-121.3	15.2	0	0	0	107.7
410	T	30.5	Very low	29.2	Very low	92 Å²	92	142 Å²	142	56%	0.564	75%	0.749	S	S	*	*			cis	167.6	105.1	-19.8	-97.6	0	0	0	0	104
411	F	29.2	Very low	29.8	Very low	185 Å²	185	140.9 Å²	140.9	81%	0.811	75%	0.749	S	S	*	*			trans	57.2	158.8	148.7	-66.1	-78.8	0	0	0	118.7
412	K	31.2	Very low	29.9	Very low	152 Å²	152	139.3 Å²	139.3	66%	0.661	75%	0.745	S	S	*	*			cis	-160.6	166.8	14	-124.6	160.8	-179.9	-75.4	0	105.3
413	E	28.8	Very low	30	Very low	132 Å²	132	140.9 Å²	140.9	62%	0.617	74%	0.744	S	S	*	*			cis	-154.7	174.5	3	-164.9	124	-127.4	0	0	109.1
414	E	28.9	Very low	29.7	Very low	165 Å²	165	142 Å²	142	77%	0.771	75%	0.745	S	S	*	*			trans	-33.1	155.9	171.1	-62.8	161.5	143.8	0	0	116.8
415	Q	30.3	Very low	29.4	Very low	166 Å²	166	138.7 Å²	138.7	78%	0.776	74%	0.735	S	S	*	*				-165.2	130.2	69.6	-164	156.9	25.1	0	0	116.4
416	E	27.7	Very low	29.4	Very low	156 Å²	156	140.2 Å²	140.2	73%	0.729	74%	0.74	S	S	*	*				19.3	125.8	126.6	-121.7	-178.6	172.3	0	0	118.2
417	T	25.3	Very low	29.1	Very low	123 Å²	123	139.1 Å²	139.1	76%	0.755	74%	0.739	S	S	*	*				-175.9	152.5	68.9	27.1	0	0	0	0	107.6
418	A	27.9	Very low	28.7	Very low	86 Å²	86	139.3 Å²	139.3	71%	0.711	74%	0.739	S	S	*	*			cis	91.6	86.9	42.2	0	0	0	0	0	115.5
419	E	28	Very low	28.4	Very low	198 Å²	198	144.8 Å²	144.8	93%	0.925	75%	0.745	S	S	*	*			trans	79	159	141.6	-52.5	-157.3	163.6	0	0	124
420	E	35.2	Very low	28.5	Very low	154 Å²	154	145.7 Å²	145.7	72%	0.72	75%	0.748	S	S	*	*			trans	-75	177.5	176.5	-121.4	-166.5	98.9	0	0	111.6
421	P	37.7	Very low	28.3	Very low	122 Å²	122	148.2 Å²	148.2	79%	0.792	75%	0.754	S	S	*	*			cis	-153.7	-157.2	47.6	43.1	-18.4	0	0	0	117.4
422	L	30	Very low	29.2	Very low	134 Å²	134	145 Å²	145	70%	0.702	75%	0.751	S	S	*	*			trans	-90.3	171.6	-161.5	-58.1	162.2	0	0	0	117.9
423	Q	28.6	Very low	29	Very low	163 Å²	163	144.6 Å²	144.6	76%	0.762	75%	0.752	S	S	*	*			trans	98	139.3	147.8	-53.5	-169.2	65.1	0	0	121.5
424	L	25.9	Very low	29	Very low	161 Å²	161	143.7 Å²	143.7	84%	0.843	76%	0.755	S	S	*	*				174.1	107.6	124.8	-108	82.8	0	0	0	108.1
425	T	23.8	Very low	29.1	Very low	89 Å²	89	141.5 Å²	141.5	55%	0.546	75%	0.752	S	S	.	*				75.2	108.4	76.8	64.9	0	0	0	0	119
426	K	29.2	Very low	28.9	Very low	196 Å²	196	141 Å²	141	85%	0.852	75%	0.75	S	S	*	*			trans	65.1	161.5	145	-50.1	171.1	-177.8	172.5	0	116.5
427	T	24.6	Very low	28.9	Very low	118 Å²	118	139.1 Å²	139.1	72%	0.724	74%	0.744	S	S	*	*			cis	-142.6	167	13.4	45.1	0	0	0	0	112
428	C	22.8	Very low	29	Very low	118 Å²	118	141.7 Å²	141.7	80%	0.797	75%	0.745	S	S	*	*			trans	38.8	156.1	140	-65	0	0	0	0	123.2
429	K	23.4	Very low	28.9	Very low	177 Å²	177	143 Å²	143	77%	0.77	75%	0.749	S	S	*	*			cis	173.4	137.3	-13.9	167.8	-175.1	177.7	-175.7	0	106.7
430	I	28.8	Very low	29	Very low	172 Å²	172	138.7 Å²	138.7	88%	0.882	74%	0.741	S	S	*	*			trans	-176.1	153.9	150.9	-102.3	154.7	0	0	0	112.2
431	E	27.9	Very low	29.4	Very low	146 Å²	146	137.1 Å²	137.1	68%	0.682	74%	0.744	S	S	*	*			trans	-100.9	-171.5	-179.9	-113.2	165.1	130.5	0	0	110.5
432	P	47.7	Very low	28.8	Very low	116 Å²	116	136.9 Å²	136.9	75%	0.753	74%	0.744	S	S	*	*			cis	-106.9	158.5	13.5	6.1	19.9	0	0	0	114.8
433	E	27.2	Very low	28.7	Very low	145 Å²	145	136.4 Å²	136.4	68%	0.678	75%	0.751	S	S	*	*				85.5	105.4	55.1	-126.9	-144	120.7	0	0	111
434	V	29	Very low	29.1	Very low	112 Å²	112	134 Å²	134	68%	0.679	75%	0.753	S	S	*	*				90.6	140.4	94	155.3	0	0	0	0	111.7
435	V	29.2	Very low	30.2	Very low	119 Å²	119	132.1 Å²	132.1	72%	0.721	75%	0.75	S	S	*	*				-154.8	162.4	52.9	-115.2	0	0	0	0	110.3
436	E	26.7	Very low	30.7	Very low	157 Å²	157	133.1 Å²	133.1	73%	0.734	76%	0.761	S	S	*	*			cis	-154.7	122.5	-12.3	-148.8	173.3	161.1	0	0	113.6
437	L	28.4	Very low	30.7	Very low	115 Å²	115	134.7 Å²	134.7	60%	0.602	76%	0.761	S	S	*	*			trans	41.2	140	138.3	-55.3	178	0	0	0	126.7
438	K	26.4	Very low	31.2	Very low	178 Å²	178	134.6 Å²	134.6	77%	0.774	76%	0.761	S	S	*	*			trans	69.9	149.6	135.5	-71.7	164.4	-168	166.9	0	118.8
439	S	26.7	Very low	32.9	Very low	112 Å²	112	134.3 Å²	134.3	78%	0.783	76%	0.757	S	S	*	*			cis	-161.6	162.7	-3.3	39.5	0	0	0	0	113.1
440	S	29.5	Very low	34.8	Very low	109 Å²	109	130.9 Å²	130.9	76%	0.762	75%	0.753	S	S	*	*			trans	-66.9	179.7	167.2	-34.1	0	0	0	0	113
441	P	44.6	Very low	36.2	Very low	121 Å²	121	128 Å²	128	79%	0.786	75%	0.746	S	S	*	*			cis	-139.5	-168.5	5.5	43.3	-23	0	0	0	117.1
442	C	25.5	Very low	36.3	Very low	117 Å²	117	127.3 Å²	127.3	79%	0.791	75%	0.752	S	S	*	*			trans	-38.2	146	-179.4	-50.2	0	0	0	0	120.3
443	S	26.7	Very low	35.6	Very low	123 Å²	123	126 Å²	126	86%	0.86	75%	0.75	S	S	*	*				176.1	153.3	110.9	-76	0	0	0	0	115.3
444	S	36.6	Very low	35.7	Very low	113 Å²	113	124.5 Å²	124.5	79%	0.79	76%	0.756	S	S	*	*			trans	-85.2	176.3	163.8	-54	0	0	0	0	110.4
445	P	49.8	Very low	36.9	Very low	121 Å²	121	124.8 Å²	124.8	79%	0.786	76%	0.76	S	S	*	*			cis	-148	177.7	17.7	44.4	-23.5	0	0	0	119.4
446	S	34.1	Very low	37.1	Very low	110 Å²	110	124.4 Å²	124.4	77%	0.769	76%	0.759	S	S	*	*			trans	15.8	126.5	149.3	-169.4	0	0	0	0	122.6
447	R	28.6	Very low	37.5	Very low	229 Å²	229	125.9 Å²	125.9	86%	0.864	76%	0.762	S	S	*	*				-175.2	165.5	124.8	-104	171.5	71.1	-137.7	1.6	114.7
448	T	35.9	Very low	37.5	Very low	117 Å²	117	126.4 Å²	126.4	72%	0.718	77%	0.77	S	S	*	*			trans	-114.8	-165.6	171.7	60.8	0	0	0	0	108.7
449	P	58.6	Low	37.7	Very low	111 Å²	111	126.8 Å²	126.8	72%	0.721	77%	0.768	S	S	*	*			cis	-135.4	-107.2	1.6	26.5	1.8	0	0	0	119.1
450	P	64.3	Low	37.9	Very low	106 Å²	106	125.5 Å²	125.5	69%	0.688	76%	0.759	S	S	*	*				-121	-155.5	-117.9	42.7	-21.4	0	0	0	112.3
451	P	56.9	Low	38	Very low	111 Å²	111	128 Å²	128	72%	0.721	76%	0.759	S	S	*	*			cis	-138.5	-137.7	3.3	42.9	-19.8	0	0	0	114.2
452	T	30.8	Very low	37.3	Very low	132 Å²	132	132.4 Å²	132.4	81%	0.81	76%	0.76	S	S	*	*			trans	79.5	126.8	168.7	-52.8	0	0	0	0	115
453	A	31.4	Very low	37.9	Very low	87 Å²	87	133.6 Å²	133.6	72%	0.719	76%	0.757	S	S	*	*			cis	-157.4	-179.8	-10.9	0	0	0	0	0	111.4
454	S	29.9	Very low	38.1	Very low	115 Å²	115	138.9 Å²	138.9	80%	0.804	76%	0.758	S	S	*	*			trans	-156.9	167.6	170	-53.9	0	0	0	0	109.9
455	P	53.9	Low	37.9	Very low	118 Å²	118	138 Å²	138	77%	0.766	76%	0.757	S	S	*	*				-145.5	-168.3	96.2	37.1	-16.7	0	0	0	111.6
456	T	33.1	Very low	36.9	Very low	111 Å²	111	138.3 Å²	138.3	68%	0.681	76%	0.762	S	S	*	*			cis	-155.6	140.4	10.7	-26.7	0	0	0	0	111.2
457	K	35.8	Very low	37	Very low	187 Å²	187	142.6 Å²	142.6	81%	0.813	77%	0.767	S	S	*	*			trans	31.8	148.2	142.1	-62.6	175.8	-170.9	173.2	0	121.4
458	T	29.6	Very low	37.1	Very low	126 Å²	126	141.2 Å²	141.2	77%	0.773	77%	0.767	S	S	*	*			cis	-157.7	174.3	16.2	-10.3	0	0	0	0	108.3
459	Y	29.2	Very low	36.6	Very low	186 Å²	186	140.1 Å²	140.1	73%	0.729	77%	0.765	S	S	*	*			cis	-149	-165.6	0.2	-177.3	-128.3	0	0	0	109.5	H461	Y459-H461 PolarHBondContact OH-CD2 3.21Å
460	S	31.3	Very low	35.2	Very low	85 Å²	85	140.1 Å²	140.1	59%	0.594	76%	0.762	S	S	*	*			trans	-166.7	151.1	177.7	-79.6	0	0	0	0	113.9
461	H	31.9	Very low	33.5	Very low	161 Å²	161	143.9 Å²	143.9	75%	0.745	77%	0.77	S	S	*	*			trans	-176.5	137	152.5	-103.9	-80	0	0	0	107.6	Y459	Y459-H461 PolarHBondContact OH-CD2 3.21Å
462	R	29.8	Very low	32.4	Very low	214 Å²	214	143.9 Å²	143.9	81%	0.808	77%	0.773	S	S	*	*			cis	74.9	136.2	3.1	-60	-169.5	171.9	-156.9	-2.9	116.2
463	I	37.7	Very low	32.3	Very low	142 Å²	142	144.7 Å²	144.7	73%	0.728	78%	0.778	S	S	*	*			cis	-164	166.3	-2	-118.9	-79.5	0	0	0	110.2
464	R	30.3	Very low	32.2	Very low	235 Å²	235	150.4 Å²	150.4	89%	0.887	79%	0.786	S	S	*	*			trans	107.5	150.3	149	-120	168.4	-154.8	-177.2	5.8	120.2
465	A	33.1	Very low	32.1	Very low	93 Å²	93	149.6 Å²	149.6	77%	0.769	79%	0.787	S	S	*	*			trans	-128.8	164.4	176.4	0	0	0	0	0	109.9
466	S	29.5	Very low	30.8	Very low	129 Å²	129	149.4 Å²	149.4	90%	0.902	79%	0.788	S	S	*	*			trans	-152.5	163.3	166.8	-132.7	0	0	0	0	113
467	K	34.7	Very low	31.6	Very low	199 Å²	199	149.4 Å²	149.4	87%	0.865	79%	0.79	S	S	*	*			trans	-95.2	160.9	-155.6	-53.8	163.2	-179.6	173	0	114.9
468	K	31.8	Very low	31.2	Very low	200 Å²	200	145 Å²	145	87%	0.87	78%	0.783	S	S	*	*			trans	103.7	136	130.1	-153.1	-175.4	-177.2	-171.8	0	119.6
469	S	25	Very low	31.5	Very low	95 Å²	95	148.3 Å²	148.3	66%	0.664	79%	0.789	S	S	*	*			trans	113.5	104.8	139.3	-143.9	0	0	0	0	119.8
470	V	29.4	Very low	31.6	Very low	111 Å²	111	146 Å²	146	67%	0.673	79%	0.794	S	S	*	*			trans	12.5	128	136.2	-153.1	0	0	0	0	118.6
471	H	29.2	Very low	31.5	Very low	184 Å²	184	146.8 Å²	146.8	85%	0.852	81%	0.806	S	S	*	*				178.2	156.8	109.2	-89.6	-68.2	0	0	0	111.9
472	S	32.5	Very low	31.3	Very low	111 Å²	111	144.4 Å²	144.4	78%	0.776	81%	0.808	S	S	*	*			trans	-112.5	140.7	-176.4	177	0	0	0	0	110.9
473	T	30.1	Very low	31.1	Very low	150 Å²	150	138.3 Å²	138.3	92%	0.92	80%	0.797	S	S	*	*			trans	-136.1	159.7	163.7	49.1	0	0	0	0	111.1
474	K	29.3	Very low	30.8	Very low	206 Å²	206	140.9 Å²	140.9	90%	0.896	80%	0.803	S	S	*	*			trans	-128	128.8	-163.6	162.4	-167.2	170.7	-172.9	0	109.3
475	A	27.2	Very low	31	Very low	98 Å²	98	135.8 Å²	135.8	81%	0.81	80%	0.804	S	S	*	*			trans	-141.8	138.4	174.3	0	0	0	0	0	112.4
476	S	26.5	Very low	30.7	Very low	114 Å²	114	135 Å²	135	80%	0.797	81%	0.805	S	S	*	*			trans	-174.4	158.8	177.1	-72	0	0	0	0	105.2
477	P	49.7	Very low	30.8	Very low	112 Å²	112	133.6 Å²	133.6	73%	0.727	80%	0.801	S	S	*	*			cis	-139.4	-161.3	22.6	37.5	-15.3	0	0	0	114.6
478	S	28	Very low	30.7	Very low	94 Å²	94	129.7 Å²	129.7	66%	0.657	80%	0.799	S	S	*	*			trans	77.4	112.3	154.2	-55.3	0	0	0	0	119
479	H	35.8	Very low	30.8	Very low	195 Å²	195	126.3 Å²	126.3	90%	0.903	80%	0.795	S	S	*	*				-155.7	157.6	97.6	-94.5	-74.3	0	0	0	109.6
480	T	30.4	Very low	31.2	Very low	137 Å²	137	127.4 Å²	127.4	84%	0.84	80%	0.803	S	S	*	*			trans	-115.7	135.2	-164.7	47.9	0	0	0	0	113.4
481	A	29.5	Very low	31.6	Very low	102 Å²	102	127.9 Å²	127.9	84%	0.843	81%	0.806	S	S	*	*			trans	-146.3	133.3	157.3	0	0	0	0	0	110.3
482	S	28.6	Very low	31.9	Very low	112 Å²	112	123.9 Å²	123.9	78%	0.783	80%	0.799	S	S	*	*			trans	-83.2	169.3	166.2	54.9	0	0	0	0	109.5
483	C	26	Very low	32.8	Very low	86 Å²	86	122.9 Å²	122.9	58%	0.581	79%	0.79	S	S	*	*			cis	-154.1	170.3	-3.7	22.7	0	0	0	0	106.1
484	F	29.5	Very low	33.5	Very low	195 Å²	195	118.8 Å²	118.8	86%	0.855	77%	0.771	S	S	*	*				-161.4	173.2	52	-79.2	-87.2	0	0	0	111.6
485	S	34.7	Very low	34.5	Very low	129 Å²	129	113.3 Å²	113.3	90%	0.902	75%	0.751	S	S	*	*			trans	-73.3	146.4	180	-58.7	0	0	0	0	114.6
486	G	28.1	Very low	35.9	Very low	76 Å²	76	110.9 Å²	110.9	78%	0.784	73%	0.726	S	S	*	*			trans	-173.9	63.1	174.4	0	0	0	0	0	112.9
487	A	32.1	Very low	36.8	Very low	100 Å²	100	112 Å²	112	83%	0.826	73%	0.731	S	S	*	*			trans	-72.8	133.8	-176.4	0	0	0	0	0	112.5
488	S	32.2	Very low	36.7	Very low	117 Å²	117	110.9 Å²	110.9	82%	0.818	73%	0.731	S	S	*	*			trans	-150.7	97.9	168.9	-79	0	0	0	0	110.4	S490	S488-S490 PolarHBondContact O-N 3.43Å
489	T	33.9	Very low	37.5	Very low	129 Å²	129	108.7 Å²	108.7	79%	0.791	72%	0.723	S	S	*	*			trans	-76.8	86.8	-178.9	43.5	0	0	0	0	111.4	T491	T489-T491 PolarHBondContact O-N 2.86Å; T489-T491 PolarHBondContact O-OG1 2.81Å
490	S	32.1	Very low	38.6	Very low	117 Å²	117	105 Å²	105	82%	0.818	70%	0.701	S	S	*	*			trans	-53.7	110.7	169.1	-176.6	0	0	0	0	110.3	S488	S488-S490 PolarHBondContact O-N 3.43Å
491	T	39.3	Very low	40.1	Very low	121 Å²	121	102.4 Å²	102.4	74%	0.742	69%	0.686	S	S	*	*			trans	-118.8	97.5	-175.7	-53.7	0	0	0	0	109	T489	T489-T491 PolarHBondContact O-N 2.86Å; T489-T491 PolarHBondContact O-OG1 2.81Å
492	S	33.8	Very low	41.9	Very low	100 Å²	100	104.4 Å²	104.4	70%	0.699	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-60.4	138.8	-178.1	-55.9	0	0	0	0	112.1	A494	S492-A494 PolarHBondContact O-N 3Å
493	P	52.2	Low	44.4	Very low	91 Å²	91	101.3 Å²	101.3	59%	0.591	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-70	116.4	-176	27.4	-34.3	0	0	0	111.5	L495	P493-L495 PolarHBondContact O-N 3.22Å; P493-L495 VanDerWaalsContact O-N 3.15Å
494	A	45.4	Very low	47.3	Very low	64 Å²	64	100.2 Å²	100.2	53%	0.529	64%	0.636	S	S	.	*	P	Polyproline II helix	trans	-62.4	116.2	175.9	0	0	0	0	0	110.9	S492 R502	S492-A494 PolarHBondContact O-N 3Å; A494-R502 VanDerWaalsContact O-CB 3.28Å; A494-R502 WeakPolarHBondContact O-CB 3.3Å; A494-R502 WeakPolarHBondContact O-CD 3.37Å; A494-R502 WeakPolarHBondContact O-CG 3.39Å; A494-R502 PolarHBondContact O-N 3.18Å; A494-R502 VanDerWaalsContact O-N 3.17Å; A494-R502 PolarHBondContact O-NE 3.11Å
495	L	50.7	Low	49.9	Very low	91 Å²	91	98.5 Å²	98.5	48%	0.476	63%	0.628	S	S	.	*	B	Isolated β-bridge	trans	-74.8	151.2	-178.7	-55	-176.5	0	0	0	112.1	P493 P501 R502	P493-L495 PolarHBondContact O-N 3.22Å; P493-L495 VanDerWaalsContact O-N 3.15Å; L495-P501 HydrophobicContact CD2-CB 4.47Å; L495-P501 HydrophobicContact CD2-CG 4.22Å; L495-R502 VanDerWaalsContact O-CZ 3.24Å; L495-R502 PolarHBondContact O-NE 3.01Å; L495-R502 PolarHBondContact O-NH2 3.06Å
496	T	56.2	Low	52.4	Low	46 Å²	46	99.6 Å²	99.6	28%	0.282	62%	0.619	S	S	.	*	P	Polyproline II helix	trans	-73.1	163.9	168.4	57.3	0	0	0	0	111.1	A498 G499 R500 R502	T496-A498 PolarHBondContact O-N 2.78Å; T496-G499 PolarHBondContact O-N 3.04Å; T496-R500 WeakPolarHBondContact CB-O 3.48Å; T496-R500 PolarHBondContact N-O 3.06Å; T496-R500 PolarHBondContact OG1-N 2.78Å; T496-R500 PolarHBondContact OG1-O 2.94Å; T496-R502 HydrophobicContact CG2-CG 3.56Å
497	P	45.6	Very low	55.3	Low	138 Å²	138	97.9 Å²	97.9	90%	0.896	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.6	-12.6	170.9	-25.1	35.7	0	0	0	114.9
498	A	46.9	Very low	58.1	Low	88 Å²	88	95.4 Å²	95.4	73%	0.727	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.7	22.1	174.4	0	0	0	0	0	112.8	T496 R500	T496-A498 PolarHBondContact O-N 2.78Å; A498-R500 PolarHBondContact O-N 3.4Å
499	G	44.6	Very low	60.8	Low	48 Å²	48	92.4 Å²	92.4	50%	0.495	54%	0.537	S	S	.	.	S	Bend	trans	73.8	-20.3	174.8	0	0	0	0	0	116.3	T496	T496-G499 PolarHBondContact O-N 3.04Å
500	R	58.5	Low	63.5	Low	119 Å²	119	88.3 Å²	88.3	45%	0.449	51%	0.512	S	S	.	.	S	Bend	trans	-67.9	144.2	177	-72	-165.1	-169	-171.1	7.9	112.1	T496 A498 R502 D539	T496-R500 WeakPolarHBondContact CB-O 3.48Å; T496-R500 PolarHBondContact N-O 3.06Å; T496-R500 PolarHBondContact OG1-N 2.78Å; T496-R500 PolarHBondContact OG1-O 2.94Å; A498-R500 PolarHBondContact O-N 3.4Å; R500-R502 PolarHBondContact O-N 2.82Å; R500-D539 IonicContact NH1-OD1 2.6Å; R500-D539 PolarHBondContact NH1-OD1 3.11Å; R500-D539 IonicContact NH1-OD2 2.82Å
501	P	61.5	Low	66.3	Low	81 Å²	81	82.8 Å²	82.8	53%	0.526	47%	0.473	S	S	.	.	B	Isolated β-bridge	trans	-51.5	137.5	166.8	-25.8	34.9	0	0	0	111.8	L495 K503	L495-P501 HydrophobicContact CD2-CB 4.47Å; L495-P501 HydrophobicContact CD2-CG 4.22Å; P501-K503 PolarHBondContact O-N 3.08Å
502	R	66.9	Low	68.8	Low	144 Å²	144	80 Å²	80	54%	0.543	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-69.6	124.3	169.8	-70.8	168.1	-155.1	-131.5	2.5	108.7	A494 L495 T496 R500 T504	A494-R502 VanDerWaalsContact O-CB 3.28Å; A494-R502 WeakPolarHBondContact O-CB 3.3Å; A494-R502 WeakPolarHBondContact O-CD 3.37Å; A494-R502 WeakPolarHBondContact O-CG 3.39Å; A494-R502 PolarHBondContact O-N 3.18Å; A494-R502 VanDerWaalsContact O-N 3.17Å; A494-R502 PolarHBondContact O-NE 3.11Å; L495-R502 VanDerWaalsContact O-CZ 3.24Å; L495-R502 PolarHBondContact O-NE 3.01Å; L495-R502 PolarHBondContact O-NH2 3.06Å; T496-R502 HydrophobicContact CG2-CG 3.56Å; R500-R502 PolarHBondContact O-N 2.82Å; R502-T504 PolarHBondContact O-N 2.92Å
503	K	81.7	Confident	71.3	Confident	48 Å²	48	81.4 Å²	81.4	21%	0.209	45%	0.447	C	S	.	.	P	Polyproline II helix	trans	-55.5	127.5	169.3	-63.3	-179.7	167.5	69.2	0	108.3	P501 Q507 L508 L511 L535 D539	P501-K503 PolarHBondContact O-N 3.08Å; K503-Q507 VanDerWaalsContact CA-OE1 3.31Å; K503-L508 HydrophobicContact CB-CD1 4.41Å; K503-L508 HydrophobicContact CB-CD2 3.97Å; K503-L508 HydrophobicContact CB-CG 3.94Å; K503-L508 HydrophobicContact CD-CD2 4.24Å; K503-L511 HydrophobicContact CD-CD1 4.42Å; K503-L535 HydrophobicContact CD-CD1 3.89Å; K503-L535 HydrophobicContact CG-CD1 3.94Å; K503-L535 HydrophobicContact CG-CD2 4.03Å; K503-D539 WeakPolarHBondContact CE-O 3.49Å; K503-D539 IonicContact NZ-OD1 2.92Å; K503-D539 PolarHBondContact NZ-OD1 3.32Å
504	T	87.3	Confident	73.1	Confident	63 Å²	63	78.7 Å²	78.7	39%	0.387	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-67.1	164.9	-176.4	74.4	0	0	0	0	111	R502 E506 Q507 L508	R502-T504 PolarHBondContact O-N 2.92Å; T504-E506 VanDerWaalsContact C-N 3.31Å; T504-E506 PolarHBondContact O-N 3.3Å; T504-Q507 PolarHBondContact O-N 2.75Å; T504-Q507 VanDerWaalsContact OG1-CG 3.29Å; T504-Q507 WeakPolarHBondContact OG1-CG 3.2Å; T504-Q507 PolarHBondContact OG1-N 3.43Å; T504-Q507 VanDerWaalsContact OG1-N 3.15Å; T504-L508 WeakPolarHBondContact O-CB 3.46Å; T504-L508 VanDerWaalsContact O-CG 3.3Å; T504-L508 WeakPolarHBondContact O-CG 3.47Å; T504-L508 PolarHBondContact O-N 3.13Å
505	K	83.3	Confident	75.2	Confident	159 Å²	159	75.8 Å²	75.8	69%	0.691	40%	0.401	S	S	*	.	H	α-helix	trans	-58	-46.7	176.3	-173.4	-169.2	169.2	-163.7	0	111	L508 D509	K505-L508 CarbonylContact O-C 3.55Å; K505-L508 PolarHBondContact O-N 2.88Å; K505-D509 WeakPolarHBondContact CE-OD2 3.11Å; K505-D509 WeakPolarHBondContact O-CB 3.19Å; K505-D509 VanDerWaalsContact O-CG 3.28Å; K505-D509 PolarHBondContact O-N 3.03Å
506	E	87.3	Confident	76.8	Confident	152 Å²	152	75.2 Å²	75.2	71%	0.71	40%	0.399	S	S	*	.	H	α-helix	trans	-60.8	-47.7	178.6	-69.3	148.2	-159	0	0	112.1	T504 L508 D509 V510	T504-E506 VanDerWaalsContact C-N 3.31Å; T504-E506 PolarHBondContact O-N 3.3Å; E506-L508 VanDerWaalsContact C-N 3.29Å; E506-L508 PolarHBondContact O-N 3.31Å; E506-D509 PolarHBondContact O-N 3.16Å; E506-D509 VanDerWaalsContact O-N 3.11Å; E506-V510 WeakPolarHBondContact O-CG2 3.42Å; E506-V510 PolarHBondContact O-N 3.48Å
507	Q	90.6	Very high	77.9	Confident	39 Å²	39	80.8 Å²	80.8	18%	0.182	42%	0.419	C	S	.	.	H	α-helix	trans	-56.3	-44.6	174.1	-73.7	172	-19.1	0	0	111.5	K503 T504 L511 T533 L535	K503-Q507 VanDerWaalsContact CA-OE1 3.31Å; T504-Q507 PolarHBondContact O-N 2.75Å; T504-Q507 VanDerWaalsContact OG1-CG 3.29Å; T504-Q507 WeakPolarHBondContact OG1-CG 3.2Å; T504-Q507 PolarHBondContact OG1-N 3.43Å; T504-Q507 VanDerWaalsContact OG1-N 3.15Å; Q507-L511 WeakPolarHBondContact O-CB 3.49Å; Q507-L511 WeakPolarHBondContact O-CD1 3.34Å; Q507-L511 WeakPolarHBondContact O-CG 3.36Å; Q507-L511 PolarHBondContact O-N 2.91Å; Q507-T533 WeakPolarHBondContact CG-O 3.46Å; Q507-T533 PolarHBondContact NE2-O 3.06Å; Q507-L535 HydrophobicContact CB-CD1 4.14Å; Q507-L535 HydrophobicContact CG-CD1 4.37Å; Q507-L535 HydrophobicContact CG-CG 4.4Å
508	L	90.2	Very high	79.6	Confident	49 Å²	49	76.7 Å²	76.7	26%	0.257	39%	0.393	S	S	.	.	H	α-helix	trans	-68.3	-32.8	177.6	-70.9	170.4	0	0	0	112.7	K503 T504 K505 E506 K512	K503-L508 HydrophobicContact CB-CD1 4.41Å; K503-L508 HydrophobicContact CB-CD2 3.97Å; K503-L508 HydrophobicContact CB-CG 3.94Å; K503-L508 HydrophobicContact CD-CD2 4.24Å; T504-L508 WeakPolarHBondContact O-CB 3.46Å; T504-L508 VanDerWaalsContact O-CG 3.3Å; T504-L508 WeakPolarHBondContact O-CG 3.47Å; T504-L508 PolarHBondContact O-N 3.13Å; K505-L508 CarbonylContact O-C 3.55Å; K505-L508 PolarHBondContact O-N 2.88Å; E506-L508 VanDerWaalsContact C-N 3.29Å; E506-L508 PolarHBondContact O-N 3.31Å; L508-K512 WeakPolarHBondContact O-CD 3.33Å; L508-K512 VanDerWaalsContact O-CE 3.31Å; L508-K512 WeakPolarHBondContact O-CE 3.41Å; L508-K512 WeakPolarHBondContact O-CG 3.38Å; L508-K512 PolarHBondContact O-N 3.48Å
509	D	88.6	Confident	81.4	Confident	53 Å²	53	72.9 Å²	72.9	28%	0.283	36%	0.36	S	S	.	.	H	α-helix	trans	-75.6	-38.1	179.3	-70.9	-19.7	0	0	0	111.5	K505 E506 K512 Q513	K505-D509 WeakPolarHBondContact CE-OD2 3.11Å; K505-D509 WeakPolarHBondContact O-CB 3.19Å; K505-D509 VanDerWaalsContact O-CG 3.28Å; K505-D509 PolarHBondContact O-N 3.03Å; E506-D509 PolarHBondContact O-N 3.16Å; E506-D509 VanDerWaalsContact O-N 3.11Å; D509-K512 PolarHBondContact O-N 3.23Å; D509-K512 IonicContact OD1-NZ 2.63Å; D509-K512 PolarHBondContact OD1-NZ 2.97Å; D509-Q513 WeakPolarHBondContact O-CB 3.3Å; D509-Q513 WeakPolarHBondContact O-CG 3.27Å; D509-Q513 PolarHBondContact O-N 3.24Å
510	V	91	Very high	83.3	Confident	44 Å²	44	76.6 Å²	76.6	27%	0.267	36%	0.359	S	S	.	.	H	α-helix	trans	-59.1	-48.2	167.9	171.4	0	0	0	0	111.1	E506 K512 Q513 H514 L529 L532 T533	E506-V510 WeakPolarHBondContact O-CG2 3.42Å; E506-V510 PolarHBondContact O-N 3.48Å; V510-K512 PolarHBondContact O-N 2.84Å; V510-Q513 PolarHBondContact O-N 3.18Å; V510-H514 PolarHBondContact O-N 2.95Å; V510-L529 HydrophobicContact CG1-CD2 4.36Å; V510-L532 HydrophobicContact CG1-CB 4.25Å; V510-T533 HydrophobicContact CB-CG2 4.24Å; V510-T533 HydrophobicContact CG1-CG2 3.9Å
511	L	91.9	Very high	84.8	Confident	0 Å²	0	71.4 Å²	71.4	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-60.3	-41.6	178.2	-73.4	167.8	0	0	0	112.1	K503 Q507 F515 L529 T533 L535 V540 W543 F544	K503-L511 HydrophobicContact CD-CD1 4.42Å; Q507-L511 WeakPolarHBondContact O-CB 3.49Å; Q507-L511 WeakPolarHBondContact O-CD1 3.34Å; Q507-L511 WeakPolarHBondContact O-CG 3.36Å; Q507-L511 PolarHBondContact O-N 2.91Å; L511-F515 VanDerWaalsContact O-CB 3.31Å; L511-F515 WeakPolarHBondContact O-CB 3.39Å; L511-F515 PolarHBondContact O-N 2.98Å; L511-L529 HydrophobicContact CD2-CD2 4.3Å; L511-T533 HydrophobicContact CD2-CG2 4.32Å; L511-T533 HydrophobicContact CG-CG2 4.09Å; L511-L535 HydrophobicContact CD1-CD1 3.94Å; L511-V540 HydrophobicContact CD2-CG1 3.94Å; L511-W543 VanDerWaalsContact C-CH2 3.48Å; L511-W543 HydrophobicContact CB-CD2 4.02Å; L511-W543 HydrophobicContact CB-CE3 3.86Å; L511-W543 HydrophobicContact CB-CH2 3.7Å; L511-W543 HydrophobicContact CB-CZ2 3.82Å; L511-W543 HydrophobicContact CB-CZ3 3.72Å; L511-W543 HydrophobicContact CD1-CD2 3.94Å; L511-W543 HydrophobicContact CD1-CE3 4.35Å; L511-W543 HydrophobicContact CD1-CG 4.02Å; L511-W543 HydrophobicContact CD2-CD2 4.48Å; L511-W543 HydrophobicContact CD2-CE3 4.09Å; L511-W543 HydrophobicContact CG-CD2 4.38Å; L511-W543 HydrophobicContact CG-CE3 4.33Å; L511-W543 WeakPolarHBondContact O-CH2 3.34Å; L511-W543 WeakPolarHBondContact O-CZ3 3.42Å; L511-F544 HydrophobicContact CD2-CD2 4.35Å; L511-F544 HydrophobicContact CD2-CE2 3.79Å
512	K	89.9	Confident	86.1	Confident	62 Å²	62	70.5 Å²	70.5	27%	0.27	33%	0.334	S	S	.	.	H	α-helix	trans	-64.2	-46.7	174.1	-70.1	163.1	-150.2	161.2	0	112.2	L508 D509 V510 H514 F515 L516 W543 W558	L508-K512 WeakPolarHBondContact O-CD 3.33Å; L508-K512 VanDerWaalsContact O-CE 3.31Å; L508-K512 WeakPolarHBondContact O-CE 3.41Å; L508-K512 WeakPolarHBondContact O-CG 3.38Å; L508-K512 PolarHBondContact O-N 3.48Å; D509-K512 PolarHBondContact O-N 3.23Å; D509-K512 IonicContact OD1-NZ 2.63Å; D509-K512 PolarHBondContact OD1-NZ 2.97Å; V510-K512 PolarHBondContact O-N 2.84Å; K512-H514 VanDerWaalsContact C-N 3.28Å; K512-H514 PolarHBondContact O-N 2.84Å; K512-F515 PolarHBondContact O-N 2.99Å; K512-L516 WeakPolarHBondContact O-CG 3.4Å; K512-L516 PolarHBondContact O-N 2.91Å; K512-W543 HydrophobicContact CG-CH2 4.43Å; K512-W543 HydrophobicContact CG-CZ2 4.24Å; K512-W558 HydrophobicContact CB-CH2 4.01Å; K512-W558 HydrophobicContact CB-CZ3 4.26Å; K512-W558 HydrophobicContact CG-CH2 3.72Å; K512-W558 HydrophobicContact CG-CZ2 3.79Å; K512-W558 HydrophobicContact CG-CZ3 4.23Å
513	Q	87.9	Confident	87.2	Confident	131 Å²	131	66.4 Å²	66.4	61%	0.612	33%	0.327	S	S	*	.	H	α-helix	trans	-60.1	-39.6	179.9	-76.9	178.3	-3.1	0	0	111.7	D509 V510	D509-Q513 WeakPolarHBondContact O-CB 3.3Å; D509-Q513 WeakPolarHBondContact O-CG 3.27Å; D509-Q513 PolarHBondContact O-N 3.24Å; V510-Q513 PolarHBondContact O-N 3.18Å
514	H	89.6	Confident	87.6	Confident	34 Å²	34	69.9 Å²	69.9	16%	0.157	35%	0.345	C	S	.	.	H	α-helix	trans	-71.5	-40.7	173.9	-163	-56.4	0	0	0	112.3	V510 K512 L516 K517 C518 E525 L529 F544	V510-H514 PolarHBondContact O-N 2.95Å; K512-H514 VanDerWaalsContact C-N 3.28Å; K512-H514 PolarHBondContact O-N 2.84Å; H514-L516 PolarHBondContact O-N 3.34Å; H514-K517 PolarHBondContact O-N 3.22Å; H514-C518 PolarHBondContact O-N 2.96Å; H514-E525 IonicContact CE1-OE2 4Å; H514-E525 PolarHBondContact CE1-OE2 3.14Å; H514-E525 IonicContact NE2-OE2 2.83Å; H514-L529 HydrophobicContact CB-CD2 3.78Å; H514-F544 HydrophobicContact CB-CZ 4.29Å
515	F	88.3	Confident	87.8	Confident	2 Å²	2	69 Å²	69	1%	0.009	34%	0.336	C	S	.	.	H	α-helix	trans	-59.4	-34.9	176.2	-170.9	-84.1	0	0	0	112.5	L511 K512 K517 Q519 W543 F544 T547 R548 V551 W558 F566	L511-F515 VanDerWaalsContact O-CB 3.31Å; L511-F515 WeakPolarHBondContact O-CB 3.39Å; L511-F515 PolarHBondContact O-N 2.98Å; K512-F515 PolarHBondContact O-N 2.99Å; F515-K517 VanDerWaalsContact C-N 3.25Å; F515-K517 PolarHBondContact O-N 3.28Å; F515-Q519 HydrophobicContact CD1-CG 4.26Å; F515-Q519 HydrophobicContact CE1-CG 3.9Å; F515-Q519 HydrophobicContact CE2-CB 4.14Å; F515-Q519 HydrophobicContact CE2-CG 4.39Å; F515-Q519 HydrophobicContact CZ-CB 4.11Å; F515-Q519 HydrophobicContact CZ-CG 3.96Å; F515-Q519 WeakPolarHBondContact O-CG 3.39Å; F515-Q519 PolarHBondContact O-NE2 2.95Å; F515-W543 HydrophobicContact CB-CH2 3.99Å; F515-W543 HydrophobicContact CB-CZ3 4Å; F515-W543 HydrophobicContact CD2-CH2 4.39Å; F515-W543 AromaticContact CD2-CZ3 3.98Å; F515-W543 HydrophobicContact CD2-CZ3 3.98Å; F515-W543 HydrophobicContact CG-CH2 4.36Å; F515-W543 HydrophobicContact CG-CZ3 4.32Å; F515-F544 HydrophobicContact CB-CE1 4.05Å; F515-F544 HydrophobicContact CB-CZ 4.35Å; F515-F544 AromaticContact CD2-CD1 3.67Å; F515-F544 HydrophobicContact CD2-CD1 3.67Å; F515-F544 AromaticContact CD2-CE1 3.7Å; F515-F544 HydrophobicContact CD2-CE1 3.7Å; F515-F544 HydrophobicContact CE2-CD1 4.27Å; F515-F544 HydrophobicContact CG-CE1 4.33Å; F515-T547 HydrophobicContact CD1-CG2 4.14Å; F515-T547 HydrophobicContact CD2-CG2 3.66Å; F515-T547 HydrophobicContact CE1-CG2 3.94Å; F515-T547 HydrophobicContact CE2-CG2 3.42Å; F515-T547 VanDerWaalsContact CE2-CG2 3.42Å; F515-T547 HydrophobicContact CG-CG2 4.02Å; F515-T547 HydrophobicContact CZ-CG2 3.59Å; F515-R548 HydrophobicContact CE2-CG 3.84Å; F515-R548 HydrophobicContact CZ-CG 4.11Å; F515-V551 HydrophobicContact CE1-CG2 4.09Å; F515-V551 HydrophobicContact CZ-CG2 4.1Å; F515-W558 HydrophobicContact CD1-CH2 4.26Å; F515-F566 HydrophobicContact CD1-CE2 4.34Å; F515-F566 HydrophobicContact CE1-CD2 4.38Å; F515-F566 AromaticContact CE1-CE2 3.92Å; F515-F566 HydrophobicContact CE1-CE2 3.92Å; F515-F566 HydrophobicContact CE1-CZ 4.49Å
516	L	84.6	Confident	88.2	Confident	80 Å²	80	62.7 Å²	62.7	42%	0.419	31%	0.308	S	S	.	.	H	α-helix	trans	-68.7	-21.5	174.8	-70.1	177.4	0	0	0	113.6	K512 H514 W558 V562 F566	K512-L516 WeakPolarHBondContact O-CG 3.4Å; K512-L516 PolarHBondContact O-N 2.91Å; H514-L516 PolarHBondContact O-N 3.34Å; L516-W558 HydrophobicContact CD2-CZ3 4.01Å; L516-W558 HydrophobicContact CG-CZ3 4.22Å; L516-V562 HydrophobicContact CD2-CG2 4.13Å; L516-F566 HydrophobicContact CD2-CE2 4.41Å; L516-F566 HydrophobicContact CD2-CZ 3.99Å
517	K	80.3	Confident	88.5	Confident	163 Å²	163	57.9 Å²	57.9	71%	0.709	29%	0.289	S	S	*	.	H	α-helix	trans	-90.7	-52.6	174.9	-64.9	178.2	-179.3	-176.6	0	111.9	H514 F515	H514-K517 PolarHBondContact O-N 3.22Å; F515-K517 VanDerWaalsContact C-N 3.25Å; F515-K517 PolarHBondContact O-N 3.28Å
518	C	81.8	Confident	88.6	Confident	52 Å²	52	61.4 Å²	61.4	35%	0.351	31%	0.305	S	S	.	.			trans	-139.8	114.5	-174.6	-53.8	0	0	0	0	109.4	H514 W520 F544	H514-C518 PolarHBondContact O-N 2.96Å; C518-W520 VanDerWaalsContact C-N 3.35Å; C518-F544 WeakPolarHBondContact O-CE1 3.43Å
519	Q	84.4	Confident	88.7	Confident	8 Å²	8	59.1 Å²	59.1	4%	0.037	29%	0.294	C	S	.	.	S	Bend	trans	-86.4	-13	-177	-51.4	70.3	49	0	0	111.9	F515 R548 F566	F515-Q519 HydrophobicContact CD1-CG 4.26Å; F515-Q519 HydrophobicContact CE1-CG 3.9Å; F515-Q519 HydrophobicContact CE2-CB 4.14Å; F515-Q519 HydrophobicContact CE2-CG 4.39Å; F515-Q519 HydrophobicContact CZ-CB 4.11Å; F515-Q519 HydrophobicContact CZ-CG 3.96Å; F515-Q519 WeakPolarHBondContact O-CG 3.39Å; F515-Q519 PolarHBondContact O-NE2 2.95Å; Q519-R548 WeakPolarHBondContact O-CD 3.41Å; Q519-R548 PolarHBondContact O-NH1 3.28Å; Q519-F566 VanDerWaalsContact CD-CD1 3.48Å; Q519-F566 VanDerWaalsContact CD-CE1 3.45Å; Q519-F566 HydrophobicContact CG-CD1 3.9Å; Q519-F566 HydrophobicContact CG-CD2 4.48Å; Q519-F566 HydrophobicContact CG-CE1 3.92Å; Q519-F566 HydrophobicContact CG-CE2 4.47Å; Q519-F566 HydrophobicContact CG-CG 4.21Å; Q519-F566 HydrophobicContact CG-CZ 4.21Å
520	W	84.9	Confident	88.9	Confident	125 Å²	125	58.5 Å²	58.5	47%	0.473	29%	0.292	S	S	.	.	S	Bend	trans	-125.1	75.1	175.1	-59.5	101.5	0	0	0	110.2	C518 R548 L570	C518-W520 VanDerWaalsContact C-N 3.35Å; W520-R548 VanDerWaalsContact CE3-CZ 3.43Å; W520-R548 VanDerWaalsContact CZ3-CZ 3.44Å; W520-R548 VanDerWaalsContact CZ3-NE 3.28Å; W520-L570 HydrophobicContact CZ2-CD1 4.3Å
521	P	89.6	Confident	88.9	Confident	10 Å²	10	64.1 Å²	64.1	7%	0.065	31%	0.312	C	S	.	.			trans	-56.5	144.7	-177.6	-26.2	33	0	0	0	113.8	E525 Y526 L529 F544	P521-E525 WeakPolarHBondContact CA-OE2 3.34Å; P521-E525 HydrophobicContact CB-CB 3.82Å; P521-Y526 HydrophobicContact CB-CD1 4.06Å; P521-Y526 HydrophobicContact CB-CD2 4.05Å; P521-Y526 HydrophobicContact CB-CE1 3.96Å; P521-Y526 HydrophobicContact CB-CE2 3.95Å; P521-Y526 HydrophobicContact CB-CG 4.1Å; P521-Y526 HydrophobicContact CG-CD1 4.38Å; P521-Y526 HydrophobicContact CG-CE1 3.92Å; P521-Y526 WeakPolarHBondContact O-CD2 3.44Å; P521-Y526 WeakPolarHBondContact O-CE2 3.33Å; P521-L529 HydrophobicContact CB-CD1 4.28Å; P521-L529 HydrophobicContact CG-CD1 4.08Å; P521-F544 HydrophobicContact CG-CD1 3.72Å; P521-F544 HydrophobicContact CG-CD2 4.42Å; P521-F544 HydrophobicContact CG-CE1 3.37Å; P521-F544 HydrophobicContact CG-CE2 4.14Å; P521-F544 HydrophobicContact CG-CG 4.25Å; P521-F544 HydrophobicContact CG-CZ 3.61Å
522	T	88.9	Confident	88.8	Confident	63 Å²	63	70 Å²	70	39%	0.387	34%	0.343	S	S	.	.			trans	-66.4	170.9	170.2	59.1	0	0	0	0	111.8	E524 E525 Y526	T522-E524 PolarHBondContact O-N 2.94Å; T522-E525 WeakPolarHBondContact CB-OE1 3.28Å; T522-E525 WeakPolarHBondContact CG2-OE1 3.13Å; T522-E525 PolarHBondContact N-OE2 2.82Å; T522-E525 PolarHBondContact O-N 3.25Å; T522-E525 WeakPolarHBondContact OG1-CB 3.18Å; T522-E525 VanDerWaalsContact OG1-CG 3.26Å; T522-E525 WeakPolarHBondContact OG1-CG 3.36Å; T522-E525 PolarHBondContact OG1-N 2.83Å; T522-E525 VanDerWaalsContact OG1-N 3.17Å; T522-E525 PolarHBondContact OG1-OE1 2.77Å; T522-Y526 WeakPolarHBondContact O-CD2 3.44Å; T522-Y526 PolarHBondContact O-N 3.11Å
523	S	88.9	Confident	88.9	Confident	57 Å²	57	67.4 Å²	67.4	40%	0.399	33%	0.333	S	S	.	.	H	α-helix	trans	-61.6	-31.3	176.4	166.3	0	0	0	0	111.8	T527 R537	S523-T527 PolarHBondContact O-N 3.4Å; S523-T527 PolarHBondContact O-OG1 3.44Å; S523-R537 PolarHBondContact O-NH1 2.61Å; S523-R537 PolarHBondContact O-NH2 3.11Å; S523-R537 VanDerWaalsContact O-NH2 3.14Å; S523-R537 PolarHBondContact OG-NH2 2.6Å
524	E	91.1	Very high	88.9	Confident	122 Å²	122	64.2 Å²	64.2	57%	0.57	34%	0.335	S	S	*	.	H	α-helix	trans	-75.9	-51.3	-177.2	-65.4	54.3	-117.8	0	0	108.5	T522 Y526 T527 E528	T522-E524 PolarHBondContact O-N 2.94Å; E524-Y526 PolarHBondContact O-N 2.88Å; E524-T527 CarbonylContact O-C 3.58Å; E524-T527 VanDerWaalsContact O-CA 3.31Å; E524-T527 WeakPolarHBondContact O-CA 3.46Å; E524-T527 WeakPolarHBondContact O-CB 3.47Å; E524-T527 PolarHBondContact O-N 3.29Å; E524-E528 PolarHBondContact O-N 2.89Å
525	E	90.5	Very high	89	Confident	45 Å²	45	63.4 Å²	63.4	21%	0.21	33%	0.332	C	S	.	.	H	α-helix	trans	-58.9	-40.6	172.6	-72.5	154.2	-123	0	0	112.8	H514 P521 T522 T527 E528 L529	H514-E525 IonicContact CE1-OE2 4Å; H514-E525 PolarHBondContact CE1-OE2 3.14Å; H514-E525 IonicContact NE2-OE2 2.83Å; P521-E525 WeakPolarHBondContact CA-OE2 3.34Å; P521-E525 HydrophobicContact CB-CB 3.82Å; T522-E525 WeakPolarHBondContact CB-OE1 3.28Å; T522-E525 WeakPolarHBondContact CG2-OE1 3.13Å; T522-E525 PolarHBondContact N-OE2 2.82Å; T522-E525 PolarHBondContact O-N 3.25Å; T522-E525 WeakPolarHBondContact OG1-CB 3.18Å; T522-E525 VanDerWaalsContact OG1-CG 3.26Å; T522-E525 WeakPolarHBondContact OG1-CG 3.36Å; T522-E525 PolarHBondContact OG1-N 2.83Å; T522-E525 VanDerWaalsContact OG1-N 3.17Å; T522-E525 PolarHBondContact OG1-OE1 2.77Å; E525-T527 PolarHBondContact O-N 3.33Å; E525-E528 PolarHBondContact O-N 3.28Å; E525-L529 WeakPolarHBondContact O-CB 3.41Å; E525-L529 WeakPolarHBondContact O-CG 3.39Å; E525-L529 PolarHBondContact O-N 3.49Å
526	Y	92.4	Very high	89.1	Confident	25 Å²	25	67 Å²	67	10%	0.098	36%	0.355	C	S	.	.	H	α-helix	trans	-61.6	-29.2	171.6	-80.6	-57.4	0	0	0	112.2	P521 T522 E524 L529 V530 V540 I541 F544	P521-Y526 HydrophobicContact CB-CD1 4.06Å; P521-Y526 HydrophobicContact CB-CD2 4.05Å; P521-Y526 HydrophobicContact CB-CE1 3.96Å; P521-Y526 HydrophobicContact CB-CE2 3.95Å; P521-Y526 HydrophobicContact CB-CG 4.1Å; P521-Y526 HydrophobicContact CG-CD1 4.38Å; P521-Y526 HydrophobicContact CG-CE1 3.92Å; P521-Y526 WeakPolarHBondContact O-CD2 3.44Å; P521-Y526 WeakPolarHBondContact O-CE2 3.33Å; T522-Y526 WeakPolarHBondContact O-CD2 3.44Å; T522-Y526 PolarHBondContact O-N 3.11Å; E524-Y526 PolarHBondContact O-N 2.88Å; Y526-L529 HydrophobicContact CD1-CD1 4.49Å; Y526-V530 WeakPolarHBondContact O-CG2 3.24Å; Y526-V530 PolarHBondContact O-N 3.17Å; Y526-V540 HydrophobicContact CD1-CG1 3.88Å; Y526-V540 HydrophobicContact CE1-CG1 4.28Å; Y526-I541 HydrophobicContact CD1-CG1 3.76Å; Y526-I541 HydrophobicContact CD2-CG1 4.33Å; Y526-I541 HydrophobicContact CE1-CB 4.39Å; Y526-I541 HydrophobicContact CE1-CG1 3.65Å; Y526-I541 HydrophobicContact CE2-CG1 4.24Å; Y526-I541 HydrophobicContact CG-CG1 4.12Å; Y526-F544 HydrophobicContact CE1-CB 4.4Å; Y526-F544 HydrophobicContact CE1-CD2 4.15Å; Y526-F544 HydrophobicContact CE1-CG 4.26Å
527	T	92.9	Very high	89.3	Confident	52 Å²	52	67.7 Å²	67.7	32%	0.319	35%	0.352	S	S	.	.	H	α-helix	trans	-75.3	-37.9	175.5	-50.7	0	0	0	0	111.3	S523 E524 E525 V530 K531 R537	S523-T527 PolarHBondContact O-N 3.4Å; S523-T527 PolarHBondContact O-OG1 3.44Å; E524-T527 CarbonylContact O-C 3.58Å; E524-T527 VanDerWaalsContact O-CA 3.31Å; E524-T527 WeakPolarHBondContact O-CA 3.46Å; E524-T527 WeakPolarHBondContact O-CB 3.47Å; E524-T527 PolarHBondContact O-N 3.29Å; E525-T527 PolarHBondContact O-N 3.33Å; T527-V530 PolarHBondContact O-N 3.09Å; T527-K531 WeakPolarHBondContact O-CG 3.16Å; T527-K531 PolarHBondContact O-N 3.24Å; T527-R537 PolarHBondContact OG1-NH1 2.96Å
528	E	92.5	Very high	89.7	Confident	112 Å²	112	63.3 Å²	63.3	52%	0.523	35%	0.346	S	S	.	.	H	α-helix	trans	-68.8	-43.7	174	-63.5	-166.6	153.8	0	0	112.2	E524 E525 V530 K531 L532	E524-E528 PolarHBondContact O-N 2.89Å; E525-E528 PolarHBondContact O-N 3.28Å; E528-V530 VanDerWaalsContact C-N 3.27Å; E528-V530 PolarHBondContact O-N 3.49Å; E528-K531 WeakPolarHBondContact O-CB 3.41Å; E528-K531 PolarHBondContact O-N 3.12Å; E528-L532 WeakPolarHBondContact O-CB 3.22Å; E528-L532 WeakPolarHBondContact O-CG 3.4Å; E528-L532 PolarHBondContact O-N 3.29Å
529	L	92.1	Very high	90	Very high	1 Å²	1	62 Å²	62	1%	0.005	34%	0.335	C	S	.	.	H	α-helix	trans	-57.9	-37.9	173.5	-79.2	167.9	0	0	0	112.6	V510 L511 H514 P521 E525 Y526 T533 V540 F544	V510-L529 HydrophobicContact CG1-CD2 4.36Å; L511-L529 HydrophobicContact CD2-CD2 4.3Å; H514-L529 HydrophobicContact CB-CD2 3.78Å; P521-L529 HydrophobicContact CB-CD1 4.28Å; P521-L529 HydrophobicContact CG-CD1 4.08Å; E525-L529 WeakPolarHBondContact O-CB 3.41Å; E525-L529 WeakPolarHBondContact O-CG 3.39Å; E525-L529 PolarHBondContact O-N 3.49Å; Y526-L529 HydrophobicContact CD1-CD1 4.49Å; L529-T533 WeakPolarHBondContact O-CB 3.4Å; L529-T533 WeakPolarHBondContact O-CG2 3.48Å; L529-T533 PolarHBondContact O-N 3.03Å; L529-T533 PolarHBondContact O-OG1 2.86Å; L529-V540 HydrophobicContact CB-CG1 3.97Å; L529-V540 HydrophobicContact CD1-CG1 4.16Å; L529-F544 HydrophobicContact CD1-CE2 3.62Å; L529-F544 HydrophobicContact CD1-CZ 3.85Å
530	V	92.9	Very high	90.3	Very high	41 Å²	41	61.6 Å²	61.6	25%	0.248	33%	0.334	C	S	.	.	H	α-helix	trans	-63.8	-44.8	172.9	164.6	0	0	0	0	111.2	Y526 T527 E528 G534 R537 V540	Y526-V530 WeakPolarHBondContact O-CG2 3.24Å; Y526-V530 PolarHBondContact O-N 3.17Å; T527-V530 PolarHBondContact O-N 3.09Å; E528-V530 VanDerWaalsContact C-N 3.27Å; E528-V530 PolarHBondContact O-N 3.49Å; V530-G534 WeakPolarHBondContact O-CA 3.39Å; V530-G534 PolarHBondContact O-N 3.15Å; V530-R537 VanDerWaalsContact CG2-CA 3.45Å; V530-R537 HydrophobicContact CG2-CB 3.7Å; V530-R537 HydrophobicContact CG2-CG 4.07Å; V530-V540 HydrophobicContact CG2-CG2 4.11Å
531	K	92	Very high	90.6	Very high	161 Å²	161	59 Å²	59	70%	0.7	33%	0.328	S	S	*	.	H	α-helix	trans	-62.4	-45.5	175.5	-67.1	168.3	-176.9	173.2	0	112.1	T527 E528	T527-K531 WeakPolarHBondContact O-CG 3.16Å; T527-K531 PolarHBondContact O-N 3.24Å; E528-K531 WeakPolarHBondContact O-CB 3.41Å; E528-K531 PolarHBondContact O-N 3.12Å
532	L	89.8	Confident	90.7	Very high	123 Å²	123	62.7 Å²	62.7	64%	0.644	35%	0.345	S	S	*	.	H	α-helix	trans	-72.9	-29.6	-175.8	-69.7	172.4	0	0	0	113.6	V510 E528	V510-L532 HydrophobicContact CG1-CB 4.25Å; E528-L532 WeakPolarHBondContact O-CB 3.22Å; E528-L532 WeakPolarHBondContact O-CG 3.4Å; E528-L532 PolarHBondContact O-N 3.29Å
533	T	90.6	Very high	91	Very high	8 Å²	8	61.1 Å²	61.1	5%	0.049	33%	0.332	C	S	.	.	H	α-helix	trans	-100.9	-20.3	-179.6	62.8	0	0	0	0	113.7	Q507 V510 L511 L529 L535	Q507-T533 WeakPolarHBondContact CG-O 3.46Å; Q507-T533 PolarHBondContact NE2-O 3.06Å; V510-T533 HydrophobicContact CB-CG2 4.24Å; V510-T533 HydrophobicContact CG1-CG2 3.9Å; L511-T533 HydrophobicContact CD2-CG2 4.32Å; L511-T533 HydrophobicContact CG-CG2 4.09Å; L529-T533 WeakPolarHBondContact O-CB 3.4Å; L529-T533 WeakPolarHBondContact O-CG2 3.48Å; L529-T533 PolarHBondContact O-N 3.03Å; L529-T533 PolarHBondContact O-OG1 2.86Å; T533-L535 PolarHBondContact O-N 2.81Å; T533-L535 WeakPolarHBondContact OG1-CB 3.42Å; T533-L535 PolarHBondContact OG1-N 3.09Å
534	G	89.7	Confident	91.1	Very high	64 Å²	64	58.4 Å²	58.4	66%	0.66	31%	0.313	S	S	*	.			trans	65.4	12.5	-169.5	0	0	0	0	0	114	V530	V530-G534 WeakPolarHBondContact O-CA 3.39Å; V530-G534 PolarHBondContact O-N 3.15Å
535	L	89.8	Confident	91.2	Very high	18 Å²	18	53.9 Å²	53.9	9%	0.094	30%	0.299	C	S	.	.			trans	-88.9	146.3	179.3	-67.6	170.7	0	0	0	111.1	K503 Q507 L511 T533 V540	K503-L535 HydrophobicContact CD-CD1 3.89Å; K503-L535 HydrophobicContact CG-CD1 3.94Å; K503-L535 HydrophobicContact CG-CD2 4.03Å; Q507-L535 HydrophobicContact CB-CD1 4.14Å; Q507-L535 HydrophobicContact CG-CD1 4.37Å; Q507-L535 HydrophobicContact CG-CG 4.4Å; L511-L535 HydrophobicContact CD1-CD1 3.94Å; T533-L535 PolarHBondContact O-N 2.81Å; T533-L535 WeakPolarHBondContact OG1-CB 3.42Å; T533-L535 PolarHBondContact OG1-N 3.09Å; L535-V540 HydrophobicContact CB-CG2 3.9Å
536	P	90.4	Very high	91.1	Very high	76 Å²	76	56 Å²	56	49%	0.494	31%	0.312	S	S	.	.			trans	-55.5	141.5	172.4	-25	34	0	0	0	112.1	A538 D539 V540	P536-A538 PolarHBondContact O-N 3.32Å; P536-A538 VanDerWaalsContact O-N 3.09Å; P536-D539 HydrophobicContact CB-CB 4.39Å; P536-D539 WeakPolarHBondContact O-CA 3.42Å; P536-D539 WeakPolarHBondContact O-CB 3.39Å; P536-D539 PolarHBondContact O-N 2.99Å; P536-V540 PolarHBondContact O-N 2.91Å; P536-V540 VanDerWaalsContact O-N 3.12Å
537	R	89.1	Confident	90.9	Very high	96 Å²	96	55.3 Å²	55.3	36%	0.362	31%	0.31	S	S	.	.	H	α-helix	trans	-53.5	-36.2	-179	-167.9	170.8	172.4	144.4	-6	112.9	S523 T527 V530 V540 I541	S523-R537 PolarHBondContact O-NH1 2.61Å; S523-R537 PolarHBondContact O-NH2 3.11Å; S523-R537 VanDerWaalsContact O-NH2 3.14Å; S523-R537 PolarHBondContact OG-NH2 2.6Å; T527-R537 PolarHBondContact OG1-NH1 2.96Å; V530-R537 VanDerWaalsContact CG2-CA 3.45Å; V530-R537 HydrophobicContact CG2-CB 3.7Å; V530-R537 HydrophobicContact CG2-CG 4.07Å; R537-V540 PolarHBondContact O-N 3.19Å; R537-I541 HydrophobicContact CG-CD1 3.88Å; R537-I541 HydrophobicContact CG-CG1 4.47Å; R537-I541 WeakPolarHBondContact O-CB 3.29Å; R537-I541 VanDerWaalsContact O-CG1 3.29Å; R537-I541 WeakPolarHBondContact O-CG1 3.49Å; R537-I541 PolarHBondContact O-N 3.01Å
538	A	88.8	Confident	90.7	Very high	70 Å²	70	55.1 Å²	55.1	58%	0.579	30%	0.303	S	S	*	.	H	α-helix	trans	-63.4	-40.9	173.7	0	0	0	0	0	113.1	P536 V540 Q542	P536-A538 PolarHBondContact O-N 3.32Å; P536-A538 VanDerWaalsContact O-N 3.09Å; A538-V540 VanDerWaalsContact C-N 3.33Å; A538-Q542 WeakPolarHBondContact O-CB 3.41Å; A538-Q542 PolarHBondContact O-N 3.41Å
539	D	88.6	Confident	90.4	Very high	24 Å²	24	57.6 Å²	57.6	13%	0.128	31%	0.309	C	S	.	.	H	α-helix	trans	-70	-28.9	177.7	-98.9	-55.1	0	0	0	112.9	R500 K503 P536 W543	R500-D539 IonicContact NH1-OD1 2.6Å; R500-D539 PolarHBondContact NH1-OD1 3.11Å; R500-D539 IonicContact NH1-OD2 2.82Å; K503-D539 WeakPolarHBondContact CE-O 3.49Å; K503-D539 IonicContact NZ-OD1 2.92Å; K503-D539 PolarHBondContact NZ-OD1 3.32Å; P536-D539 HydrophobicContact CB-CB 4.39Å; P536-D539 WeakPolarHBondContact O-CA 3.42Å; P536-D539 WeakPolarHBondContact O-CB 3.39Å; P536-D539 PolarHBondContact O-N 2.99Å; D539-W543 VanDerWaalsContact O-CB 3.29Å; D539-W543 WeakPolarHBondContact O-CB 3.27Å; D539-W543 PolarHBondContact O-N 2.97Å; D539-W543 VanDerWaalsContact O-N 3.15Å
540	V	90.6	Very high	90.1	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-72.6	-53	171.9	178.7	0	0	0	0	110.4	L511 Y526 L529 V530 L535 P536 R537 A538 Q542 W543 F544	L511-V540 HydrophobicContact CD2-CG1 3.94Å; Y526-V540 HydrophobicContact CD1-CG1 3.88Å; Y526-V540 HydrophobicContact CE1-CG1 4.28Å; L529-V540 HydrophobicContact CB-CG1 3.97Å; L529-V540 HydrophobicContact CD1-CG1 4.16Å; V530-V540 HydrophobicContact CG2-CG2 4.11Å; L535-V540 HydrophobicContact CB-CG2 3.9Å; P536-V540 PolarHBondContact O-N 2.91Å; P536-V540 VanDerWaalsContact O-N 3.12Å; R537-V540 PolarHBondContact O-N 3.19Å; A538-V540 VanDerWaalsContact C-N 3.33Å; V540-Q542 VanDerWaalsContact C-N 3.31Å; V540-Q542 PolarHBondContact O-N 2.85Å; V540-W543 PolarHBondContact O-N 3.49Å; V540-W543 VanDerWaalsContact O-N 3.16Å; V540-F544 HydrophobicContact CG1-CD2 4.05Å; V540-F544 HydrophobicContact CG1-CE2 4.19Å; V540-F544 WeakPolarHBondContact O-CD2 3.08Å; V540-F544 PolarHBondContact O-N 2.92Å
541	I	91.6	Very high	89.6	Confident	71 Å²	71	57.2 Å²	57.2	36%	0.364	31%	0.309	S	S	.	.	H	α-helix	trans	-57.7	-44.3	178.3	-69.7	167.6	0	0	0	110.8	Y526 R537 F544 G545	Y526-I541 HydrophobicContact CD1-CG1 3.76Å; Y526-I541 HydrophobicContact CD2-CG1 4.33Å; Y526-I541 HydrophobicContact CE1-CB 4.39Å; Y526-I541 HydrophobicContact CE1-CG1 3.65Å; Y526-I541 HydrophobicContact CE2-CG1 4.24Å; Y526-I541 HydrophobicContact CG-CG1 4.12Å; R537-I541 HydrophobicContact CG-CD1 3.88Å; R537-I541 HydrophobicContact CG-CG1 4.47Å; R537-I541 WeakPolarHBondContact O-CB 3.29Å; R537-I541 VanDerWaalsContact O-CG1 3.29Å; R537-I541 WeakPolarHBondContact O-CG1 3.49Å; R537-I541 PolarHBondContact O-N 3.01Å; I541-F544 PolarHBondContact O-N 2.96Å; I541-G545 PolarHBondContact O-N 2.99Å
542	Q	92.1	Very high	88.9	Confident	87 Å²	87	57.1 Å²	57.1	41%	0.407	31%	0.309	S	S	.	.	H	α-helix	trans	-62.4	-46.1	176.7	-165	-156.9	-53.1	0	0	111.2	A538 V540 F544 G545 D546	A538-Q542 WeakPolarHBondContact O-CB 3.41Å; A538-Q542 PolarHBondContact O-N 3.41Å; V540-Q542 VanDerWaalsContact C-N 3.31Å; V540-Q542 PolarHBondContact O-N 2.85Å; Q542-F544 VanDerWaalsContact C-N 3.3Å; Q542-F544 PolarHBondContact O-N 2.99Å; Q542-G545 WeakPolarHBondContact O-CA 3.3Å; Q542-G545 PolarHBondContact O-N 3.05Å; Q542-G545 VanDerWaalsContact O-N 3.1Å; Q542-D546 PolarHBondContact NE2-OD2 2.61Å; Q542-D546 WeakPolarHBondContact O-CB 3.45Å; Q542-D546 PolarHBondContact O-N 3.47Å
543	W	93.8	Very high	88.3	Confident	31 Å²	31	55 Å²	55	12%	0.117	30%	0.298	C	S	.	.	H	α-helix	trans	-59.5	-40.3	177.3	-178.7	95.1	0	0	0	112.2	L511 K512 F515 D539 V540 T547	L511-W543 VanDerWaalsContact C-CH2 3.48Å; L511-W543 HydrophobicContact CB-CD2 4.02Å; L511-W543 HydrophobicContact CB-CE3 3.86Å; L511-W543 HydrophobicContact CB-CH2 3.7Å; L511-W543 HydrophobicContact CB-CZ2 3.82Å; L511-W543 HydrophobicContact CB-CZ3 3.72Å; L511-W543 HydrophobicContact CD1-CD2 3.94Å; L511-W543 HydrophobicContact CD1-CE3 4.35Å; L511-W543 HydrophobicContact CD1-CG 4.02Å; L511-W543 HydrophobicContact CD2-CD2 4.48Å; L511-W543 HydrophobicContact CD2-CE3 4.09Å; L511-W543 HydrophobicContact CG-CD2 4.38Å; L511-W543 HydrophobicContact CG-CE3 4.33Å; L511-W543 WeakPolarHBondContact O-CH2 3.34Å; L511-W543 WeakPolarHBondContact O-CZ3 3.42Å; K512-W543 HydrophobicContact CG-CH2 4.43Å; K512-W543 HydrophobicContact CG-CZ2 4.24Å; F515-W543 HydrophobicContact CB-CH2 3.99Å; F515-W543 HydrophobicContact CB-CZ3 4Å; F515-W543 HydrophobicContact CD2-CH2 4.39Å; F515-W543 AromaticContact CD2-CZ3 3.98Å; F515-W543 HydrophobicContact CD2-CZ3 3.98Å; F515-W543 HydrophobicContact CG-CH2 4.36Å; F515-W543 HydrophobicContact CG-CZ3 4.32Å; D539-W543 VanDerWaalsContact O-CB 3.29Å; D539-W543 WeakPolarHBondContact O-CB 3.27Å; D539-W543 PolarHBondContact O-N 2.97Å; D539-W543 VanDerWaalsContact O-N 3.15Å; V540-W543 PolarHBondContact O-N 3.49Å; V540-W543 VanDerWaalsContact O-N 3.16Å; W543-T547 HydrophobicContact CH2-CG2 4.08Å; W543-T547 HydrophobicContact CZ2-CG2 4.43Å; W543-T547 HydrophobicContact CZ3-CG2 4.39Å; W543-T547 WeakPolarHBondContact O-CB 3.44Å; W543-T547 PolarHBondContact O-N 2.75Å; W543-T547 PolarHBondContact O-OG1 2.6Å
544	F	92.5	Very high	87.5	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-65.1	-40.2	174.6	-93.2	-92.9	0	0	0	112	L511 H514 F515 C518 P521 Y526 L529 V540 I541 Q542 R548	L511-F544 HydrophobicContact CD2-CD2 4.35Å; L511-F544 HydrophobicContact CD2-CE2 3.79Å; H514-F544 HydrophobicContact CB-CZ 4.29Å; F515-F544 HydrophobicContact CB-CE1 4.05Å; F515-F544 HydrophobicContact CB-CZ 4.35Å; F515-F544 AromaticContact CD2-CD1 3.67Å; F515-F544 HydrophobicContact CD2-CD1 3.67Å; F515-F544 AromaticContact CD2-CE1 3.7Å; F515-F544 HydrophobicContact CD2-CE1 3.7Å; F515-F544 HydrophobicContact CE2-CD1 4.27Å; F515-F544 HydrophobicContact CG-CE1 4.33Å; C518-F544 WeakPolarHBondContact O-CE1 3.43Å; P521-F544 HydrophobicContact CG-CD1 3.72Å; P521-F544 HydrophobicContact CG-CD2 4.42Å; P521-F544 HydrophobicContact CG-CE1 3.37Å; P521-F544 HydrophobicContact CG-CE2 4.14Å; P521-F544 HydrophobicContact CG-CG 4.25Å; P521-F544 HydrophobicContact CG-CZ 3.61Å; Y526-F544 HydrophobicContact CE1-CB 4.4Å; Y526-F544 HydrophobicContact CE1-CD2 4.15Å; Y526-F544 HydrophobicContact CE1-CG 4.26Å; L529-F544 HydrophobicContact CD1-CE2 3.62Å; L529-F544 HydrophobicContact CD1-CZ 3.85Å; V540-F544 HydrophobicContact CG1-CD2 4.05Å; V540-F544 HydrophobicContact CG1-CE2 4.19Å; V540-F544 WeakPolarHBondContact O-CD2 3.08Å; V540-F544 PolarHBondContact O-N 2.92Å; I541-F544 PolarHBondContact O-N 2.96Å; Q542-F544 VanDerWaalsContact C-N 3.3Å; Q542-F544 PolarHBondContact O-N 2.99Å; F544-R548 WeakPolarHBondContact O-CG 3.44Å; F544-R548 PolarHBondContact O-N 3.19Å
545	G	91.5	Very high	86.3	Confident	27 Å²	27	59.8 Å²	59.8	28%	0.278	31%	0.313	S	S	.	.	H	α-helix	trans	-62.2	-52.1	173.3	0	0	0	0	0	113.3	I541 Q542 T547 R548 Y549	I541-G545 PolarHBondContact O-N 2.99Å; Q542-G545 WeakPolarHBondContact O-CA 3.3Å; Q542-G545 PolarHBondContact O-N 3.05Å; Q542-G545 VanDerWaalsContact O-N 3.1Å; G545-T547 VanDerWaalsContact C-N 3.27Å; G545-T547 PolarHBondContact O-N 2.76Å; G545-R548 PolarHBondContact O-N 3.46Å; G545-Y549 WeakPolarHBondContact O-CB 3.39Å; G545-Y549 PolarHBondContact O-N 2.71Å
546	D	88.6	Confident	85.5	Confident	90 Å²	90	60.7 Å²	60.7	48%	0.481	32%	0.318	S	S	.	.	H	α-helix	trans	-57.6	-40.6	177.1	-70.3	-28.2	0	0	0	111	Q542 Y549 A550	Q542-D546 PolarHBondContact NE2-OD2 2.61Å; Q542-D546 WeakPolarHBondContact O-CB 3.45Å; Q542-D546 PolarHBondContact O-N 3.47Å; D546-Y549 PolarHBondContact O-N 3.44Å; D546-A550 WeakPolarHBondContact O-CB 3.28Å; D546-A550 PolarHBondContact O-N 2.76Å
547	T	89.3	Confident	84.2	Confident	9 Å²	9	67.7 Å²	67.7	6%	0.055	34%	0.335	C	S	.	.	H	α-helix	trans	-68.9	-47.8	178.5	-57.6	0	0	0	0	111.5	F515 W543 G545 Y549 A550 V551 L556 W558	F515-T547 HydrophobicContact CD1-CG2 4.14Å; F515-T547 HydrophobicContact CD2-CG2 3.66Å; F515-T547 HydrophobicContact CE1-CG2 3.94Å; F515-T547 HydrophobicContact CE2-CG2 3.42Å; F515-T547 VanDerWaalsContact CE2-CG2 3.42Å; F515-T547 HydrophobicContact CG-CG2 4.02Å; F515-T547 HydrophobicContact CZ-CG2 3.59Å; W543-T547 HydrophobicContact CH2-CG2 4.08Å; W543-T547 HydrophobicContact CZ2-CG2 4.43Å; W543-T547 HydrophobicContact CZ3-CG2 4.39Å; W543-T547 WeakPolarHBondContact O-CB 3.44Å; W543-T547 PolarHBondContact O-N 2.75Å; W543-T547 PolarHBondContact O-OG1 2.6Å; G545-T547 VanDerWaalsContact C-N 3.27Å; G545-T547 PolarHBondContact O-N 2.76Å; T547-Y549 VanDerWaalsContact C-N 3.29Å; T547-Y549 PolarHBondContact O-N 3.08Å; T547-A550 PolarHBondContact O-N 3.43Å; T547-V551 WeakPolarHBondContact O-CG2 3.42Å; T547-V551 PolarHBondContact O-N 2.81Å; T547-L556 HydrophobicContact CG2-CD2 3.57Å; T547-W558 HydrophobicContact CG2-CZ2 4.29Å
548	R	89.3	Confident	83.5	Confident	48 Å²	48	68.6 Å²	68.6	18%	0.181	34%	0.338	C	S	.	.	H	α-helix	trans	-57.1	-42.2	173.4	-74	-171.8	-62.7	-95.6	-0.3	111.7	F515 Q519 W520 F544 G545 V551 K552	F515-R548 HydrophobicContact CE2-CG 3.84Å; F515-R548 HydrophobicContact CZ-CG 4.11Å; Q519-R548 WeakPolarHBondContact O-CD 3.41Å; Q519-R548 PolarHBondContact O-NH1 3.28Å; W520-R548 VanDerWaalsContact CE3-CZ 3.43Å; W520-R548 VanDerWaalsContact CZ3-CZ 3.44Å; W520-R548 VanDerWaalsContact CZ3-NE 3.28Å; F544-R548 WeakPolarHBondContact O-CG 3.44Å; F544-R548 PolarHBondContact O-N 3.19Å; G545-R548 PolarHBondContact O-N 3.46Å; R548-V551 PolarHBondContact O-N 2.77Å; R548-K552 WeakPolarHBondContact O-CB 3.18Å; R548-K552 PolarHBondContact O-N 2.81Å
549	Y	85.8	Confident	82.4	Confident	164 Å²	164	65.3 Å²	65.3	64%	0.643	31%	0.311	S	S	*	.	H	α-helix	trans	-64.2	-42	176.6	-176.3	-95.8	0	0	0	112.3	G545 D546 T547 K552 N553	G545-Y549 WeakPolarHBondContact O-CB 3.39Å; G545-Y549 PolarHBondContact O-N 2.71Å; D546-Y549 PolarHBondContact O-N 3.44Å; T547-Y549 VanDerWaalsContact C-N 3.29Å; T547-Y549 PolarHBondContact O-N 3.08Å; Y549-K552 PolarHBondContact O-N 3.15Å; Y549-N553 WeakPolarHBondContact CE1-ND2 3.32Å; Y549-N553 VanDerWaalsContact CE2-ND2 3.34Å; Y549-N553 WeakPolarHBondContact CE2-ND2 3.43Å; Y549-N553 VanDerWaalsContact CZ-ND2 3.32Å; Y549-N553 PolarHBondContact O-N 2.82Å; Y549-N553 VanDerWaalsContact O-N 3.12Å; Y549-N553 PolarHBondContact O-ND2 3.24Å
550	A	84.4	Confident	81	Confident	21 Å²	21	72.1 Å²	72.1	17%	0.174	34%	0.339	C	S	.	.	H	α-helix	trans	-67.5	-34.3	177	0	0	0	0	0	113.1	D546 T547 G554 Q555 L556	D546-A550 WeakPolarHBondContact O-CB 3.28Å; D546-A550 PolarHBondContact O-N 2.76Å; T547-A550 PolarHBondContact O-N 3.43Å; A550-G554 PolarHBondContact O-N 3.38Å; A550-Q555 HydrophobicContact CB-CB 4.4Å; A550-Q555 PolarHBondContact O-N 3.32Å; A550-L556 HydrophobicContact CB-CB 4.07Å; A550-L556 HydrophobicContact CB-CD1 4.06Å; A550-L556 HydrophobicContact CB-CD2 4.44Å; A550-L556 HydrophobicContact CB-CG 4.43Å; A550-L556 PolarHBondContact O-N 3.48Å
551	V	83.5	Confident	79.5	Confident	13 Å²	13	75.6 Å²	75.6	8%	0.079	38%	0.375	C	S	.	.	H	α-helix	trans	-65.5	-52.3	172.1	173.8	0	0	0	0	110.6	F515 T547 R548 N553 G554 L556 V559 R563 F566	F515-V551 HydrophobicContact CE1-CG2 4.09Å; F515-V551 HydrophobicContact CZ-CG2 4.1Å; T547-V551 WeakPolarHBondContact O-CG2 3.42Å; T547-V551 PolarHBondContact O-N 2.81Å; R548-V551 PolarHBondContact O-N 2.77Å; V551-N553 PolarHBondContact O-N 3.08Å; V551-G554 PolarHBondContact O-N 3.41Å; V551-L556 HydrophobicContact CG2-CB 4.14Å; V551-L556 HydrophobicContact CG2-CD2 3.56Å; V551-L556 HydrophobicContact CG2-CG 4.49Å; V551-V559 HydrophobicContact CG1-CG1 4.01Å; V551-V559 HydrophobicContact CG2-CB 4.13Å; V551-V559 HydrophobicContact CG2-CG1 3.83Å; V551-V559 HydrophobicContact CG2-CG2 4.05Å; V551-R563 HydrophobicContact CG1-CG 4.09Å; V551-F566 HydrophobicContact CG1-CD2 4.44Å
552	K	76.5	Confident	78	Confident	160 Å²	160	74.2 Å²	74.2	70%	0.696	37%	0.37	S	S	*	.	H	α-helix	trans	-57.5	-33.9	-179.2	-175.4	170.6	-177.6	170.8	0	113.1	R548 Y549	R548-K552 WeakPolarHBondContact O-CB 3.18Å; R548-K552 PolarHBondContact O-N 2.81Å; Y549-K552 PolarHBondContact O-N 3.15Å
553	N	78.4	Confident	76.6	Confident	77 Å²	77	74.4 Å²	74.4	41%	0.412	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	11.9	178.4	-66.6	-73.7	0	0	0	114.1	Y549 V551 Q555	Y549-N553 WeakPolarHBondContact CE1-ND2 3.32Å; Y549-N553 VanDerWaalsContact CE2-ND2 3.34Å; Y549-N553 WeakPolarHBondContact CE2-ND2 3.43Å; Y549-N553 VanDerWaalsContact CZ-ND2 3.32Å; Y549-N553 PolarHBondContact O-N 2.82Å; Y549-N553 VanDerWaalsContact O-N 3.12Å; Y549-N553 PolarHBondContact O-ND2 3.24Å; V551-N553 PolarHBondContact O-N 3.08Å; N553-Q555 HydrophobicContact CB-CG 4.28Å; N553-Q555 PolarHBondContact O-N 3.45Å; N553-Q555 VanDerWaalsContact O-N 3.08Å
554	G	72.3	Confident	75.2	Confident	40 Å²	40	77.5 Å²	77.5	41%	0.412	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.1	9.5	175.9	0	0	0	0	0	115.9	A550 V551 L556	A550-G554 PolarHBondContact O-N 3.38Å; V551-G554 PolarHBondContact O-N 3.41Å; G554-L556 VanDerWaalsContact C-N 3.33Å
555	Q	66.3	Low	73.8	Confident	133 Å²	133	83.7 Å²	83.7	62%	0.621	41%	0.412	S	S	*	.			trans	-74.8	-25.7	-177.8	-63.3	-62.8	-43.9	0	0	112.3	A550 N553 R557	A550-Q555 HydrophobicContact CB-CB 4.4Å; A550-Q555 PolarHBondContact O-N 3.32Å; N553-Q555 HydrophobicContact CB-CG 4.28Å; N553-Q555 PolarHBondContact O-N 3.45Å; N553-Q555 VanDerWaalsContact O-N 3.08Å; Q555-R557 PolarHBondContact O-N 2.95Å; Q555-R557 VanDerWaalsContact O-N 3.14Å
556	L	72.1	Confident	72.6	Confident	38 Å²	38	83 Å²	83	20%	0.199	40%	0.401	C	S	.	.			trans	-90	80.4	-168.2	-151	66.7	0	0	0	112.6	T547 A550 V551 G554 W558 V559	T547-L556 HydrophobicContact CG2-CD2 3.57Å; A550-L556 HydrophobicContact CB-CB 4.07Å; A550-L556 HydrophobicContact CB-CD1 4.06Å; A550-L556 HydrophobicContact CB-CD2 4.44Å; A550-L556 HydrophobicContact CB-CG 4.43Å; A550-L556 PolarHBondContact O-N 3.48Å; V551-L556 HydrophobicContact CG2-CB 4.14Å; V551-L556 HydrophobicContact CG2-CD2 3.56Å; V551-L556 HydrophobicContact CG2-CG 4.49Å; G554-L556 VanDerWaalsContact C-N 3.33Å; L556-W558 HydrophobicContact CD2-CZ2 3.67Å; L556-W558 HydrophobicContact CG-CZ2 4.29Å; L556-W558 PolarHBondContact O-N 3.16Å; L556-W558 VanDerWaalsContact O-N 3.1Å; L556-V559 HydrophobicContact CD2-CG2 3.78Å; L556-V559 HydrophobicContact CG-CG2 4.25Å; L556-V559 PolarHBondContact O-N 3.04Å
557	R	62.5	Low	71.5	Confident	222 Å²	222	82.3 Å²	82.3	84%	0.838	40%	0.397	S	S	*	.	G	3₁₀ helix	trans	-55.9	-29.9	-171.8	-56	-172.5	-166	-86.4	2.9	115.1	Q555 V559 K560	Q555-R557 PolarHBondContact O-N 2.95Å; Q555-R557 VanDerWaalsContact O-N 3.14Å; R557-V559 VanDerWaalsContact C-N 3.26Å; R557-V559 PolarHBondContact O-N 3.47Å; R557-K560 WeakPolarHBondContact O-CB 3.35Å; R557-K560 PolarHBondContact O-N 3.25Å
558	W	74.7	Confident	70.3	Confident	115 Å²	115	85 Å²	85	44%	0.436	42%	0.42	S	S	.	.	G	3₁₀ helix	trans	-74.4	-12.7	179.1	66	-96.4	0	0	0	114.1	K512 F515 L516 T547 L556	K512-W558 HydrophobicContact CB-CH2 4.01Å; K512-W558 HydrophobicContact CB-CZ3 4.26Å; K512-W558 HydrophobicContact CG-CH2 3.72Å; K512-W558 HydrophobicContact CG-CZ2 3.79Å; K512-W558 HydrophobicContact CG-CZ3 4.23Å; F515-W558 HydrophobicContact CD1-CH2 4.26Å; L516-W558 HydrophobicContact CD2-CZ3 4.01Å; L516-W558 HydrophobicContact CG-CZ3 4.22Å; T547-W558 HydrophobicContact CG2-CZ2 4.29Å; L556-W558 HydrophobicContact CD2-CZ2 3.67Å; L556-W558 HydrophobicContact CG-CZ2 4.29Å; L556-W558 PolarHBondContact O-N 3.16Å; L556-W558 VanDerWaalsContact O-N 3.1Å
559	V	66.1	Low	69.2	Low	2 Å²	2	86.2 Å²	86.2	1%	0.012	43%	0.428	C	S	.	.	G	3₁₀ helix	trans	-93.4	-1.6	176.2	172.4	0	0	0	0	112.4	V551 L556 R557 G561 V562 R563 F566	V551-V559 HydrophobicContact CG1-CG1 4.01Å; V551-V559 HydrophobicContact CG2-CB 4.13Å; V551-V559 HydrophobicContact CG2-CG1 3.83Å; V551-V559 HydrophobicContact CG2-CG2 4.05Å; L556-V559 HydrophobicContact CD2-CG2 3.78Å; L556-V559 HydrophobicContact CG-CG2 4.25Å; L556-V559 PolarHBondContact O-N 3.04Å; R557-V559 VanDerWaalsContact C-N 3.26Å; R557-V559 PolarHBondContact O-N 3.47Å; V559-G561 VanDerWaalsContact C-N 3.25Å; V559-G561 PolarHBondContact O-N 2.76Å; V559-V562 PolarHBondContact O-N 2.59Å; V559-R563 HydrophobicContact CG1-CB 4.15Å; V559-R563 PolarHBondContact O-N 3.31Å; V559-F566 HydrophobicContact CG1-CD2 3.63Å; V559-F566 HydrophobicContact CG1-CE2 3.54Å
560	K	59	Low	68.1	Low	166 Å²	166	80.6 Å²	80.6	72%	0.722	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.1	-36.7	-167.3	-168.9	-173.4	175.9	-164.4	0	115.3	R557	R557-K560 WeakPolarHBondContact O-CB 3.35Å; R557-K560 PolarHBondContact O-N 3.25Å
561	G	60	Low	67.1	Low	73 Å²	73	82 Å²	82	75%	0.753	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-34.1	177.7	0	0	0	0	0	114.9	V559	V559-G561 VanDerWaalsContact C-N 3.25Å; V559-G561 PolarHBondContact O-N 2.76Å
562	V	58.8	Low	66.1	Low	42 Å²	42	84.3 Å²	84.3	26%	0.255	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-10.5	-177.9	-152.4	0	0	0	0	111.8	L516 V559 E564 Q565 F566	L516-V562 HydrophobicContact CD2-CG2 4.13Å; V559-V562 PolarHBondContact O-N 2.59Å; V562-E564 VanDerWaalsContact C-N 3.32Å; V562-E564 PolarHBondContact O-N 2.7Å; V562-Q565 HydrophobicContact CG1-CB 4.28Å; V562-Q565 WeakPolarHBondContact O-CB 3.48Å; V562-Q565 PolarHBondContact O-N 3.26Å; V562-F566 HydrophobicContact CB-CD2 4.32Å; V562-F566 HydrophobicContact CB-CE1 4.3Å; V562-F566 HydrophobicContact CB-CE2 3.79Å; V562-F566 HydrophobicContact CB-CZ 3.77Å; V562-F566 HydrophobicContact CG1-CD1 4.04Å; V562-F566 HydrophobicContact CG1-CD2 4.38Å; V562-F566 HydrophobicContact CG1-CE1 3.44Å; V562-F566 VanDerWaalsContact CG1-CE1 3.44Å; V562-F566 HydrophobicContact CG1-CE2 3.86Å; V562-F566 HydrophobicContact CG1-CG 4.46Å; V562-F566 HydrophobicContact CG1-CZ 3.35Å; V562-F566 WeakPolarHBondContact O-CD2 3.36Å; V562-F566 VanDerWaalsContact O-CG 3.29Å; V562-F566 WeakPolarHBondContact O-CG 3.43Å; V562-F566 PolarHBondContact O-N 2.98Å
563	R	63	Low	65.2	Low	91 Å²	91	80.9 Å²	80.9	34%	0.343	43%	0.427	S	S	.	.	H	α-helix	trans	-54.2	-43	-180	-172.5	-175.9	69.2	166.6	5.5	113.1	V551 V559 F566 L567	V551-R563 HydrophobicContact CG1-CG 4.09Å; V559-R563 HydrophobicContact CG1-CB 4.15Å; V559-R563 PolarHBondContact O-N 3.31Å; R563-F566 PolarHBondContact O-N 3.17Å; R563-L567 HydrophobicContact CG-CD1 4.13Å; R563-L567 WeakPolarHBondContact O-CG 3.36Å; R563-L567 PolarHBondContact O-N 3.23Å
564	E	63.9	Low	63.8	Low	96 Å²	96	84.3 Å²	84.3	45%	0.449	44%	0.441	S	S	.	.	H	α-helix	trans	-71.3	-38.2	-178.1	-48.5	-43.2	133.6	0	0	111.3	V562 L567 A568	V562-E564 VanDerWaalsContact C-N 3.32Å; V562-E564 PolarHBondContact O-N 2.7Å; E564-L567 PolarHBondContact O-N 3.3Å; E564-A568 PolarHBondContact O-N 3.38Å
565	Q	63.3	Low	62.4	Low	130 Å²	130	87.8 Å²	87.8	61%	0.607	46%	0.459	S	S	*	.	H	α-helix	trans	-61	-44.7	171.9	-170.1	172.8	5.6	0	0	110.9	V562 L567 A568 E569	V562-Q565 HydrophobicContact CG1-CB 4.28Å; V562-Q565 WeakPolarHBondContact O-CB 3.48Å; V562-Q565 PolarHBondContact O-N 3.26Å; Q565-L567 VanDerWaalsContact C-N 3.34Å; Q565-L567 PolarHBondContact O-N 3.49Å; Q565-A568 PolarHBondContact O-N 2.77Å; Q565-E569 WeakPolarHBondContact O-CB 3.39Å; Q565-E569 PolarHBondContact O-N 3.11Å
566	F	67.6	Low	61.3	Low	12 Å²	12	83.9 Å²	83.9	5%	0.053	45%	0.454	C	S	.	.	H	α-helix	trans	-65.9	-30.7	174.6	-61.2	-28.1	0	0	0	113.8	F515 L516 Q519 V551 V559 V562 R563 L570	F515-F566 HydrophobicContact CD1-CE2 4.34Å; F515-F566 HydrophobicContact CE1-CD2 4.38Å; F515-F566 AromaticContact CE1-CE2 3.92Å; F515-F566 HydrophobicContact CE1-CE2 3.92Å; F515-F566 HydrophobicContact CE1-CZ 4.49Å; L516-F566 HydrophobicContact CD2-CE2 4.41Å; L516-F566 HydrophobicContact CD2-CZ 3.99Å; Q519-F566 VanDerWaalsContact CD-CD1 3.48Å; Q519-F566 VanDerWaalsContact CD-CE1 3.45Å; Q519-F566 HydrophobicContact CG-CD1 3.9Å; Q519-F566 HydrophobicContact CG-CD2 4.48Å; Q519-F566 HydrophobicContact CG-CE1 3.92Å; Q519-F566 HydrophobicContact CG-CE2 4.47Å; Q519-F566 HydrophobicContact CG-CG 4.21Å; Q519-F566 HydrophobicContact CG-CZ 4.21Å; V551-F566 HydrophobicContact CG1-CD2 4.44Å; V559-F566 HydrophobicContact CG1-CD2 3.63Å; V559-F566 HydrophobicContact CG1-CE2 3.54Å; V562-F566 HydrophobicContact CB-CD2 4.32Å; V562-F566 HydrophobicContact CB-CE1 4.3Å; V562-F566 HydrophobicContact CB-CE2 3.79Å; V562-F566 HydrophobicContact CB-CZ 3.77Å; V562-F566 HydrophobicContact CG1-CD1 4.04Å; V562-F566 HydrophobicContact CG1-CD2 4.38Å; V562-F566 HydrophobicContact CG1-CE1 3.44Å; V562-F566 VanDerWaalsContact CG1-CE1 3.44Å; V562-F566 HydrophobicContact CG1-CE2 3.86Å; V562-F566 HydrophobicContact CG1-CG 4.46Å; V562-F566 HydrophobicContact CG1-CZ 3.35Å; V562-F566 WeakPolarHBondContact O-CD2 3.36Å; V562-F566 VanDerWaalsContact O-CG 3.29Å; V562-F566 WeakPolarHBondContact O-CG 3.43Å; V562-F566 PolarHBondContact O-N 2.98Å; R563-F566 PolarHBondContact O-N 3.17Å; F566-L570 WeakPolarHBondContact O-CB 3.2Å; F566-L570 PolarHBondContact O-N 3.44Å
567	L	64.4	Low	59.6	Low	77 Å²	77	87.9 Å²	87.9	40%	0.403	49%	0.485	S	S	.	.	H	α-helix	trans	-73.1	-40.8	175.3	-76.8	168	0	0	0	111.5	R563 E564 Q565 L570 A571	R563-L567 HydrophobicContact CG-CD1 4.13Å; R563-L567 WeakPolarHBondContact O-CG 3.36Å; R563-L567 PolarHBondContact O-N 3.23Å; E564-L567 PolarHBondContact O-N 3.3Å; Q565-L567 VanDerWaalsContact C-N 3.34Å; Q565-L567 PolarHBondContact O-N 3.49Å; L567-L570 PolarHBondContact O-N 2.91Å; L567-A571 PolarHBondContact O-N 3.46Å; L567-A571 VanDerWaalsContact O-N 3.07Å
568	A	65.1	Low	58.3	Low	65 Å²	65	80.2 Å²	80.2	54%	0.537	48%	0.476	S	S	.	.	H	α-helix	trans	-62.8	-43.7	172.4	0	0	0	0	0	111.5	E564 Q565 A571 A572	E564-A568 PolarHBondContact O-N 3.38Å; Q565-A568 PolarHBondContact O-N 2.77Å; A568-A571 WeakPolarHBondContact O-CB 3.47Å; A568-A571 PolarHBondContact O-N 3.13Å; A568-A572 PolarHBondContact O-N 2.92Å
569	E	64.9	Low	56.5	Low	74 Å²	74	83.5 Å²	83.5	35%	0.346	50%	0.501	S	S	.	.	H	α-helix	trans	-68.2	-37.2	177.9	-163.5	176.9	162	0	0	112.3	Q565 A571 A572 Q573	Q565-E569 WeakPolarHBondContact O-CB 3.39Å; Q565-E569 PolarHBondContact O-N 3.11Å; E569-A571 VanDerWaalsContact C-N 3.29Å; E569-A571 PolarHBondContact O-N 2.76Å; E569-A572 PolarHBondContact O-N 3.08Å; E569-Q573 WeakPolarHBondContact O-CG 3.38Å; E569-Q573 PolarHBondContact O-N 3.07Å; E569-Q573 PolarHBondContact OE1-NE2 2.98Å
570	L	63.7	Low	54.7	Low	46 Å²	46	89.1 Å²	89.1	24%	0.241	54%	0.54	C	S	.	.	H	α-helix	trans	-61.2	-37.4	170.8	-122.8	79.2	0	0	0	112.2	W520 F566 L567 Q574	W520-L570 HydrophobicContact CZ2-CD1 4.3Å; F566-L570 WeakPolarHBondContact O-CB 3.2Å; F566-L570 PolarHBondContact O-N 3.44Å; L567-L570 PolarHBondContact O-N 2.91Å; L570-Q574 WeakPolarHBondContact O-CG 3.48Å; L570-Q574 PolarHBondContact O-N 3.4Å; L570-Q574 PolarHBondContact O-NE2 2.97Å
571	A	62.1	Low	53.3	Low	50 Å²	50	89.6 Å²	89.6	41%	0.413	55%	0.55	S	S	.	*	H	α-helix	trans	-68.8	-46.2	176.6	0	0	0	0	0	110.8	L567 A568 E569 Q573 Q574 S575	L567-A571 PolarHBondContact O-N 3.46Å; L567-A571 VanDerWaalsContact O-N 3.07Å; A568-A571 WeakPolarHBondContact O-CB 3.47Å; A568-A571 PolarHBondContact O-N 3.13Å; E569-A571 VanDerWaalsContact C-N 3.29Å; E569-A571 PolarHBondContact O-N 2.76Å; A571-Q573 VanDerWaalsContact C-N 3.35Å; A571-Q573 PolarHBondContact O-N 2.88Å; A571-Q574 PolarHBondContact O-N 3.44Å; A571-S575 PolarHBondContact O-N 2.92Å; A571-S575 PolarHBondContact O-OG 2.86Å
572	A	62.6	Low	51.9	Low	61 Å²	61	89.6 Å²	89.6	50%	0.504	55%	0.55	S	S	.	*	H	α-helix	trans	-57.5	-44	176.7	0	0	0	0	0	112.5	A568 E569 Q574 S575 G576	A568-A572 PolarHBondContact O-N 2.92Å; E569-A572 PolarHBondContact O-N 3.08Å; A572-Q574 PolarHBondContact O-N 3.5Å; A572-S575 PolarHBondContact O-N 2.93Å; A572-G576 WeakPolarHBondContact O-CA 3.21Å; A572-G576 PolarHBondContact O-N 2.87Å
573	Q	58	Low	50.6	Low	89 Å²	89	95 Å²	95	42%	0.416	58%	0.584	S	S	.	*	H	α-helix	trans	-67.6	-33.5	177.6	-69	179.4	26.3	0	0	112.9	E569 A571 G576	E569-Q573 WeakPolarHBondContact O-CG 3.38Å; E569-Q573 PolarHBondContact O-N 3.07Å; E569-Q573 PolarHBondContact OE1-NE2 2.98Å; A571-Q573 VanDerWaalsContact C-N 3.35Å; A571-Q573 PolarHBondContact O-N 2.88Å; Q573-G576 PolarHBondContact O-N 3.35Å
574	Q	49.7	Very low	49	Very low	148 Å²	148	94.1 Å²	94.1	69%	0.692	60%	0.603	S	S	*	*	H	α-helix	trans	-71.3	-31.6	174.4	-79.3	166.2	97.2	0	0	112.8	L570 A571 A572 G576	L570-Q574 WeakPolarHBondContact O-CG 3.48Å; L570-Q574 PolarHBondContact O-N 3.4Å; L570-Q574 PolarHBondContact O-NE2 2.97Å; A571-Q574 PolarHBondContact O-N 3.44Å; A572-Q574 PolarHBondContact O-N 3.5Å; Q574-G576 VanDerWaalsContact C-N 3.33Å
575	S	43.3	Very low	47.6	Very low	114 Å²	114	96.4 Å²	96.4	80%	0.797	62%	0.624	S	S	*	*	H	α-helix	trans	-79.8	-14.5	171.4	-58.4	0	0	0	0	113.6	A571 A572	A571-S575 PolarHBondContact O-N 2.92Å; A571-S575 PolarHBondContact O-OG 2.86Å; A572-S575 PolarHBondContact O-N 2.93Å
576	G	42.1	Very low	46	Very low	51 Å²	51	95.9 Å²	95.9	53%	0.526	64%	0.635	S	S	.	*			trans	-110.2	15	-164.8	0	0	0	0	0	116	A572 Q573 Q574 G578	A572-G576 WeakPolarHBondContact O-CA 3.21Å; A572-G576 PolarHBondContact O-N 2.87Å; Q573-G576 PolarHBondContact O-N 3.35Å; Q574-G576 VanDerWaalsContact C-N 3.33Å; G576-G578 PolarHBondContact O-N 3.43Å
577	S	37.2	Very low	44.4	Very low	121 Å²	121	100.6 Å²	100.6	85%	0.846	67%	0.665	S	S	*	*			trans	-74.6	43.7	179.7	-172.4	0	0	0	0	113.6
578	G	34.5	Very low	42.9	Very low	62 Å²	62	108.5 Å²	108.5	64%	0.639	69%	0.689	S	S	*	*	S	Bend	trans	-129.5	99.6	176	0	0	0	0	0	110.1	G576	G576-G578 PolarHBondContact O-N 3.43Å
579	L	36.3	Very low	41.3	Very low	183 Å²	183	109.3 Å²	109.3	96%	0.958	70%	0.704	S	S	*	*			trans	-13	124.1	177.1	-56.9	172.2	0	0	0	117.2
580	S	29.4	Very low	39.6	Very low	121 Å²	121	109.8 Å²	109.8	85%	0.846	73%	0.729	S	S	*	*			trans	-140.1	106.4	152	63.9	0	0	0	0	112.7
581	N	30.4	Very low	38	Very low	175 Å²	175	111.7 Å²	111.7	94%	0.936	76%	0.76	S	S	*	*			trans	-156.7	114.7	148.5	-151.5	15.7	0	0	0	107.4
582	G	29.3	Very low	36.7	Very low	73 Å²	73	113 Å²	113	75%	0.753	78%	0.778	S	S	*	*			trans	169.1	72.4	-167	0	0	0	0	0	114.4	G584	G582-G584 PolarHBondContact O-N 2.81Å
583	T	31.6	Very low	35.7	Very low	156 Å²	156	122.3 Å²	122.3	96%	0.957	80%	0.8	S	S	*	*			trans	-69.2	113.1	167.5	-52.9	0	0	0	0	109.4
584	G	30.4	Very low	34.8	Very low	73 Å²	73	127.9 Å²	127.9	75%	0.753	82%	0.823	S	S	*	*			trans	-159.1	113.6	-179.3	0	0	0	0	0	112.8	G582	G582-G584 PolarHBondContact O-N 2.81Å
585	T	33.5	Very low	34.4	Very low	143 Å²	143	132.7 Å²	132.7	88%	0.877	84%	0.835	S	S	*	*			trans	-91.9	123.7	180	49.8	0	0	0	0	112.1
586	S	29.5	Very low	34.3	Very low	120 Å²	120	137.1 Å²	137.1	84%	0.839	84%	0.84	S	S	*	*			trans	-160.6	168.9	141.1	-156.3	0	0	0	0	112.7
587	T	35	Very low	34.3	Very low	111 Å²	111	142 Å²	142	68%	0.681	85%	0.853	S	S	*	*			trans	-108.6	166	-161	61.9	0	0	0	0	114
588	R	32.9	Very low	34.3	Very low	242 Å²	242	141.9 Å²	141.9	91%	0.913	85%	0.852	S	S	*	*			trans	73.2	136.6	170.4	-49.7	159.5	86.7	144.8	2.1	113.4
589	G	30	Very low	34.4	Very low	82 Å²	82	149.6 Å²	149.6	85%	0.845	86%	0.861	S	S	*	*			cis	143.9	140.6	-2	0	0	0	0	0	110
590	G	30.8	Very low	34.5	Very low	85 Å²	85	145.6 Å²	145.6	88%	0.876	86%	0.855	S	S	*	*			cis	-179	-178.3	-3.7	0	0	0	0	0	110.6
591	G	29.9	Very low	34.8	Very low	86 Å²	86	144.2 Å²	144.2	89%	0.887	85%	0.845	S	S	*	*			trans	118.5	130.2	175.6	0	0	0	0	0	113.8
592	G	33.8	Very low	35.4	Very low	77 Å²	77	141 Å²	141	79%	0.794	83%	0.832	S	S	*	*			cis	153.4	53.9	-7.1	0	0	0	0	0	116.9
593	R	41.7	Very low	36.5	Very low	256 Å²	256	145.2 Å²	145.2	97%	0.966	84%	0.838	S	S	*	*			trans	-125	101.6	163.5	-74.3	-167.3	172.4	-169.9	-1.9	111.3
594	K	39.4	Very low	37.7	Very low	207 Å²	207	141.2 Å²	141.2	90%	0.9	82%	0.816	S	S	*	*			trans	-65.3	135.6	177.2	-62.2	175	179.9	174.9	0	110.7
595	R	42.1	Very low	40	Very low	249 Å²	249	141 Å²	141	94%	0.94	80%	0.801	S	S	*	*			trans	-130.3	159.5	133	-83.8	-161.9	-74.6	174.5	-2.9	109.6
596	K	40.6	Very low	42.3	Very low	207 Å²	207	137.6 Å²	137.6	90%	0.9	78%	0.778	S	S	*	*			trans	-82.8	143.6	-151.7	-165.1	171.8	178.9	-179.8	0	112.6
597	L	42.7	Very low	45.1	Very low	154 Å²	154	135.6 Å²	135.6	81%	0.806	76%	0.757	S	S	*	*			trans	-66.2	139.7	175.8	-166.9	78.3	0	0	0	111.4
598	S	36.1	Very low	47.6	Very low	117 Å²	117	136.3 Å²	136.3	82%	0.818	75%	0.752	S	S	*	*			trans	-123	154.8	149.8	64.9	0	0	0	0	108.7
599	R	36.7	Very low	50.2	Low	224 Å²	224	125.5 Å²	125.5	85%	0.845	71%	0.713	S	S	*	*			trans	-125.9	119.7	-161.8	-177.6	-177.6	70.5	179.8	2.5	111.1
600	A	39.5	Very low	52.9	Low	99 Å²	99	121.6 Å²	121.6	82%	0.818	67%	0.673	S	S	*	*			trans	45.5	120.1	159.7	0	0	0	0	0	119.4
601	S	36	Very low	55.6	Low	93 Å²	93	119.9 Å²	119.9	65%	0.65	65%	0.646	S	S	*	*			trans	-165.2	150.8	134.7	-166.9	0	0	0	0	111.1
602	T	43	Very low	58.4	Low	107 Å²	107	118.9 Å²	118.9	66%	0.656	63%	0.625	S	S	*	*			trans	30.9	109.2	151.7	48.4	0	0	0	0	118.4	S604	T602-S604 PolarHBondContact O-N 3.25Å
603	D	50.5	Low	61	Low	162 Å²	162	116.6 Å²	116.6	87%	0.866	59%	0.592	S	S	*	*			trans	-78.4	72.6	165.1	-162.2	33.7	0	0	0	110.4
604	S	56.9	Low	63.2	Low	72 Å²	72	105.9 Å²	105.9	50%	0.503	55%	0.552	S	S	.	*			trans	-117.2	141.1	173.3	-178.1	0	0	0	0	108.5	T602	T602-S604 PolarHBondContact O-N 3.25Å
605	P	78.6	Confident	65.4	Low	67 Å²	67	102.5 Å²	102.5	44%	0.435	54%	0.543	S	S	.	.			trans	-59.9	139.6	168.1	27	-34.2	0	0	0	110.1	M634	P605-M634 HydrophobicContact CB-CG 3.41Å; P605-M634 VanDerWaalsContact CB-CG 3.41Å; P605-M634 HydrophobicContact CB-SD 3.87Å
606	D	83	Confident	67.4	Low	73 Å²	73	96.2 Å²	96.2	39%	0.39	53%	0.533	S	S	.	.			trans	-103.1	119.2	172.8	-179.2	9.2	0	0	0	109.1	Q608 P609 S632	D606-Q608 WeakPolarHBondContact OD1-CB 3.28Å; D606-Q608 WeakPolarHBondContact OD1-CG 3.16Å; D606-Q608 PolarHBondContact OD1-N 2.89Å; D606-P609 VanDerWaalsContact CG-CD 3.48Å; D606-P609 WeakPolarHBondContact O-CD 3.5Å; D606-P609 WeakPolarHBondContact OD2-CD 3.31Å; D606-S632 PolarHBondContact N-O 3.27Å; D606-S632 VanDerWaalsContact O-CA 3.24Å; D606-S632 WeakPolarHBondContact O-CA 3.34Å; D606-S632 VanDerWaalsContact O-CB 3.23Å; D606-S632 WeakPolarHBondContact O-CB 3.25Å; D606-S632 PolarHBondContact O-OG 3.28Å
607	I	87.5	Confident	69.5	Low	77 Å²	77	89 Å²	89	40%	0.395	51%	0.506	S	S	.	.			trans	-90.8	-17.3	-176.2	-57.8	173.9	0	0	0	110.8	P609 L610 V611 M634 W642	I607-P609 VanDerWaalsContact C-CD 3.47Å; I607-L610 WeakPolarHBondContact O-CB 3.42Å; I607-L610 PolarHBondContact O-N 2.97Å; I607-V611 HydrophobicContact CG2-CG2 4.09Å; I607-V611 PolarHBondContact O-N 3.19Å; I607-V611 VanDerWaalsContact O-N 3.15Å; I607-M634 HydrophobicContact CG1-SD 4.26Å; I607-W642 HydrophobicContact CG2-CZ2 4.26Å
608	Q	87.4	Confident	71.2	Confident	127 Å²	127	83.3 Å²	83.3	59%	0.593	48%	0.484	S	S	*	.	H	α-helix	trans	-57	-38.6	-178.4	-62.7	-66.7	-63.6	0	0	114	D606 L610 S612	D606-Q608 WeakPolarHBondContact OD1-CB 3.28Å; D606-Q608 WeakPolarHBondContact OD1-CG 3.16Å; D606-Q608 PolarHBondContact OD1-N 2.89Å; Q608-L610 VanDerWaalsContact C-N 3.26Å; Q608-L610 PolarHBondContact O-N 3.38Å; Q608-S612 WeakPolarHBondContact O-CB 3.3Å; Q608-S612 PolarHBondContact O-N 2.86Å; Q608-S612 PolarHBondContact O-OG 3.43Å
609	P	87.6	Confident	73.5	Confident	14 Å²	14	81.6 Å²	81.6	9%	0.091	47%	0.469	C	S	.	.	H	α-helix	trans	-65.4	-25.8	175.5	-24.1	36.4	0	0	0	114.4	D606 I607 Y613 K631	D606-P609 VanDerWaalsContact CG-CD 3.48Å; D606-P609 WeakPolarHBondContact O-CD 3.5Å; D606-P609 WeakPolarHBondContact OD2-CD 3.31Å; I607-P609 VanDerWaalsContact C-CD 3.47Å; P609-Y613 WeakPolarHBondContact O-CB 3.21Å; P609-Y613 PolarHBondContact O-N 3.11Å; P609-K631 HydrophobicContact CB-CB 3.72Å; P609-K631 HydrophobicContact CG-CB 4Å
610	L	88.2	Confident	76	Confident	0 Å²	0	72.4 Å²	72.4	0%	0	44%	0.437	C	S	.	.	H	α-helix	trans	-79.3	-50	178.8	-55.6	-178.6	0	0	0	110.3	I607 Q608 S612 Y613 Y614 L628 M634 V639 W642 F643	I607-L610 WeakPolarHBondContact O-CB 3.42Å; I607-L610 PolarHBondContact O-N 2.97Å; Q608-L610 VanDerWaalsContact C-N 3.26Å; Q608-L610 PolarHBondContact O-N 3.38Å; L610-S612 VanDerWaalsContact C-N 3.3Å; L610-S612 PolarHBondContact O-N 2.99Å; L610-Y613 PolarHBondContact O-N 3.46Å; L610-Y614 PolarHBondContact O-N 2.9Å; L610-L628 HydrophobicContact CD2-CB 4.02Å; L610-L628 HydrophobicContact CD2-CD2 4.27Å; L610-M634 HydrophobicContact CD1-CE 3.76Å; L610-M634 HydrophobicContact CD1-SD 3.66Å; L610-V639 HydrophobicContact CD2-CG1 3.88Å; L610-V639 HydrophobicContact CD2-CG2 4.1Å; L610-W642 HydrophobicContact CB-CD2 3.93Å; L610-W642 HydrophobicContact CB-CE3 3.68Å; L610-W642 HydrophobicContact CB-CH2 3.94Å; L610-W642 HydrophobicContact CB-CZ2 4.15Å; L610-W642 HydrophobicContact CB-CZ3 3.7Å; L610-W642 HydrophobicContact CD1-CB 4.2Å; L610-W642 HydrophobicContact CD1-CD2 3.86Å; L610-W642 HydrophobicContact CD1-CE3 4.14Å; L610-W642 HydrophobicContact CD1-CG 3.87Å; L610-W642 HydrophobicContact CG-CE3 4.46Å; L610-F643 HydrophobicContact CD2-CE2 4.26Å
611	V	86.5	Confident	78.3	Confident	50 Å²	50	71 Å²	71	30%	0.303	42%	0.416	S	S	.	.	H	α-helix	trans	-55.1	-46.4	173.5	175.6	0	0	0	0	111	I607 Y613 Y614 L615 W642	I607-V611 HydrophobicContact CG2-CG2 4.09Å; I607-V611 PolarHBondContact O-N 3.19Å; I607-V611 VanDerWaalsContact O-N 3.15Å; V611-Y613 VanDerWaalsContact C-N 3.25Å; V611-Y613 PolarHBondContact O-N 3.19Å; V611-Y614 PolarHBondContact O-N 3.39Å; V611-L615 HydrophobicContact CG1-CD1 3.93Å; V611-L615 HydrophobicContact CG1-CG 4.44Å; V611-L615 WeakPolarHBondContact O-CB 3.5Å; V611-L615 WeakPolarHBondContact O-CG 3.26Å; V611-L615 PolarHBondContact O-N 3.43Å; V611-W642 HydrophobicContact CG2-CH2 4.15Å; V611-W642 HydrophobicContact CG2-CZ2 3.68Å
612	S	87.6	Confident	80.8	Confident	64 Å²	64	71.9 Å²	71.9	45%	0.448	41%	0.409	S	S	.	.	H	α-helix	trans	-61.4	-33.4	178.9	-57.2	0	0	0	0	112.9	Q608 L610 T616	Q608-S612 WeakPolarHBondContact O-CB 3.3Å; Q608-S612 PolarHBondContact O-N 2.86Å; Q608-S612 PolarHBondContact O-OG 3.43Å; L610-S612 VanDerWaalsContact C-N 3.3Å; L610-S612 PolarHBondContact O-N 2.99Å; S612-T616 PolarHBondContact O-OG1 2.95Å
613	Y	90.4	Very high	83	Confident	29 Å²	29	76 Å²	76	11%	0.114	42%	0.418	C	S	.	.	H	α-helix	trans	-79	-44.4	178.3	-176.1	-82.9	0	0	0	111.5	P609 L610 V611 L615 T616 T617 T619 N621 D624 L628 F643	P609-Y613 WeakPolarHBondContact O-CB 3.21Å; P609-Y613 PolarHBondContact O-N 3.11Å; L610-Y613 PolarHBondContact O-N 3.46Å; V611-Y613 VanDerWaalsContact C-N 3.25Å; V611-Y613 PolarHBondContact O-N 3.19Å; Y613-L615 VanDerWaalsContact C-N 3.33Å; Y613-L615 PolarHBondContact O-N 2.91Å; Y613-T616 CarbonylContact O-C 3.58Å; Y613-T616 WeakPolarHBondContact O-CA 3.39Å; Y613-T616 PolarHBondContact O-N 2.86Å; Y613-T617 HydrophobicContact CE1-CG2 3.88Å; Y613-T617 WeakPolarHBondContact O-CB 3.41Å; Y613-T617 PolarHBondContact O-N 2.88Å; Y613-T619 WeakPolarHBondContact CE1-O 3.37Å; Y613-N621 WeakPolarHBondContact OH-CB 3.32Å; Y613-N621 PolarHBondContact OH-ND2 3.2Å; Y613-D624 HydrophobicContact CE2-CB 3.7Å; Y613-D624 WeakPolarHBondContact CE2-OD2 3.48Å; Y613-D624 PolarHBondContact OH-OD2 2.95Å; Y613-L628 HydrophobicContact CD1-CD1 3.95Å; Y613-L628 HydrophobicContact CD2-CD1 4.18Å; Y613-L628 HydrophobicContact CD2-CD2 3.82Å; Y613-L628 HydrophobicContact CD2-CG 4.35Å; Y613-L628 HydrophobicContact CE1-CD1 4.12Å; Y613-L628 HydrophobicContact CE2-CD1 4.34Å; Y613-L628 HydrophobicContact CG-CD1 3.98Å; Y613-L628 HydrophobicContact CG-CD2 3.76Å; Y613-L628 HydrophobicContact CG-CG 4.42Å; Y613-F643 HydrophobicContact CD1-CE1 4.1Å; Y613-F643 AromaticContact CD1-CZ 3.66Å; Y613-F643 HydrophobicContact CD1-CZ 3.66Å; Y613-F643 HydrophobicContact CE1-CZ 4.36Å
614	Y	87.5	Confident	84.8	Confident	32 Å²	32	71 Å²	71	13%	0.125	39%	0.392	C	S	.	.	H	α-helix	trans	-55.5	-46.8	174.6	177.1	-104.4	0	0	0	111.3	L610 V611 T616 T617 G618 W642 F643 Q646 E650	L610-Y614 PolarHBondContact O-N 2.9Å; V611-Y614 PolarHBondContact O-N 3.39Å; Y614-T616 PolarHBondContact O-N 3.37Å; Y614-T616 VanDerWaalsContact O-N 3.13Å; Y614-T617 PolarHBondContact O-N 3.27Å; Y614-G618 WeakPolarHBondContact CD2-O 3.18Å; Y614-G618 WeakPolarHBondContact CE2-O 3.27Å; Y614-G618 WeakPolarHBondContact O-CA 3.26Å; Y614-G618 PolarHBondContact O-N 3.4Å; Y614-W642 HydrophobicContact CG-CH2 4.41Å; Y614-F643 HydrophobicContact CD2-CD1 4.2Å; Y614-F643 HydrophobicContact CD2-CE1 4.07Å; Y614-F643 HydrophobicContact CG-CE1 4.44Å; Y614-Q646 HydrophobicContact CD1-CG 4.07Å; Y614-Q646 HydrophobicContact CD2-CG 3.92Å; Y614-Q646 HydrophobicContact CE1-CG 3.61Å; Y614-Q646 HydrophobicContact CE2-CB 4.43Å; Y614-Q646 HydrophobicContact CE2-CG 3.47Å; Y614-Q646 VanDerWaalsContact CE2-CG 3.47Å; Y614-Q646 HydrophobicContact CG-CG 4.21Å; Y614-E650 PolarHBondContact OH-OE1 3.12Å; Y614-E650 PolarHBondContact OH-OE2 3.46Å
615	L	85.1	Confident	86.5	Confident	135 Å²	135	67.8 Å²	67.8	71%	0.707	37%	0.368	S	S	*	.	H	α-helix	trans	-64.2	-15.8	174.6	-68.1	173.4	0	0	0	114.9	V611 Y613	V611-L615 HydrophobicContact CG1-CD1 3.93Å; V611-L615 HydrophobicContact CG1-CG 4.44Å; V611-L615 WeakPolarHBondContact O-CB 3.5Å; V611-L615 WeakPolarHBondContact O-CG 3.26Å; V611-L615 PolarHBondContact O-N 3.43Å; Y613-L615 VanDerWaalsContact C-N 3.33Å; Y613-L615 PolarHBondContact O-N 2.91Å
616	T	85	Confident	87.1	Confident	117 Å²	117	67.4 Å²	67.4	72%	0.718	36%	0.363	S	S	*	.	H	α-helix	trans	-102.3	-22.7	-179.9	-54.6	0	0	0	0	112.7	S612 Y613 Y614	S612-T616 PolarHBondContact O-OG1 2.95Å; Y613-T616 CarbonylContact O-C 3.58Å; Y613-T616 WeakPolarHBondContact O-CA 3.39Å; Y613-T616 PolarHBondContact O-N 2.86Å; Y614-T616 PolarHBondContact O-N 3.37Å; Y614-T616 VanDerWaalsContact O-N 3.13Å
617	T	82.8	Confident	87.5	Confident	56 Å²	56	68.4 Å²	68.4	34%	0.344	37%	0.368	S	S	.	.	H	α-helix	trans	-138.4	-15.5	-164.2	-51.5	0	0	0	0	114	Y613 Y614 T619 N621	Y613-T617 HydrophobicContact CE1-CG2 3.88Å; Y613-T617 WeakPolarHBondContact O-CB 3.41Å; Y613-T617 PolarHBondContact O-N 2.88Å; Y614-T617 PolarHBondContact O-N 3.27Å; T617-T619 PolarHBondContact O-N 3.44Å; T617-N621 VanDerWaalsContact CG2-ND2 3.3Å; T617-N621 WeakPolarHBondContact CG2-ND2 3.27Å
618	G	78.3	Confident	87.6	Confident	34 Å²	34	64.9 Å²	64.9	35%	0.351	35%	0.35	S	S	.	.	S	Bend	trans	70.8	-48.1	178.8	0	0	0	0	0	114.5	Y614	Y614-G618 WeakPolarHBondContact CD2-O 3.18Å; Y614-G618 WeakPolarHBondContact CE2-O 3.27Å; Y614-G618 WeakPolarHBondContact O-CA 3.26Å; Y614-G618 PolarHBondContact O-N 3.4Å
619	T	85.2	Confident	87.8	Confident	81 Å²	81	59.4 Å²	59.4	50%	0.497	33%	0.325	S	S	.	.	S	Bend	trans	-121.8	154.4	-174.8	53.5	0	0	0	0	112	Y613 T617 N621	Y613-T619 WeakPolarHBondContact CE1-O 3.37Å; T617-T619 PolarHBondContact O-N 3.44Å; T619-N621 PolarHBondContact O-N 2.88Å
620	L	89.3	Confident	88	Confident	32 Å²	32	65.5 Å²	65.5	17%	0.168	35%	0.35	C	S	.	.			trans	-79	107.3	-177.8	176.3	56.8	0	0	0	112	L625 L628 V639 R640 F643	L620-L625 HydrophobicContact CD1-CD1 4.24Å; L620-L625 HydrophobicContact CD2-CD1 4.27Å; L620-L628 HydrophobicContact CD1-CD1 3.6Å; L620-V639 HydrophobicContact CD1-CG1 4.29Å; L620-V639 HydrophobicContact CD2-CG1 4.4Å; L620-R640 HydrophobicContact CD2-CB 4.34Å; L620-R640 HydrophobicContact CD2-CG 3.73Å; L620-F643 HydrophobicContact CB-CB 4.06Å; L620-F643 HydrophobicContact CB-CD1 3.92Å; L620-F643 HydrophobicContact CB-CD2 3.97Å; L620-F643 HydrophobicContact CB-CE1 4.36Å; L620-F643 HydrophobicContact CB-CE2 4.44Å; L620-F643 HydrophobicContact CB-CG 3.72Å; L620-F643 HydrophobicContact CD1-CD2 3.92Å; L620-F643 HydrophobicContact CD1-CE2 3.85Å; L620-F643 HydrophobicContact CD1-CZ 4.38Å; L620-F643 HydrophobicContact CD2-CB 4.15Å; L620-F643 HydrophobicContact CD2-CD2 3.84Å; L620-F643 HydrophobicContact CD2-CG 4.14Å; L620-F643 HydrophobicContact CG-CD2 4.12Å; L620-F643 HydrophobicContact CG-CG 4.35Å
621	N	86.8	Confident	88	Confident	70 Å²	70	70.8 Å²	70.8	37%	0.374	37%	0.373	S	S	.	.			trans	-79.3	123.8	169.5	-66.5	-83.6	0	0	0	111.4	Y613 T617 T619 K623 D624 L625	Y613-N621 WeakPolarHBondContact OH-CB 3.32Å; Y613-N621 PolarHBondContact OH-ND2 3.2Å; T617-N621 VanDerWaalsContact CG2-ND2 3.3Å; T617-N621 WeakPolarHBondContact CG2-ND2 3.27Å; T619-N621 PolarHBondContact O-N 2.88Å; N621-K623 PolarHBondContact O-N 2.98Å; N621-D624 PolarHBondContact O-N 3.33Å; N621-L625 PolarHBondContact O-N 3.44Å
622	E	89.2	Confident	88.1	Confident	111 Å²	111	68.4 Å²	68.4	52%	0.519	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-24	174.4	-76.1	-71.1	141.1	0	0	114.1	R640	E622-R640 IonicContact OE1-CZ 3.64Å; E622-R640 IonicContact OE1-NE 3.84Å; E622-R640 PolarHBondContact OE1-NE 2.92Å; E622-R640 IonicContact OE1-NH2 2.8Å; E622-R640 PolarHBondContact OE1-NH2 3.08Å; E622-R640 IonicContact OE2-CZ 2.92Å; E622-R640 IonicContact OE2-NE 2.78Å; E622-R640 IonicContact OE2-NH2 3.7Å; E622-R640 PolarHBondContact OE2-NH2 2.61Å
623	K	89.2	Confident	88.2	Confident	193 Å²	193	73.5 Å²	73.5	84%	0.839	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-34.9	175	-65.1	177.4	-177.1	171.7	0	112.9	N621	N621-K623 PolarHBondContact O-N 2.98Å
624	D	89.7	Confident	88.1	Confident	58 Å²	58	73 Å²	73	31%	0.31	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-11.5	-177.9	-60.2	-42.5	0	0	0	112.4	Y613 N621 D626 L627 L628	Y613-D624 HydrophobicContact CE2-CB 3.7Å; Y613-D624 WeakPolarHBondContact CE2-OD2 3.48Å; Y613-D624 PolarHBondContact OH-OD2 2.95Å; N621-D624 PolarHBondContact O-N 3.33Å; D624-D626 VanDerWaalsContact C-N 3.27Å; D624-D626 PolarHBondContact O-N 2.89Å; D624-L627 CarbonylContact O-C 3.52Å; D624-L627 WeakPolarHBondContact O-CA 3.35Å; D624-L627 WeakPolarHBondContact O-CB 3.47Å; D624-L627 PolarHBondContact O-N 3.15Å; D624-L628 WeakPolarHBondContact O-CG 3.3Å; D624-L628 PolarHBondContact O-N 3.23Å
625	L	91.3	Very high	88.3	Confident	3 Å²	3	74.1 Å²	74.1	2%	0.016	38%	0.38	C	S	.	.	H	α-helix	trans	-51.9	-41.3	-178.5	177	58.6	0	0	0	113.1	L620 N621 L628 C629 Y636 V639 R640	L620-L625 HydrophobicContact CD1-CD1 4.24Å; L620-L625 HydrophobicContact CD2-CD1 4.27Å; N621-L625 PolarHBondContact O-N 3.44Å; L625-L628 PolarHBondContact O-N 2.75Å; L625-C629 WeakPolarHBondContact O-CB 3.17Å; L625-C629 PolarHBondContact O-N 2.8Å; L625-C629 PolarHBondContact O-SG 2.97Å; L625-Y636 HydrophobicContact CD1-CD1 4.5Å; L625-Y636 HydrophobicContact CD2-CD1 3.91Å; L625-Y636 HydrophobicContact CG-CD1 3.78Å; L625-Y636 HydrophobicContact CG-CE1 4.36Å; L625-V639 HydrophobicContact CD1-CB 3.81Å; L625-V639 HydrophobicContact CD1-CG1 3.52Å; L625-R640 HydrophobicContact CD1-CG 4.44Å; L625-R640 HydrophobicContact CD2-CG 4.38Å
626	D	91.3	Very high	88.7	Confident	60 Å²	60	73.4 Å²	73.4	32%	0.321	37%	0.368	S	S	.	.	H	α-helix	trans	-64.7	-39.9	175	171.6	73.2	0	0	0	112.9	D624 K630 Y636	D624-D626 VanDerWaalsContact C-N 3.27Å; D624-D626 PolarHBondContact O-N 2.89Å; D626-K630 WeakPolarHBondContact O-CB 3.43Å; D626-K630 WeakPolarHBondContact O-CD 3.4Å; D626-K630 VanDerWaalsContact O-CG 3.28Å; D626-K630 WeakPolarHBondContact O-CG 3.35Å; D626-K630 PolarHBondContact O-N 3.08Å; D626-K630 WeakPolarHBondContact OD1-CE 3.49Å; D626-K630 IonicContact OD1-NZ 3.93Å; D626-K630 PolarHBondContact OD1-NZ 2.97Å; D626-K630 WeakPolarHBondContact OD2-CE 3.43Å; D626-K630 IonicContact OD2-NZ 3.36Å; D626-K630 PolarHBondContact OD2-NZ 3.48Å; D626-Y636 HydrophobicContact CB-CE1 4.29Å; D626-Y636 PolarHBondContact OD1-OH 3.29Å
627	L	90.9	Very high	89.1	Confident	94 Å²	94	73 Å²	73	49%	0.492	36%	0.358	S	S	.	.	H	α-helix	trans	-67.8	-39.3	175.1	178.8	62.1	0	0	0	111.3	D624 K630 K631	D624-L627 CarbonylContact O-C 3.52Å; D624-L627 WeakPolarHBondContact O-CA 3.35Å; D624-L627 WeakPolarHBondContact O-CB 3.47Å; D624-L627 PolarHBondContact O-N 3.15Å; L627-K630 PolarHBondContact O-N 3.1Å; L627-K631 HydrophobicContact CD1-CD 3.96Å; L627-K631 HydrophobicContact CD1-CG 4.2Å; L627-K631 HydrophobicContact CG-CD 3.95Å; L627-K631 WeakPolarHBondContact O-CB 3.39Å; L627-K631 VanDerWaalsContact O-CG 3.31Å; L627-K631 WeakPolarHBondContact O-CG 3.48Å; L627-K631 PolarHBondContact O-N 3.12Å
628	L	90.6	Very high	89.5	Confident	3 Å²	3	74.6 Å²	74.6	2%	0.016	36%	0.362	C	S	.	.	H	α-helix	trans	-65	-46.6	175.7	-68.2	172.8	0	0	0	111.4	L610 Y613 L620 D624 L625 K630 K631 S632 V639 F643	L610-L628 HydrophobicContact CD2-CB 4.02Å; L610-L628 HydrophobicContact CD2-CD2 4.27Å; Y613-L628 HydrophobicContact CD1-CD1 3.95Å; Y613-L628 HydrophobicContact CD2-CD1 4.18Å; Y613-L628 HydrophobicContact CD2-CD2 3.82Å; Y613-L628 HydrophobicContact CD2-CG 4.35Å; Y613-L628 HydrophobicContact CE1-CD1 4.12Å; Y613-L628 HydrophobicContact CE2-CD1 4.34Å; Y613-L628 HydrophobicContact CG-CD1 3.98Å; Y613-L628 HydrophobicContact CG-CD2 3.76Å; Y613-L628 HydrophobicContact CG-CG 4.42Å; L620-L628 HydrophobicContact CD1-CD1 3.6Å; D624-L628 WeakPolarHBondContact O-CG 3.3Å; D624-L628 PolarHBondContact O-N 3.23Å; L625-L628 PolarHBondContact O-N 2.75Å; L628-K630 VanDerWaalsContact C-N 3.31Å; L628-K630 PolarHBondContact O-N 3.49Å; L628-K631 PolarHBondContact O-N 3.41Å; L628-S632 WeakPolarHBondContact O-CB 3.41Å; L628-S632 PolarHBondContact O-N 2.92Å; L628-V639 HydrophobicContact CB-CG1 4.21Å; L628-F643 HydrophobicContact CD1-CE2 4.1Å; L628-F643 HydrophobicContact CD1-CZ 4.33Å
629	C	91.4	Very high	90.2	Very high	11 Å²	11	73 Å²	73	7%	0.074	35%	0.345	C	S	.	.	H	α-helix	trans	-56.1	-45.4	173.1	-66.3	0	0	0	0	111.5	L625 R633 M634 Y636	L625-C629 WeakPolarHBondContact O-CB 3.17Å; L625-C629 PolarHBondContact O-N 2.8Å; L625-C629 PolarHBondContact O-SG 2.97Å; C629-R633 VanDerWaalsContact O-CA 3.26Å; C629-R633 WeakPolarHBondContact O-CA 3.41Å; C629-R633 PolarHBondContact O-N 2.68Å; C629-M634 WeakPolarHBondContact CA-O 3.38Å; C629-M634 WeakPolarHBondContact CB-O 3.23Å; C629-Y636 VanDerWaalsContact SG-CA 3.52Å; C629-Y636 PolarHBondContact SG-N 3.15Å
630	K	90.8	Very high	90.5	Very high	142 Å²	142	73.9 Å²	73.9	62%	0.617	34%	0.339	S	S	*	.	H	α-helix	trans	-67.3	-35.3	179.6	-75.5	165.6	179.5	163.8	0	113.8	D626 L627 L628	D626-K630 WeakPolarHBondContact O-CB 3.43Å; D626-K630 WeakPolarHBondContact O-CD 3.4Å; D626-K630 VanDerWaalsContact O-CG 3.28Å; D626-K630 WeakPolarHBondContact O-CG 3.35Å; D626-K630 PolarHBondContact O-N 3.08Å; D626-K630 WeakPolarHBondContact OD1-CE 3.49Å; D626-K630 IonicContact OD1-NZ 3.93Å; D626-K630 PolarHBondContact OD1-NZ 2.97Å; D626-K630 WeakPolarHBondContact OD2-CE 3.43Å; D626-K630 IonicContact OD2-NZ 3.36Å; D626-K630 PolarHBondContact OD2-NZ 3.48Å; L627-K630 PolarHBondContact O-N 3.1Å; L628-K630 VanDerWaalsContact C-N 3.31Å; L628-K630 PolarHBondContact O-N 3.49Å
631	K	88.9	Confident	90.5	Very high	111 Å²	111	76.5 Å²	76.5	48%	0.483	35%	0.353	S	S	.	.	H	α-helix	trans	-77.4	-45.4	177.2	-71	172	69.6	-172.9	0	111.9	P609 L627 L628	P609-K631 HydrophobicContact CB-CB 3.72Å; P609-K631 HydrophobicContact CG-CB 4Å; L627-K631 HydrophobicContact CD1-CD 3.96Å; L627-K631 HydrophobicContact CD1-CG 4.2Å; L627-K631 HydrophobicContact CG-CD 3.95Å; L627-K631 WeakPolarHBondContact O-CB 3.39Å; L627-K631 VanDerWaalsContact O-CG 3.31Å; L627-K631 WeakPolarHBondContact O-CG 3.48Å; L627-K631 PolarHBondContact O-N 3.12Å; L628-K631 PolarHBondContact O-N 3.41Å
632	S	88.5	Confident	90.7	Very high	0 Å²	0	75.5 Å²	75.5	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-79	-22.7	-176.2	176.4	0	0	0	0	113.8	D606 L628 M634	D606-S632 PolarHBondContact N-O 3.27Å; D606-S632 VanDerWaalsContact O-CA 3.24Å; D606-S632 WeakPolarHBondContact O-CA 3.34Å; D606-S632 VanDerWaalsContact O-CB 3.23Å; D606-S632 WeakPolarHBondContact O-CB 3.25Å; D606-S632 PolarHBondContact O-OG 3.28Å; L628-S632 WeakPolarHBondContact O-CB 3.41Å; L628-S632 PolarHBondContact O-N 2.92Å; S632-M634 PolarHBondContact O-N 2.69Å; S632-M634 WeakPolarHBondContact OG-CG 3.47Å; S632-M634 PolarHBondContact OG-SD 2.79Å
633	R	90.1	Very high	90.8	Very high	171 Å²	171	70.3 Å²	70.3	65%	0.645	32%	0.32	S	S	*	.			trans	62.4	11.4	-168.6	-48.1	-175.8	-175.8	-175.9	5.5	114.5	C629	C629-R633 VanDerWaalsContact O-CA 3.26Å; C629-R633 WeakPolarHBondContact O-CA 3.41Å; C629-R633 PolarHBondContact O-N 2.68Å
634	M	88.4	Confident	90.7	Very high	20 Å²	20	63.6 Å²	63.6	10%	0.099	30%	0.301	C	S	.	.			trans	-83.4	149.2	169.9	-73.3	168.9	60	0	0	110.5	P605 I607 L610 C629 S632 Q638 V639 W642	P605-M634 HydrophobicContact CB-CG 3.41Å; P605-M634 VanDerWaalsContact CB-CG 3.41Å; P605-M634 HydrophobicContact CB-SD 3.87Å; I607-M634 HydrophobicContact CG1-SD 4.26Å; L610-M634 HydrophobicContact CD1-CE 3.76Å; L610-M634 HydrophobicContact CD1-SD 3.66Å; C629-M634 WeakPolarHBondContact CA-O 3.38Å; C629-M634 WeakPolarHBondContact CB-O 3.23Å; S632-M634 PolarHBondContact O-N 2.69Å; S632-M634 WeakPolarHBondContact OG-CG 3.47Å; S632-M634 PolarHBondContact OG-SD 2.79Å; M634-Q638 HydrophobicContact CB-CB 4Å; M634-Q638 HydrophobicContact CE-CB 3.82Å; M634-Q638 VanDerWaalsContact CE-O 3.31Å; M634-Q638 WeakPolarHBondContact CE-O 3.49Å; M634-Q638 HydrophobicContact CG-CB 4.45Å; M634-V639 HydrophobicContact CB-CG2 3.82Å; M634-W642 HydrophobicContact CE-CB 4.17Å
635	S	92.3	Very high	90.4	Very high	55 Å²	55	64.2 Å²	64.2	39%	0.385	31%	0.314	S	S	.	.			trans	-73.3	159.8	174.8	65.4	0	0	0	0	112.3	Q637 Q638 V639	S635-Q637 PolarHBondContact O-N 3.47Å; S635-Q638 PolarHBondContact O-N 3Å; S635-Q638 WeakPolarHBondContact OG-CG 3.42Å; S635-Q638 PolarHBondContact OG-OE1 3.05Å; S635-V639 PolarHBondContact O-N 2.9Å
636	Y	93.2	Very high	89.9	Confident	120 Å²	120	67.2 Å²	67.2	47%	0.471	33%	0.328	S	S	.	.	H	α-helix	trans	-46.4	-39.9	177.5	-66	-90.5	0	0	0	113.8	L625 D626 C629 R640	L625-Y636 HydrophobicContact CD1-CD1 4.5Å; L625-Y636 HydrophobicContact CD2-CD1 3.91Å; L625-Y636 HydrophobicContact CG-CD1 3.78Å; L625-Y636 HydrophobicContact CG-CE1 4.36Å; D626-Y636 HydrophobicContact CB-CE1 4.29Å; D626-Y636 PolarHBondContact OD1-OH 3.29Å; C629-Y636 VanDerWaalsContact SG-CA 3.52Å; C629-Y636 PolarHBondContact SG-N 3.15Å; Y636-R640 WeakPolarHBondContact O-CG 3.09Å; Y636-R640 PolarHBondContact O-N 3.4Å
637	Q	92.2	Very high	88.7	Confident	107 Å²	107	69.3 Å²	69.3	50%	0.5	34%	0.336	S	S	.	.	H	α-helix	trans	-73	-45.8	177.8	-166.4	61.5	52.7	0	0	111.5	S635 V639 R640 D641	S635-Q637 PolarHBondContact O-N 3.47Å; Q637-V639 VanDerWaalsContact C-N 3.27Å; Q637-V639 PolarHBondContact O-N 2.84Å; Q637-R640 PolarHBondContact O-N 3.02Å; Q637-R640 VanDerWaalsContact O-N 3.16Å; Q637-D641 PolarHBondContact NE2-OD1 2.97Å; Q637-D641 WeakPolarHBondContact O-CB 3.46Å; Q637-D641 PolarHBondContact O-N 2.83Å
638	Q	91.8	Very high	87.2	Confident	90 Å²	90	70.1 Å²	70.1	42%	0.421	34%	0.344	S	S	.	.	H	α-helix	trans	-61.7	-33.1	178	-70.4	167.4	-71.1	0	0	113	M634 S635 W642	M634-Q638 HydrophobicContact CB-CB 4Å; M634-Q638 HydrophobicContact CE-CB 3.82Å; M634-Q638 VanDerWaalsContact CE-O 3.31Å; M634-Q638 WeakPolarHBondContact CE-O 3.49Å; M634-Q638 HydrophobicContact CG-CB 4.45Å; S635-Q638 PolarHBondContact O-N 3Å; S635-Q638 WeakPolarHBondContact OG-CG 3.42Å; S635-Q638 PolarHBondContact OG-OE1 3.05Å; Q638-W642 WeakPolarHBondContact O-CB 3.26Å; Q638-W642 PolarHBondContact O-N 3.03Å; Q638-W642 VanDerWaalsContact O-N 3.07Å
639	V	92.1	Very high	85.3	Confident	0 Å²	0	72.4 Å²	72.4	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-68.4	-47.8	173.5	175.2	0	0	0	0	110.6	L610 L620 L625 L628 M634 S635 Q637 D641 W642 F643	L610-V639 HydrophobicContact CD2-CG1 3.88Å; L610-V639 HydrophobicContact CD2-CG2 4.1Å; L620-V639 HydrophobicContact CD1-CG1 4.29Å; L620-V639 HydrophobicContact CD2-CG1 4.4Å; L625-V639 HydrophobicContact CD1-CB 3.81Å; L625-V639 HydrophobicContact CD1-CG1 3.52Å; L628-V639 HydrophobicContact CB-CG1 4.21Å; M634-V639 HydrophobicContact CB-CG2 3.82Å; S635-V639 PolarHBondContact O-N 2.9Å; Q637-V639 VanDerWaalsContact C-N 3.27Å; Q637-V639 PolarHBondContact O-N 2.84Å; V639-D641 PolarHBondContact O-N 2.99Å; V639-W642 PolarHBondContact O-N 3.3Å; V639-F643 HydrophobicContact CG1-CD2 4.1Å; V639-F643 HydrophobicContact CG1-CE2 4.11Å; V639-F643 WeakPolarHBondContact O-CD2 3.38Å; V639-F643 PolarHBondContact O-N 2.57Å; V639-F643 VanDerWaalsContact O-N 3.13Å
640	R	92.9	Very high	83.4	Confident	100 Å²	100	78.3 Å²	78.3	38%	0.377	40%	0.395	S	S	.	.	H	α-helix	trans	-61.1	-43.8	175.6	-75.4	178.6	176.4	162.9	1.4	112.6	L620 E622 L625 Y636 Q637 W642 F643 A644	L620-R640 HydrophobicContact CD2-CB 4.34Å; L620-R640 HydrophobicContact CD2-CG 3.73Å; E622-R640 IonicContact OE1-CZ 3.64Å; E622-R640 IonicContact OE1-NE 3.84Å; E622-R640 PolarHBondContact OE1-NE 2.92Å; E622-R640 IonicContact OE1-NH2 2.8Å; E622-R640 PolarHBondContact OE1-NH2 3.08Å; E622-R640 IonicContact OE2-CZ 2.92Å; E622-R640 IonicContact OE2-NE 2.78Å; E622-R640 IonicContact OE2-NH2 3.7Å; E622-R640 PolarHBondContact OE2-NH2 2.61Å; L625-R640 HydrophobicContact CD1-CG 4.44Å; L625-R640 HydrophobicContact CD2-CG 4.38Å; Y636-R640 WeakPolarHBondContact O-CG 3.09Å; Y636-R640 PolarHBondContact O-N 3.4Å; Q637-R640 PolarHBondContact O-N 3.02Å; Q637-R640 VanDerWaalsContact O-N 3.16Å; R640-W642 VanDerWaalsContact C-N 3.26Å; R640-W642 PolarHBondContact O-N 2.68Å; R640-F643 PolarHBondContact O-N 3.27Å; R640-A644 WeakPolarHBondContact O-CB 3.21Å; R640-A644 PolarHBondContact O-N 3.5Å
641	D	89.4	Confident	81.3	Confident	87 Å²	87	77 Å²	77	47%	0.465	40%	0.399	S	S	.	.	H	α-helix	trans	-62.5	-34.4	177.6	-63.4	-15.2	0	0	0	111.4	Q637 V639 A645	Q637-D641 PolarHBondContact NE2-OD1 2.97Å; Q637-D641 WeakPolarHBondContact O-CB 3.46Å; Q637-D641 PolarHBondContact O-N 2.83Å; V639-D641 PolarHBondContact O-N 2.99Å; D641-A645 VanDerWaalsContact O-CB 3.32Å; D641-A645 WeakPolarHBondContact O-CB 3.44Å; D641-A645 PolarHBondContact O-N 3.1Å
642	W	91.3	Very high	79.1	Confident	49 Å²	49	79 Å²	79	19%	0.186	42%	0.415	C	S	.	.	H	α-helix	trans	-68.9	-45.4	175.9	-177.2	88.2	0	0	0	112.4	I607 L610 V611 Y614 M634 Q638 V639 R640 A645 Q646	I607-W642 HydrophobicContact CG2-CZ2 4.26Å; L610-W642 HydrophobicContact CB-CD2 3.93Å; L610-W642 HydrophobicContact CB-CE3 3.68Å; L610-W642 HydrophobicContact CB-CH2 3.94Å; L610-W642 HydrophobicContact CB-CZ2 4.15Å; L610-W642 HydrophobicContact CB-CZ3 3.7Å; L610-W642 HydrophobicContact CD1-CB 4.2Å; L610-W642 HydrophobicContact CD1-CD2 3.86Å; L610-W642 HydrophobicContact CD1-CE3 4.14Å; L610-W642 HydrophobicContact CD1-CG 3.87Å; L610-W642 HydrophobicContact CG-CE3 4.46Å; V611-W642 HydrophobicContact CG2-CH2 4.15Å; V611-W642 HydrophobicContact CG2-CZ2 3.68Å; Y614-W642 HydrophobicContact CG-CH2 4.41Å; M634-W642 HydrophobicContact CE-CB 4.17Å; Q638-W642 WeakPolarHBondContact O-CB 3.26Å; Q638-W642 PolarHBondContact O-N 3.03Å; Q638-W642 VanDerWaalsContact O-N 3.07Å; V639-W642 PolarHBondContact O-N 3.3Å; R640-W642 VanDerWaalsContact C-N 3.26Å; R640-W642 PolarHBondContact O-N 2.68Å; W642-A645 PolarHBondContact O-N 2.78Å; W642-Q646 PolarHBondContact O-N 3.01Å; W642-Q646 VanDerWaalsContact O-N 3.15Å
643	F	90.1	Very high	77.2	Confident	3 Å²	3	88.2 Å²	88.2	1%	0.013	46%	0.458	C	S	.	.	H	α-helix	trans	-66.3	-40.8	175	-83.1	-88.4	0	0	0	111.9	L610 Y613 Y614 L620 L628 V639 R640 A645 Q646 E647	L610-F643 HydrophobicContact CD2-CE2 4.26Å; Y613-F643 HydrophobicContact CD1-CE1 4.1Å; Y613-F643 AromaticContact CD1-CZ 3.66Å; Y613-F643 HydrophobicContact CD1-CZ 3.66Å; Y613-F643 HydrophobicContact CE1-CZ 4.36Å; Y614-F643 HydrophobicContact CD2-CD1 4.2Å; Y614-F643 HydrophobicContact CD2-CE1 4.07Å; Y614-F643 HydrophobicContact CG-CE1 4.44Å; L620-F643 HydrophobicContact CB-CB 4.06Å; L620-F643 HydrophobicContact CB-CD1 3.92Å; L620-F643 HydrophobicContact CB-CD2 3.97Å; L620-F643 HydrophobicContact CB-CE1 4.36Å; L620-F643 HydrophobicContact CB-CE2 4.44Å; L620-F643 HydrophobicContact CB-CG 3.72Å; L620-F643 HydrophobicContact CD1-CD2 3.92Å; L620-F643 HydrophobicContact CD1-CE2 3.85Å; L620-F643 HydrophobicContact CD1-CZ 4.38Å; L620-F643 HydrophobicContact CD2-CB 4.15Å; L620-F643 HydrophobicContact CD2-CD2 3.84Å; L620-F643 HydrophobicContact CD2-CG 4.14Å; L620-F643 HydrophobicContact CG-CD2 4.12Å; L620-F643 HydrophobicContact CG-CG 4.35Å; L628-F643 HydrophobicContact CD1-CE2 4.1Å; L628-F643 HydrophobicContact CD1-CZ 4.33Å; V639-F643 HydrophobicContact CG1-CD2 4.1Å; V639-F643 HydrophobicContact CG1-CE2 4.11Å; V639-F643 WeakPolarHBondContact O-CD2 3.38Å; V639-F643 PolarHBondContact O-N 2.57Å; V639-F643 VanDerWaalsContact O-N 3.13Å; R640-F643 PolarHBondContact O-N 3.27Å; F643-A645 VanDerWaalsContact C-N 3.28Å; F643-A645 PolarHBondContact O-N 2.82Å; F643-Q646 WeakPolarHBondContact O-CB 3.34Å; F643-Q646 PolarHBondContact O-N 3.21Å; F643-E647 PolarHBondContact O-N 3.34Å
644	A	88.1	Confident	75.1	Confident	52 Å²	52	88.8 Å²	88.8	43%	0.43	47%	0.468	S	S	.	.	H	α-helix	trans	-64.3	-31.5	175.8	0	0	0	0	0	112.9	R640 Q646 V648	R640-A644 WeakPolarHBondContact O-CB 3.21Å; R640-A644 PolarHBondContact O-N 3.5Å; A644-Q646 VanDerWaalsContact C-N 3.32Å; A644-V648 WeakPolarHBondContact O-CG2 3.44Å; A644-V648 PolarHBondContact O-N 3.27Å
645	A	83.8	Confident	73.3	Confident	70 Å²	70	95.7 Å²	95.7	58%	0.579	50%	0.503	S	S	*	.	H	α-helix	trans	-71.6	-27.4	171.8	0	0	0	0	0	112.8	D641 W642 F643	D641-A645 VanDerWaalsContact O-CB 3.32Å; D641-A645 WeakPolarHBondContact O-CB 3.44Å; D641-A645 PolarHBondContact O-N 3.1Å; W642-A645 PolarHBondContact O-N 2.78Å; F643-A645 VanDerWaalsContact C-N 3.28Å; F643-A645 PolarHBondContact O-N 2.82Å
646	Q	80.6	Confident	71	Confident	66 Å²	66	99.5 Å²	99.5	31%	0.308	52%	0.524	S	S	.	.	H	α-helix	trans	-79.4	-41.2	177.9	-172.6	61.6	60.2	0	0	112	Y614 W642 F643 A644 V648 G649	Y614-Q646 HydrophobicContact CD1-CG 4.07Å; Y614-Q646 HydrophobicContact CD2-CG 3.92Å; Y614-Q646 HydrophobicContact CE1-CG 3.61Å; Y614-Q646 HydrophobicContact CE2-CB 4.43Å; Y614-Q646 HydrophobicContact CE2-CG 3.47Å; Y614-Q646 VanDerWaalsContact CE2-CG 3.47Å; Y614-Q646 HydrophobicContact CG-CG 4.21Å; W642-Q646 PolarHBondContact O-N 3.01Å; W642-Q646 VanDerWaalsContact O-N 3.15Å; F643-Q646 WeakPolarHBondContact O-CB 3.34Å; F643-Q646 PolarHBondContact O-N 3.21Å; A644-Q646 VanDerWaalsContact C-N 3.32Å; Q646-V648 PolarHBondContact O-N 3.44Å; Q646-G649 PolarHBondContact O-N 3.44Å
647	E	65.3	Low	68.5	Low	104 Å²	104	100.3 Å²	100.3	49%	0.486	54%	0.541	S	S	.	.	H	α-helix	trans	-62.5	-25.3	174.6	-71.9	178.5	178.3	0	0	113	F643 G649	F643-E647 PolarHBondContact O-N 3.34Å; E647-G649 VanDerWaalsContact C-N 3.33Å
648	V	58.8	Low	65.8	Low	112 Å²	112	103.4 Å²	103.4	68%	0.679	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	-10.9	174.3	173	0	0	0	0	112.4	A644 Q646	A644-V648 WeakPolarHBondContact O-CG2 3.44Å; A644-V648 PolarHBondContact O-N 3.27Å; Q646-V648 PolarHBondContact O-N 3.44Å
649	G	52.5	Low	64.5	Low	50 Å²	50	104.1 Å²	104.1	52%	0.515	59%	0.594	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.4	-19.3	-178.6	0	0	0	0	0	115.4	Q646 E647	Q646-G649 PolarHBondContact O-N 3.44Å; E647-G649 VanDerWaalsContact C-N 3.33Å
650	E	50.8	Low	63.1	Low	135 Å²	135	109.6 Å²	109.6	63%	0.631	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	0.7	-172.3	-71.8	-178.8	101.1	0	0	114.4	Y614	Y614-E650 PolarHBondContact OH-OE1 3.12Å; Y614-E650 PolarHBondContact OH-OE2 3.46Å
651	T	45.8	Very low	61.4	Low	114 Å²	114	110.1 Å²	110.1	70%	0.699	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.1	-1.3	-171.7	58	0	0	0	0	116.6
652	D	43.9	Very low	59.7	Low	154 Å²	154	111.5 Å²	111.5	82%	0.824	65%	0.649	S	S	*	*	S	Bend	trans	-123.7	-2.7	-173	-97.8	-28.5	0	0	0	115.6
653	E	48.8	Very low	57.8	Low	194 Å²	194	115.4 Å²	115.4	91%	0.907	68%	0.678	S	S	*	*	S	Bend	trans	-122.3	37	-179.7	-72.4	-156.5	176.4	0	0	115.6
654	E	45.5	Very low	55.6	Low	182 Å²	182	122.9 Å²	122.9	85%	0.85	72%	0.722	S	S	*	*			trans	-141.5	90.6	159	-165.3	170.8	-162.5	0	0	112.7
655	I	49.2	Very low	53.3	Low	165 Å²	165	127.9 Å²	127.9	85%	0.846	74%	0.743	S	S	*	*			trans	-176.4	74.4	146.1	-89.4	147.7	0	0	0	107.8
656	V	44.1	Very low	51	Low	136 Å²	136	132.4 Å²	132.4	82%	0.824	76%	0.756	S	S	*	*			trans	-143.3	108.6	165.8	-179.5	0	0	0	0	110.2
657	V	42.3	Very low	48.5	Very low	137 Å²	137	137.9 Å²	137.9	83%	0.83	79%	0.793	S	S	*	*			trans	64.9	101.9	165.3	-177.3	0	0	0	0	117.6
658	A	34.8	Very low	47	Very low	172 Å²	172	141 Å²	141	100%	1.421	82%	0.821	S	S	*	*				-137.2	0	119.7	0	0	0	0	0	108.6

Retrieved 658 of 658 residues in 1071.9 ms (Link to these results)

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