A0A096LSH5_POEFO Loading...

Pleckstrin homology like domain family B member 3

AlphaFold DB , UniProt , Accession A0A096LSH5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 583 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.1	Very low	35.5	Very low	225 Å²	225	160.8 Å²	160.8	100%	1.108	83%	0.83	S	S	*	*				0	60.2	0	-51.8	-176.9	-169.7	0	0	107.1
2	D	36.2	Very low	35.3	Very low	139 Å²	139	167.5 Å²	167.5	74%	0.743	84%	0.837	S	S	*	*				82.9	135.4	71	-68	-56.2	0	0	0	111.1
3	R	39.2	Very low	35	Very low	219 Å²	219	168.7 Å²	168.7	83%	0.826	84%	0.838	S	S	*	*			cis	-160.1	172.7	5.5	-133.4	169.2	179.1	-154	-0.5	111.7
4	S	38.6	Very low	34.8	Very low	98 Å²	98	167.1 Å²	167.1	69%	0.685	84%	0.842	S	S	*	*			trans	85.6	120.8	168.3	-50.9	0	0	0	0	115.5
5	L	40.8	Very low	34.4	Very low	150 Å²	150	168.4 Å²	168.4	79%	0.785	84%	0.844	S	S	*	*				69.7	130.9	51.1	-54.9	167.3	0	0	0	111.6
6	L	37.9	Very low	34.6	Very low	144 Å²	144	166.5 Å²	166.5	75%	0.754	84%	0.844	S	S	*	*			cis	-161.3	138.6	1.5	-119.2	168.2	0	0	0	110.6
7	H	31.8	Very low	34.5	Very low	182 Å²	182	170.9 Å²	170.9	84%	0.843	85%	0.848	S	S	*	*			trans	-171.6	125.6	153.8	-115.3	-80.2	0	0	0	109.6
8	H	33.4	Very low	34.1	Very low	196 Å²	196	165.7 Å²	165.7	91%	0.907	85%	0.845	S	S	*	*			trans	-152.6	150	170.2	-105	57.5	0	0	0	110.3
9	S	33.3	Very low	33.9	Very low	112 Å²	112	165.7 Å²	165.7	78%	0.783	85%	0.846	S	S	*	*			trans	-130.3	147.7	-178.2	177.7	0	0	0	0	110.5
10	S	30.9	Very low	33.8	Very low	122 Å²	122	162.9 Å²	162.9	85%	0.853	84%	0.841	S	S	*	*			trans	-167.5	148.7	161.3	-91.4	0	0	0	0	114.3
11	H	33.3	Very low	33.8	Very low	182 Å²	182	160.2 Å²	160.2	84%	0.843	84%	0.843	S	S	*	*			trans	-72.8	157	179.4	-62.1	-82.6	0	0	0	114.4
12	R	32.8	Very low	33.7	Very low	241 Å²	241	157.5 Å²	157.5	91%	0.909	83%	0.833	S	S	*	*			trans	-136.3	117.5	141.6	-58.1	-176.6	-166.1	-119.5	-1.6	106.3
13	H	31.2	Very low	33.3	Very low	183 Å²	183	158.2 Å²	158.2	85%	0.847	84%	0.836	S	S	*	*				55.2	99.1	82	-85.2	52.6	0	0	0	113.1
14	T	32.5	Very low	32.9	Very low	147 Å²	147	155.2 Å²	155.2	90%	0.902	83%	0.834	S	S	*	*			trans	-83.5	138	166.7	41	0	0	0	0	109.9
15	Q	29.2	Very low	32.6	Very low	186 Å²	186	155.9 Å²	155.9	87%	0.869	84%	0.836	S	S	*	*			trans	-134.2	128.5	173.5	-169.5	172.5	36.4	0	0	109.8
16	T	36.9	Very low	32.2	Very low	138 Å²	138	158 Å²	158	85%	0.847	84%	0.841	S	S	*	*			trans	-72.5	137	178.7	41.2	0	0	0	0	111.5
17	R	33.2	Very low	31.7	Very low	241 Å²	241	159.5 Å²	159.5	91%	0.909	84%	0.844	S	S	*	*			trans	-137.2	142.7	163.4	-98.6	-176.3	166.6	-176.2	-4.8	109.4
18	G	27.8	Very low	31.6	Very low	77 Å²	77	157.2 Å²	157.2	79%	0.794	84%	0.838	S	S	*	*			trans	-73.2	153.5	-169.1	0	0	0	0	0	114.1
19	I	30.8	Very low	31.4	Very low	167 Å²	167	155.4 Å²	155.4	86%	0.856	83%	0.832	S	S	*	*			trans	-87.6	112.5	173.6	-59.6	171.7	0	0	0	108
20	S	30.6	Very low	31.2	Very low	109 Å²	109	158 Å²	158	76%	0.762	83%	0.832	S	S	*	*			trans	-98.8	144.3	167.1	-68.9	0	0	0	0	109.8	L22	S20-L22 PolarHBondContact O-N 3.3Å
21	A	34	Very low	31	Very low	107 Å²	107	159.5 Å²	159.5	88%	0.884	83%	0.83	S	S	*	*			trans	-15.4	114.5	177.7	0	0	0	0	0	116.6
22	L	32.3	Very low	30.7	Very low	168 Å²	168	155.3 Å²	155.3	88%	0.88	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-88.7	122.8	159.5	-88.9	167.2	0	0	0	109.2	S20	S20-L22 PolarHBondContact O-N 3.3Å
23	D	28.9	Very low	30.5	Very low	153 Å²	153	155.7 Å²	155.7	82%	0.818	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-68.1	149.5	174.8	-168.6	15.9	0	0	0	111
24	M	31.4	Very low	30.4	Very low	157 Å²	157	152.5 Å²	152.5	77%	0.773	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-103.9	125.4	177.4	-82.1	-159	71.9	0	0	110.7	Q26	M24-Q26 PolarHBondContact O-N 3.21Å
25	P	32.2	Very low	30.2	Very low	112 Å²	112	154.2 Å²	154.2	73%	0.727	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-67	118.3	-175.2	26.9	-34.1	0	0	0	111.4	H27	P25-H27 PolarHBondContact O-N 3.15Å; P25-H27 VanDerWaalsContact O-N 3.15Å
26	Q	30.8	Very low	30.3	Very low	194 Å²	194	156.8 Å²	156.8	91%	0.907	82%	0.821	S	S	*	*			trans	-70.1	106.5	170	-68.2	-168.6	-41.7	0	0	109.9	M24 N28	M24-Q26 PolarHBondContact O-N 3.21Å; Q26-N28 PolarHBondContact O-N 3.41Å; Q26-N28 VanDerWaalsContact O-N 3.11Å
27	H	28.2	Very low	29.9	Very low	175 Å²	175	158.8 Å²	158.8	81%	0.81	82%	0.82	S	S	*	*			trans	-72.6	103.4	170.8	-122.2	-80.1	0	0	0	109.8	P25 M29	P25-H27 PolarHBondContact O-N 3.15Å; P25-H27 VanDerWaalsContact O-N 3.15Å; H27-M29 PolarHBondContact O-N 2.77Å
28	N	29.9	Very low	29.7	Very low	135 Å²	135	156 Å²	156	72%	0.722	82%	0.818	S	S	*	*			trans	-69.4	118.6	173.4	-176.7	22.7	0	0	0	109.9	Q26	Q26-N28 PolarHBondContact O-N 3.41Å; Q26-N28 VanDerWaalsContact O-N 3.11Å
29	M	29.6	Very low	29.7	Very low	158 Å²	158	157.1 Å²	157.1	78%	0.778	81%	0.813	S	S	*	*			trans	-125	109.1	170.5	-77.8	-72.4	-82.9	0	0	108.6	H27 N31	H27-M29 PolarHBondContact O-N 2.77Å; M29-N31 VanDerWaalsContact C-N 3.33Å; M29-N31 PolarHBondContact O-N 3.12Å
30	E	28.1	Very low	29.6	Very low	166 Å²	166	157.7 Å²	157.7	78%	0.776	82%	0.817	S	S	*	*			trans	-66.1	82.9	-179.4	-174.7	78.5	-131.8	0	0	110.6	S32	E30-S32 PolarHBondContact O-N 3.05Å
31	N	27.3	Very low	29.6	Very low	154 Å²	154	160.3 Å²	160.3	82%	0.824	82%	0.817	S	S	*	*			trans	-73.7	114.1	179.7	-168.5	10.5	0	0	0	110.8	M29	M29-N31 VanDerWaalsContact C-N 3.33Å; M29-N31 PolarHBondContact O-N 3.12Å
32	S	26.3	Very low	29.4	Very low	93 Å²	93	163.2 Å²	163.2	65%	0.65	81%	0.812	S	S	*	*			trans	-66.8	142.1	-175.5	-75.7	0	0	0	0	112.7	E30 S34	E30-S32 PolarHBondContact O-N 3.05Å; S32-S34 PolarHBondContact O-N 3.49Å
33	R	29.1	Very low	29.5	Very low	250 Å²	250	160.3 Å²	160.3	94%	0.943	80%	0.804	S	S	*	*			trans	-48.8	119.7	-176.2	-68.5	174.7	171	179.6	-2.6	113.4
34	S	28.9	Very low	29.8	Very low	116 Å²	116	163.2 Å²	163.2	81%	0.811	80%	0.803	S	S	*	*			trans	-99	114.6	160.9	-75.6	0	0	0	0	110.7	S32 W36	S32-S34 PolarHBondContact O-N 3.49Å; S34-W36 VanDerWaalsContact C-N 3.31Å; S34-W36 PolarHBondContact O-N 3.47Å
35	Q	29	Very low	29.9	Very low	183 Å²	183	162.6 Å²	162.6	86%	0.855	80%	0.802	S	S	*	*			trans	-85.6	40.4	-160.4	-162.5	-177.8	-30.3	0	0	114.8
36	W	31.6	Very low	29.9	Very low	240 Å²	240	162.2 Å²	162.2	91%	0.909	80%	0.801	S	S	*	*			trans	-134.1	56.2	-168.7	-71.7	109.4	0	0	0	115.8	S34	S34-W36 VanDerWaalsContact C-N 3.31Å; S34-W36 PolarHBondContact O-N 3.47Å
37	Q	28.3	Very low	30.1	Very low	179 Å²	179	160.2 Å²	160.2	84%	0.836	79%	0.786	S	S	*	*			trans	-150.3	92.4	160	-106.7	165.8	30.7	0	0	111.1
38	Q	29.2	Very low	30.3	Very low	183 Å²	183	158.3 Å²	158.3	86%	0.855	79%	0.786	S	S	*	*			trans	-124.2	134.9	166.8	-74.8	-167.2	1.5	0	0	111.3
39	S	28.1	Very low	30.2	Very low	100 Å²	100	156.8 Å²	156.8	70%	0.699	79%	0.792	S	S	*	*			trans	56	73.7	160.9	59.6	0	0	0	0	118
40	L	28.8	Very low	30.3	Very low	179 Å²	179	154 Å²	154	94%	0.937	80%	0.795	S	S	*	*			trans	-102.9	53.2	148.7	-103.4	162.3	0	0	0	110.7	Q42	L40-Q42 PolarHBondContact O-N 3.07Å
41	H	29.2	Very low	30.3	Very low	164 Å²	164	149.6 Å²	149.6	76%	0.759	79%	0.793	S	S	*	*			trans	-69.7	112.1	169.3	-90.8	-84	0	0	0	110.2
42	Q	29.3	Very low	30.4	Very low	168 Å²	168	151.5 Å²	151.5	79%	0.785	80%	0.797	S	S	*	*			trans	-60.9	133.1	157.4	-71.2	-76.5	1	0	0	108.6	L40 W44	L40-Q42 PolarHBondContact O-N 3.07Å; Q42-W44 PolarHBondContact O-N 3.35Å
43	P	34.9	Very low	30.5	Very low	108 Å²	108	152.4 Å²	152.4	70%	0.701	80%	0.804	S	S	*	*			trans	-83.1	114.5	-174.6	31.3	-33	0	0	0	111.5
44	W	35.2	Very low	31.8	Very low	214 Å²	214	146.5 Å²	146.5	81%	0.811	80%	0.798	S	S	*	*			trans	-76.8	162.2	167.1	68.9	-92.7	0	0	0	111.5	Q42 S46	Q42-W44 PolarHBondContact O-N 3.35Å; W44-S46 PolarHBondContact O-N 3.38Å
45	I	34	Very low	31.7	Very low	144 Å²	144	145.8 Å²	145.8	74%	0.738	80%	0.799	S	S	*	*			trans	-81.3	107.2	-165.9	-59.9	170.8	0	0	0	110.7	R47	I45-R47 PolarHBondContact O-N 3Å; I45-R47 VanDerWaalsContact O-N 3.07Å
46	S	32.4	Very low	31.7	Very low	103 Å²	103	142.5 Å²	142.5	72%	0.72	80%	0.796	S	S	*	*			trans	-62.7	108.9	167.3	-52	0	0	0	0	110	W44 V48	W44-S46 PolarHBondContact O-N 3.38Å; S46-V48 PolarHBondContact O-N 3.3Å
47	R	34.8	Very low	31.6	Very low	153 Å²	153	136.8 Å²	136.8	58%	0.577	79%	0.793	S	S	*	*			trans	-71.1	128.7	176.5	-92.9	-168.6	-102.2	-170.9	1.1	111.4	I45 A49 E112 E116	I45-R47 PolarHBondContact O-N 3Å; I45-R47 VanDerWaalsContact O-N 3.07Å; R47-A49 PolarHBondContact O-N 2.67Å; R47-E112 IonicContact CZ-OE1 3.42Å; R47-E112 IonicContact CZ-OE2 3.44Å; R47-E112 IonicContact NH1-OE1 2.8Å; R47-E112 PolarHBondContact NH1-OE1 2.96Å; R47-E112 IonicContact NH1-OE2 2.64Å; R47-E112 PolarHBondContact NH1-OE2 2.91Å; R47-E112 IonicContact NH2-OE1 2.54Å; R47-E112 IonicContact NH2-OE2 3.47Å; R47-E112 PolarHBondContact NH2-OE2 2.7Å; R47-E116 IonicContact NH2-OE1 3.11Å
48	V	32.4	Very low	31.5	Very low	135 Å²	135	131 Å²	131	82%	0.818	78%	0.781	S	S	*	*			trans	-79.8	113.1	172.7	179.7	0	0	0	0	108.5	S46	S46-V48 PolarHBondContact O-N 3.3Å
49	A	28.7	Very low	31.7	Very low	103 Å²	103	126.5 Å²	126.5	85%	0.851	78%	0.776	S	S	*	*			trans	-73.3	122.5	163.4	0	0	0	0	0	108.5	R47	R47-A49 PolarHBondContact O-N 2.67Å
50	A	31.1	Very low	31.8	Very low	100 Å²	100	130 Å²	130	83%	0.826	78%	0.781	S	S	*	*			trans	-109.1	137.7	-175.1	0	0	0	0	0	112
51	G	28.6	Very low	31.9	Very low	73 Å²	73	126.7 Å²	126.7	75%	0.753	77%	0.773	S	S	*	*			trans	131.5	117.2	-177.5	0	0	0	0	0	110.6
52	Q	28.9	Very low	31.8	Very low	193 Å²	193	126 Å²	126	90%	0.902	78%	0.775	S	S	*	*			cis	-138.4	177.8	4.9	-67.3	172.1	-15.5	0	0	110.8
53	S	27.4	Very low	31.9	Very low	113 Å²	113	124.3 Å²	124.3	79%	0.79	78%	0.776	S	S	*	*			trans	-141.2	-178.5	-176.8	-52.2	0	0	0	0	109.5
54	P	56	Low	31.7	Very low	125 Å²	125	127.3 Å²	127.3	81%	0.812	78%	0.78	S	S	*	*				-134.5	165.7	-64.7	39.3	-25.2	0	0	0	113.3
55	A	27	Very low	31.3	Very low	102 Å²	102	121.6 Å²	121.6	84%	0.843	77%	0.773	S	S	*	*			trans	180	160	158.8	0	0	0	0	0	110.5
56	S	29.7	Very low	31	Very low	114 Å²	114	119.6 Å²	119.6	80%	0.797	77%	0.772	S	S	*	*			cis	-170.1	149.9	-31.1	-171.3	0	0	0	0	108.7
57	S	29.7	Very low	30.9	Very low	119 Å²	119	119.3 Å²	119.3	83%	0.832	77%	0.77	S	S	*	*			trans	63.5	149.7	178.3	-148.7	0	0	0	0	116.5
58	G	26.8	Very low	30.7	Very low	58 Å²	58	118.4 Å²	118.4	60%	0.598	78%	0.782	S	S	*	*			cis	140.9	125.6	-13.4	0	0	0	0	0	112.9
59	A	32.5	Very low	30.5	Very low	89 Å²	89	120.6 Å²	120.6	74%	0.736	78%	0.783	S	S	*	*			trans	69.2	153.5	173.3	0	0	0	0	0	115.9
60	E	30.9	Very low	30.6	Very low	172 Å²	172	120.9 Å²	120.9	80%	0.804	78%	0.779	S	S	*	*			cis	-167.1	166.4	-17.6	50.3	-162.7	117.4	0	0	111.9
61	S	29.6	Very low	30.5	Very low	110 Å²	110	123.3 Å²	123.3	77%	0.769	77%	0.773	S	S	*	*			trans	75	149.9	162.2	-55.9	0	0	0	0	120.9
62	D	28.7	Very low	30.5	Very low	151 Å²	151	127.6 Å²	127.6	81%	0.807	77%	0.771	S	S	*	*			trans	-96	153.2	-176.4	-47.5	-94.5	0	0	0	113.3
63	T	31.5	Very low	30.4	Very low	132 Å²	132	124.3 Å²	124.3	81%	0.81	76%	0.764	S	S	*	*				170.3	146.2	117.4	32.2	0	0	0	0	114.7
64	E	28.8	Very low	30.3	Very low	170 Å²	170	124 Å²	124	79%	0.794	76%	0.758	S	S	*	*			trans	52.2	125.4	144.5	-68.9	-149.6	67	0	0	125.5
65	S	26.9	Very low	29	Very low	94 Å²	94	125.8 Å²	125.8	66%	0.657	76%	0.76	S	S	*	*				76.3	107.4	122.4	-60.3	0	0	0	0	123.1
66	S	28	Very low	29	Very low	102 Å²	102	126.9 Å²	126.9	71%	0.713	76%	0.762	S	S	*	*				69.3	106.5	122.3	-176.5	0	0	0	0	122.6
67	S	30.6	Very low	28.9	Very low	97 Å²	97	126.9 Å²	126.9	68%	0.678	76%	0.76	S	S	*	*				70.7	152.4	128.7	-46.8	0	0	0	0	121.3
68	T	31.3	Very low	29	Very low	135 Å²	135	128.5 Å²	128.5	83%	0.828	76%	0.759	S	S	*	*			trans	64.4	153.6	165	28.6	0	0	0	0	115.7
69	E	28.3	Very low	29.3	Very low	181 Å²	181	135.3 Å²	135.3	85%	0.846	77%	0.772	S	S	*	*			cis	-145.9	-167.9	-2.7	54.6	-157.4	109	0	0	111.3
70	S	29.8	Very low	29.5	Very low	109 Å²	109	138.9 Å²	138.9	76%	0.762	77%	0.771	S	S	*	*			trans	-109.3	175.4	-172.3	-67.9	0	0	0	0	113.4
71	E	29	Very low	29.7	Very low	151 Å²	151	136.2 Å²	136.2	71%	0.706	77%	0.768	S	S	*	*			trans	86.7	107.4	155.3	-72.5	-141.6	96.4	0	0	121.2
72	K	28.1	Very low	30.2	Very low	163 Å²	163	138.1 Å²	138.1	71%	0.709	77%	0.765	S	S	*	*				98.9	171.4	110.6	-159.6	-179.1	-142	144.5	0	119
73	V	26.8	Very low	30.4	Very low	123 Å²	123	137.7 Å²	137.7	75%	0.745	77%	0.768	S	S	*	*			trans	75.7	83.6	-178.1	-169.6	0	0	0	0	113.7
74	T	27.2	Very low	30.5	Very low	108 Å²	108	134.4 Å²	134.4	66%	0.663	76%	0.76	S	S	*	*				83.9	122.8	64.7	64.6	0	0	0	0	116.6
75	D	27.1	Very low	31.3	Very low	161 Å²	161	131.6 Å²	131.6	86%	0.861	76%	0.759	S	S	*	*			trans	58.6	116.7	152.5	-60.3	-27.6	0	0	0	122.8
76	S	27.8	Very low	31.7	Very low	126 Å²	126	131 Å²	131	88%	0.881	76%	0.755	S	S	*	*				-147.5	151.7	125.7	64.6	0	0	0	0	111.8
77	C	27.4	Very low	32.7	Very low	114 Å²	114	133.3 Å²	133.3	77%	0.77	75%	0.748	S	S	*	*			trans	-89.1	151.8	-158.6	-117	0	0	0	0	115.9
78	L	32.8	Very low	33.2	Very low	153 Å²	153	137.3 Å²	137.3	80%	0.801	75%	0.754	S	S	*	*			trans	56.6	106.7	144.1	-63.5	166.4	0	0	0	119.9
79	K	32.4	Very low	34	Very low	201 Å²	201	136 Å²	136	87%	0.874	74%	0.737	S	S	*	*				-170.9	123.3	104	-100.3	159.4	-174.9	173.8	0	112.9
80	K	37.2	Very low	35.5	Very low	164 Å²	164	130.3 Å²	130.3	71%	0.713	72%	0.717	S	S	*	*			trans	-68.1	152.1	151.2	-90.2	-177.6	169.1	-176.8	0	108.6	E82	K80-E82 HydrophobicContact CD-CG 4.21Å; K80-E82 IonicContact NZ-OE1 2.65Å; K80-E82 PolarHBondContact NZ-OE1 3.49Å
81	P	34.9	Very low	37.8	Very low	115 Å²	115	128 Å²	128	75%	0.747	70%	0.701	S	S	*	*				-122.6	139.5	108.8	34.2	-32.8	0	0	0	112.7
82	E	38.8	Very low	40.2	Very low	151 Å²	151	124 Å²	124	71%	0.706	69%	0.688	S	S	*	*			trans	-82.9	108.1	161.4	-77	172.2	-166.5	0	0	109.2	K80	K80-E82 HydrophobicContact CD-CG 4.21Å; K80-E82 IonicContact NZ-OE1 2.65Å; K80-E82 PolarHBondContact NZ-OE1 3.49Å
83	V	33.8	Very low	42.8	Very low	141 Å²	141	119.5 Å²	119.5	86%	0.855	68%	0.677	S	S	*	*			trans	-142.7	143.4	161.1	-179.3	0	0	0	0	108.1
84	G	32.9	Very low	45.6	Very low	63 Å²	63	119.4 Å²	119.4	65%	0.649	67%	0.67	S	S	*	*			trans	94	61.2	162.2	0	0	0	0	0	115.7	S86	G84-S86 PolarHBondContact O-N 3.27Å
85	S	45.8	Very low	48.5	Very low	111 Å²	111	115 Å²	115	78%	0.776	64%	0.642	S	S	*	*			trans	-62.2	88.9	144.9	-178.6	0	0	0	0	107.7	R87	S85-R87 PolarHBondContact O-N 2.88Å
86	S	36.6	Very low	51.4	Low	82 Å²	82	112 Å²	112	57%	0.573	62%	0.623	S	S	*	*			trans	-73.3	75.4	174.6	-165.9	0	0	0	0	109.1	G84 F88	G84-S86 PolarHBondContact O-N 3.27Å; S86-F88 PolarHBondContact O-N 2.92Å; S86-F88 WeakPolarHBondContact OG-CD2 3.39Å; S86-F88 WeakPolarHBondContact OG-CE2 3.47Å
87	R	48	Very low	54.4	Low	151 Å²	151	110.4 Å²	110.4	57%	0.57	60%	0.604	S	S	*	*			trans	-59.6	89	150.8	-77.9	-168.1	-80.4	154	-4.7	106.2	S85 F89 E303	S85-R87 PolarHBondContact O-N 2.88Å; R87-F89 HydrophobicContact CB-CE2 4.22Å; R87-F89 VanDerWaalsContact O-CD2 3.22Å; R87-F89 WeakPolarHBondContact O-CD2 3.4Å; R87-F89 PolarHBondContact O-N 3.48Å; R87-E303 IonicContact CZ-OE2 2.72Å; R87-E303 IonicContact NH1-OE1 3.7Å; R87-E303 IonicContact NH1-OE2 2.78Å; R87-E303 PolarHBondContact NH1-OE2 3.09Å
88	F	41.1	Very low	57.6	Low	181 Å²	181	110.3 Å²	110.3	79%	0.794	59%	0.588	S	S	*	*			trans	-58	94	165.6	-86.6	-88.7	0	0	0	107.2	S86 S90	S86-F88 PolarHBondContact O-N 2.92Å; S86-F88 WeakPolarHBondContact OG-CD2 3.39Å; S86-F88 WeakPolarHBondContact OG-CE2 3.47Å; F88-S90 PolarHBondContact O-N 3.02Å
89	F	48	Very low	60.4	Low	108 Å²	108	103.6 Å²	103.6	47%	0.474	55%	0.553	S	S	.	*			trans	-66.7	85.2	168.7	-73.2	-82	0	0	0	107.2	R87 S91 V300	R87-F89 HydrophobicContact CB-CE2 4.22Å; R87-F89 VanDerWaalsContact O-CD2 3.22Å; R87-F89 WeakPolarHBondContact O-CD2 3.4Å; R87-F89 PolarHBondContact O-N 3.48Å; F89-S91 PolarHBondContact O-N 3.41Å; F89-V300 HydrophobicContact CD1-CG1 4.47Å
90	S	60.7	Low	63.3	Low	61 Å²	61	98.1 Å²	98.1	43%	0.427	54%	0.536	S	S	.	.			trans	-45.3	111.3	170.3	-66.8	0	0	0	0	108	F88	F88-S90 PolarHBondContact O-N 3.02Å
91	S	76.7	Confident	66.1	Low	61 Å²	61	93.7 Å²	93.7	43%	0.427	52%	0.518	S	S	.	.			trans	-50.5	142.3	-175.8	172.9	0	0	0	0	109.4	F89 S93 M94 L95	F89-S91 PolarHBondContact O-N 3.41Å; S91-S93 CarbonylContact O-C 3.59Å; S91-S93 PolarHBondContact O-N 3.31Å; S91-M94 WeakPolarHBondContact O-CA 3.34Å; S91-M94 WeakPolarHBondContact O-CB 3.46Å; S91-M94 PolarHBondContact O-N 3.02Å; S91-L95 PolarHBondContact O-N 2.89Å
92	P	79.4	Confident	69	Low	66 Å²	66	88.6 Å²	88.6	43%	0.429	48%	0.484	S	S	.	.	H	α-helix	trans	-50.4	-31.7	176.2	-29.6	36.4	0	0	0	113	L95 Q96	P92-L95 PolarHBondContact O-N 3.49Å; P92-Q96 WeakPolarHBondContact O-CB 3.49Å; P92-Q96 VanDerWaalsContact O-CG 3.24Å; P92-Q96 WeakPolarHBondContact O-CG 3.39Å; P92-Q96 PolarHBondContact O-N 3.37Å
93	S	84.2	Confident	71.6	Confident	69 Å²	69	84 Å²	84	48%	0.483	47%	0.465	S	S	.	.	H	α-helix	trans	-62.8	-46	170.6	171.3	0	0	0	0	113.2	S91 L95 Q96 N97	S91-S93 CarbonylContact O-C 3.59Å; S91-S93 PolarHBondContact O-N 3.31Å; S93-L95 VanDerWaalsContact C-N 3.33Å; S93-L95 PolarHBondContact O-N 3.43Å; S93-Q96 PolarHBondContact O-N 2.9Å; S93-N97 WeakPolarHBondContact O-CB 3.4Å; S93-N97 PolarHBondContact O-N 3.21Å; S93-N97 PolarHBondContact O-OD1 3.24Å
94	M	85.9	Confident	74.6	Confident	121 Å²	121	82.5 Å²	82.5	60%	0.596	45%	0.448	S	S	*	.	H	α-helix	trans	-63.3	-38.8	176.3	-66.2	-65.4	-72.5	0	0	112	S91 R98	S91-M94 WeakPolarHBondContact O-CA 3.34Å; S91-M94 WeakPolarHBondContact O-CB 3.46Å; S91-M94 PolarHBondContact O-N 3.02Å; M94-R98 WeakPolarHBondContact O-CB 3.42Å; M94-R98 PolarHBondContact O-N 2.98Å
95	L	87.4	Confident	77.5	Confident	15 Å²	15	82.6 Å²	82.6	8%	0.079	43%	0.432	C	S	.	.	H	α-helix	trans	-66.6	-42.2	175.6	-66.2	175	0	0	0	111.7	S91 P92 S93 R98 I99 L293 T297 V300	S91-L95 PolarHBondContact O-N 2.89Å; P92-L95 PolarHBondContact O-N 3.49Å; S93-L95 VanDerWaalsContact C-N 3.33Å; S93-L95 PolarHBondContact O-N 3.43Å; L95-R98 PolarHBondContact O-N 2.87Å; L95-I99 WeakPolarHBondContact O-CD1 3.36Å; L95-I99 VanDerWaalsContact O-CG1 3.29Å; L95-I99 WeakPolarHBondContact O-CG1 3.42Å; L95-I99 PolarHBondContact O-N 3.3Å; L95-L293 HydrophobicContact CD2-CD2 3.85Å; L95-T297 WeakPolarHBondContact CB-OG1 3.5Å; L95-V300 HydrophobicContact CD1-CG2 4.43Å
96	Q	88.2	Confident	79.8	Confident	99 Å²	99	79.5 Å²	79.5	46%	0.463	40%	0.404	S	S	.	.	H	α-helix	trans	-65.3	-42.6	175.1	-69.9	-69	3.2	0	0	112.1	P92 S93 R98 I99 T100	P92-Q96 WeakPolarHBondContact O-CB 3.49Å; P92-Q96 VanDerWaalsContact O-CG 3.24Å; P92-Q96 WeakPolarHBondContact O-CG 3.39Å; P92-Q96 PolarHBondContact O-N 3.37Å; S93-Q96 PolarHBondContact O-N 2.9Å; Q96-R98 VanDerWaalsContact C-N 3.28Å; Q96-R98 PolarHBondContact O-N 2.88Å; Q96-I99 CarbonylContact O-C 3.59Å; Q96-I99 WeakPolarHBondContact O-CA 3.41Å; Q96-I99 WeakPolarHBondContact O-CB 3.45Å; Q96-I99 PolarHBondContact O-N 3.06Å; Q96-T100 PolarHBondContact O-N 2.94Å; Q96-T100 PolarHBondContact O-OG1 3.09Å
97	N	91.1	Very high	82.6	Confident	91 Å²	91	78.8 Å²	78.8	49%	0.487	39%	0.392	S	S	.	.	H	α-helix	trans	-60.2	-38.6	174.5	-67.7	-5.8	0	0	0	111.5	S93 I99 T100 E101	S93-N97 WeakPolarHBondContact O-CB 3.4Å; S93-N97 PolarHBondContact O-N 3.21Å; S93-N97 PolarHBondContact O-OD1 3.24Å; N97-I99 VanDerWaalsContact C-N 3.34Å; N97-T100 WeakPolarHBondContact CA-OG1 2.96Å; N97-T100 PolarHBondContact O-N 2.84Å; N97-T100 PolarHBondContact O-OG1 3.42Å; N97-E101 WeakPolarHBondContact O-CB 3.29Å; N97-E101 PolarHBondContact O-N 3.17Å
98	R	93.4	Very high	84.8	Confident	113 Å²	113	75.8 Å²	75.8	43%	0.426	38%	0.384	S	S	.	.	H	α-helix	trans	-70.2	-29.9	174.3	-170.1	57.9	176.2	-171	8.9	112.8	M94 L95 Q96 E101 I102 L293	M94-R98 WeakPolarHBondContact O-CB 3.42Å; M94-R98 PolarHBondContact O-N 2.98Å; L95-R98 PolarHBondContact O-N 2.87Å; Q96-R98 VanDerWaalsContact C-N 3.28Å; Q96-R98 PolarHBondContact O-N 2.88Å; R98-E101 WeakPolarHBondContact CD-OE2 3.35Å; R98-E101 IonicContact CZ-OE1 2.71Å; R98-E101 IonicContact CZ-OE2 2.99Å; R98-E101 IonicContact NE-OE2 2.68Å; R98-E101 IonicContact NH1-OE1 2.63Å; R98-E101 PolarHBondContact NH1-OE1 3Å; R98-E101 IonicContact NH1-OE2 2.68Å; R98-E101 PolarHBondContact NH1-OE2 2.7Å; R98-E101 IonicContact NH2-OE1 3.13Å; R98-I102 HydrophobicContact CG-CD1 4.3Å; R98-I102 WeakPolarHBondContact O-CG1 3.24Å; R98-I102 PolarHBondContact O-N 3.4Å; R98-I102 VanDerWaalsContact O-N 3.11Å; R98-L293 HydrophobicContact CG-CD1 3.76Å; R98-L293 HydrophobicContact CG-CD2 4.27Å
99	I	92.6	Very high	87.3	Confident	12 Å²	12	69.1 Å²	69.1	6%	0.062	36%	0.357	C	S	.	.	H	α-helix	trans	-71.5	-37.4	174	-71.4	162.2	0	0	0	111.3	L95 Q96 N97 N103 L293 I294	L95-I99 WeakPolarHBondContact O-CD1 3.36Å; L95-I99 VanDerWaalsContact O-CG1 3.29Å; L95-I99 WeakPolarHBondContact O-CG1 3.42Å; L95-I99 PolarHBondContact O-N 3.3Å; Q96-I99 CarbonylContact O-C 3.59Å; Q96-I99 WeakPolarHBondContact O-CA 3.41Å; Q96-I99 WeakPolarHBondContact O-CB 3.45Å; Q96-I99 PolarHBondContact O-N 3.06Å; N97-I99 VanDerWaalsContact C-N 3.34Å; I99-N103 PolarHBondContact O-N 2.72Å; I99-N103 PolarHBondContact O-ND2 3.19Å; I99-L293 HydrophobicContact CD1-CB 4.24Å; I99-L293 HydrophobicContact CG1-CB 3.86Å; I99-I294 HydrophobicContact CD1-CG1 3.86Å; I99-I294 HydrophobicContact CG1-CG1 4.46Å
100	T	93.2	Very high	89.6	Confident	85 Å²	85	68 Å²	68	52%	0.521	35%	0.352	S	S	.	.	H	α-helix	trans	-70.6	-42.4	174.3	53.2	0	0	0	0	111.7	Q96 N97 I102 N103 Q104	Q96-T100 PolarHBondContact O-N 2.94Å; Q96-T100 PolarHBondContact O-OG1 3.09Å; N97-T100 WeakPolarHBondContact CA-OG1 2.96Å; N97-T100 PolarHBondContact O-N 2.84Å; N97-T100 PolarHBondContact O-OG1 3.42Å; T100-I102 VanDerWaalsContact C-N 3.34Å; T100-I102 PolarHBondContact O-N 3.18Å; T100-N103 WeakPolarHBondContact O-CA 3.45Å; T100-N103 WeakPolarHBondContact O-CB 3.45Å; T100-N103 PolarHBondContact O-N 3.42Å; T100-Q104 PolarHBondContact O-N 3.03Å
101	E	95.2	Very high	91.2	Very high	72 Å²	72	70.2 Å²	70.2	34%	0.336	36%	0.358	S	S	.	.	H	α-helix	trans	-55	-46	172.8	-168.9	-159.8	147.3	0	0	112.2	N97 R98 N103 Q104 Q105	N97-E101 WeakPolarHBondContact O-CB 3.29Å; N97-E101 PolarHBondContact O-N 3.17Å; R98-E101 WeakPolarHBondContact CD-OE2 3.35Å; R98-E101 IonicContact CZ-OE1 2.71Å; R98-E101 IonicContact CZ-OE2 2.99Å; R98-E101 IonicContact NE-OE2 2.68Å; R98-E101 IonicContact NH1-OE1 2.63Å; R98-E101 PolarHBondContact NH1-OE1 3Å; R98-E101 IonicContact NH1-OE2 2.68Å; R98-E101 PolarHBondContact NH1-OE2 2.7Å; R98-E101 IonicContact NH2-OE1 3.13Å; E101-N103 VanDerWaalsContact C-N 3.28Å; E101-N103 PolarHBondContact O-N 2.84Å; E101-Q104 WeakPolarHBondContact O-CB 3.45Å; E101-Q104 PolarHBondContact O-N 3.47Å; E101-Q105 WeakPolarHBondContact O-CG 3.41Å; E101-Q105 PolarHBondContact O-N 3.21Å; E101-Q105 PolarHBondContact OE1-NE2 3.42Å
102	I	95.5	Very high	92.1	Very high	7 Å²	7	70.2 Å²	70.2	4%	0.036	35%	0.351	C	S	.	.	H	α-helix	trans	-68.1	-26.6	177.1	-71.9	170.5	0	0	0	112.3	R98 T100 K106 L286 K289 K290 L293	R98-I102 HydrophobicContact CG-CD1 4.3Å; R98-I102 WeakPolarHBondContact O-CG1 3.24Å; R98-I102 PolarHBondContact O-N 3.4Å; R98-I102 VanDerWaalsContact O-N 3.11Å; T100-I102 VanDerWaalsContact C-N 3.34Å; T100-I102 PolarHBondContact O-N 3.18Å; I102-K106 WeakPolarHBondContact O-CB 3.23Å; I102-K106 PolarHBondContact O-N 3.15Å; I102-K106 VanDerWaalsContact O-N 3.08Å; I102-L286 HydrophobicContact CG2-CD2 4.5Å; I102-K289 HydrophobicContact CD1-CB 4.35Å; I102-K290 HydrophobicContact CG2-CB 4.08Å; I102-L293 HydrophobicContact CD1-CD1 3.32Å
103	N	93.9	Very high	92.8	Very high	56 Å²	56	67.6 Å²	67.6	30%	0.299	33%	0.333	S	S	.	.	H	α-helix	trans	-69.8	-41.1	171.8	-64	-40.9	0	0	0	111.4	I99 T100 E101 K106 E107 K290	I99-N103 PolarHBondContact O-N 2.72Å; I99-N103 PolarHBondContact O-ND2 3.19Å; T100-N103 WeakPolarHBondContact O-CA 3.45Å; T100-N103 WeakPolarHBondContact O-CB 3.45Å; T100-N103 PolarHBondContact O-N 3.42Å; E101-N103 VanDerWaalsContact C-N 3.28Å; E101-N103 PolarHBondContact O-N 2.84Å; N103-K106 PolarHBondContact O-N 2.85Å; N103-E107 PolarHBondContact O-N 2.87Å; N103-E107 VanDerWaalsContact O-N 3.12Å; N103-K290 VanDerWaalsContact OD1-CD 3.32Å; N103-K290 WeakPolarHBondContact OD1-CD 3.41Å; N103-K290 VanDerWaalsContact OD1-CE 3.3Å; N103-K290 WeakPolarHBondContact OD1-CE 3.33Å; N103-K290 PolarHBondContact OD1-NZ 3.12Å
104	Q	95.9	Very high	93.4	Very high	108 Å²	108	68.3 Å²	68.3	51%	0.505	33%	0.329	S	S	.	.	H	α-helix	trans	-62.7	-55	176.7	-176	61	22.9	0	0	110.4	T100 E101 K106 E107 E108	T100-Q104 PolarHBondContact O-N 3.03Å; E101-Q104 WeakPolarHBondContact O-CB 3.45Å; E101-Q104 PolarHBondContact O-N 3.47Å; Q104-K106 PolarHBondContact O-N 3.18Å; Q104-E107 PolarHBondContact O-N 2.84Å; Q104-E108 HydrophobicContact CG-CG 4.42Å; Q104-E108 WeakPolarHBondContact CG-OE1 3.41Å; Q104-E108 PolarHBondContact NE2-OE1 3.17Å; Q104-E108 WeakPolarHBondContact O-CG 3.36Å; Q104-E108 PolarHBondContact O-N 2.75Å
105	Q	94.7	Very high	93.9	Very high	66 Å²	66	67.5 Å²	67.5	31%	0.308	33%	0.327	S	S	.	.	H	α-helix	trans	-53.5	-39.2	175.5	-73.3	166.6	-5.7	0	0	112.8	E101 E107 L109	E101-Q105 WeakPolarHBondContact O-CG 3.41Å; E101-Q105 PolarHBondContact O-N 3.21Å; E101-Q105 PolarHBondContact OE1-NE2 3.42Å; Q105-E107 VanDerWaalsContact C-N 3.33Å; Q105-L109 WeakPolarHBondContact O-CB 3.43Å; Q105-L109 PolarHBondContact O-N 2.77Å
106	K	94.4	Very high	94.1	Very high	46 Å²	46	70.2 Å²	70.2	20%	0.2	34%	0.339	C	S	.	.	H	α-helix	trans	-68.8	-30.5	177.5	-170.9	-156.3	117.9	-60.6	0	112.7	I102 N103 Q104 K110 L283 L286	I102-K106 WeakPolarHBondContact O-CB 3.23Å; I102-K106 PolarHBondContact O-N 3.15Å; I102-K106 VanDerWaalsContact O-N 3.08Å; N103-K106 PolarHBondContact O-N 2.85Å; Q104-K106 PolarHBondContact O-N 3.18Å; K106-K110 WeakPolarHBondContact O-CB 3.48Å; K106-K110 PolarHBondContact O-N 3.23Å; K106-L283 HydrophobicContact CG-CD2 3.75Å; K106-L283 WeakPolarHBondContact O-CD2 3.4Å; K106-L286 HydrophobicContact CB-CB 4.38Å; K106-L286 HydrophobicContact CB-CD1 3.98Å; K106-L286 HydrophobicContact CG-CB 4.33Å; K106-L286 HydrophobicContact CG-CD1 4.37Å
107	E	95.1	Very high	94.5	Very high	67 Å²	67	65.7 Å²	65.7	31%	0.313	32%	0.318	S	S	.	.	H	α-helix	trans	-86.6	-39.5	-179.5	-163.6	54.9	-147.1	0	0	111.5	N103 Q104 Q105 K110 I111	N103-E107 PolarHBondContact O-N 2.87Å; N103-E107 VanDerWaalsContact O-N 3.12Å; Q104-E107 PolarHBondContact O-N 2.84Å; Q105-E107 VanDerWaalsContact C-N 3.33Å; E107-K110 WeakPolarHBondContact O-CB 3.49Å; E107-K110 PolarHBondContact O-N 2.86Å; E107-K110 IonicContact OE1-NZ 3.29Å; E107-K110 PolarHBondContact OE1-NZ 3.02Å; E107-K110 IonicContact OE2-NZ 3.29Å; E107-K110 PolarHBondContact OE2-NZ 3.39Å; E107-I111 HydrophobicContact CG-CD1 4.41Å; E107-I111 VanDerWaalsContact O-CG1 3.3Å; E107-I111 WeakPolarHBondContact O-CG1 3.18Å; E107-I111 PolarHBondContact O-N 2.75Å
108	E	94.3	Very high	94.8	Very high	87 Å²	87	63.5 Å²	63.5	41%	0.407	31%	0.313	S	S	.	.	H	α-helix	trans	-54.8	-57.7	168.3	-70	166.8	165.1	0	0	110.9	Q104 K110 I111 E112	Q104-E108 HydrophobicContact CG-CG 4.42Å; Q104-E108 WeakPolarHBondContact CG-OE1 3.41Å; Q104-E108 PolarHBondContact NE2-OE1 3.17Å; Q104-E108 WeakPolarHBondContact O-CG 3.36Å; Q104-E108 PolarHBondContact O-N 2.75Å; E108-K110 PolarHBondContact O-N 3.08Å; E108-I111 PolarHBondContact O-N 2.7Å; E108-E112 WeakPolarHBondContact O-CG 3.38Å; E108-E112 PolarHBondContact O-N 2.68Å
109	L	94.1	Very high	95	Very high	42 Å²	42	63 Å²	63	22%	0.22	32%	0.318	C	S	.	.	H	α-helix	trans	-62	-29.9	179.4	-172	63.5	0	0	0	112.8	Q105 L113 E282 L286	Q105-L109 WeakPolarHBondContact O-CB 3.43Å; Q105-L109 PolarHBondContact O-N 2.77Å; L109-L113 HydrophobicContact CD1-CD1 3.84Å; L109-L113 HydrophobicContact CD1-CG 3.95Å; L109-L113 HydrophobicContact CG-CD1 3.85Å; L109-L113 HydrophobicContact CG-CG 4.29Å; L109-L113 WeakPolarHBondContact O-CB 3.37Å; L109-L113 WeakPolarHBondContact O-CG 3.43Å; L109-L113 PolarHBondContact O-N 3.49Å; L109-E282 HydrophobicContact CD2-CB 3.78Å; L109-E282 HydrophobicContact CD2-CG 4.45Å; L109-L286 HydrophobicContact CD2-CD1 3.96Å
110	K	95.3	Very high	95.3	Very high	84 Å²	84	63.9 Å²	63.9	37%	0.365	32%	0.323	S	S	.	.	H	α-helix	trans	-67.9	-40.6	172.9	164.9	167.6	160.6	-79.1	0	111.8	K106 E107 E108 Q114 L283	K106-K110 WeakPolarHBondContact O-CB 3.48Å; K106-K110 PolarHBondContact O-N 3.23Å; E107-K110 WeakPolarHBondContact O-CB 3.49Å; E107-K110 PolarHBondContact O-N 2.86Å; E107-K110 IonicContact OE1-NZ 3.29Å; E107-K110 PolarHBondContact OE1-NZ 3.02Å; E107-K110 IonicContact OE2-NZ 3.29Å; E107-K110 PolarHBondContact OE2-NZ 3.39Å; E108-K110 PolarHBondContact O-N 3.08Å; K110-Q114 WeakPolarHBondContact O-CB 3.44Å; K110-Q114 PolarHBondContact O-N 2.74Å; K110-L283 HydrophobicContact CB-CD1 4.43Å; K110-L283 HydrophobicContact CB-CD2 4.04Å
111	I	95.4	Very high	95.5	Very high	107 Å²	107	63.8 Å²	63.8	55%	0.549	32%	0.316	S	S	.	.	H	α-helix	trans	-68.6	-46.2	177.6	-69.1	162.3	0	0	0	109.9	E107 E108 Q114 L115	E107-I111 HydrophobicContact CG-CD1 4.41Å; E107-I111 VanDerWaalsContact O-CG1 3.3Å; E107-I111 WeakPolarHBondContact O-CG1 3.18Å; E107-I111 PolarHBondContact O-N 2.75Å; E108-I111 PolarHBondContact O-N 2.7Å; I111-Q114 PolarHBondContact O-N 3.49Å; I111-L115 WeakPolarHBondContact O-CB 3.46Å; I111-L115 PolarHBondContact O-N 3.05Å
112	E	94.6	Very high	95.6	Very high	62 Å²	62	62.1 Å²	62.1	29%	0.29	32%	0.319	S	S	.	.	H	α-helix	trans	-61.5	-55.5	-179.7	-67.9	177.6	170.6	0	0	112.7	R47 E108 Q114 L115 E116	R47-E112 IonicContact CZ-OE1 3.42Å; R47-E112 IonicContact CZ-OE2 3.44Å; R47-E112 IonicContact NH1-OE1 2.8Å; R47-E112 PolarHBondContact NH1-OE1 2.96Å; R47-E112 IonicContact NH1-OE2 2.64Å; R47-E112 PolarHBondContact NH1-OE2 2.91Å; R47-E112 IonicContact NH2-OE1 2.54Å; R47-E112 IonicContact NH2-OE2 3.47Å; R47-E112 PolarHBondContact NH2-OE2 2.7Å; E108-E112 WeakPolarHBondContact O-CG 3.38Å; E108-E112 PolarHBondContact O-N 2.68Å; E112-Q114 PolarHBondContact O-N 2.87Å; E112-L115 WeakPolarHBondContact O-CB 3.44Å; E112-L115 PolarHBondContact O-N 3.08Å; E112-E116 PolarHBondContact O-N 3.44Å
113	L	94.5	Very high	95.7	Very high	10 Å²	10	66 Å²	66	5%	0.052	34%	0.336	C	S	.	.	H	α-helix	trans	-67.5	-25.6	-179.4	-62.4	177.1	0	0	0	111.9	L109 E116 I117 M275 K279	L109-L113 HydrophobicContact CD1-CD1 3.84Å; L109-L113 HydrophobicContact CD1-CG 3.95Å; L109-L113 HydrophobicContact CG-CD1 3.85Å; L109-L113 HydrophobicContact CG-CG 4.29Å; L109-L113 WeakPolarHBondContact O-CB 3.37Å; L109-L113 WeakPolarHBondContact O-CG 3.43Å; L109-L113 PolarHBondContact O-N 3.49Å; L113-E116 WeakPolarHBondContact CD2-OE2 3.13Å; L113-I117 WeakPolarHBondContact O-CB 3.39Å; L113-I117 VanDerWaalsContact O-CD1 3.3Å; L113-I117 WeakPolarHBondContact O-CD1 3.4Å; L113-I117 WeakPolarHBondContact O-CG1 3.45Å; L113-I117 PolarHBondContact O-N 3.19Å; L113-M275 HydrophobicContact CD2-CE 4.02Å; L113-K279 HydrophobicContact CB-CB 4.03Å; L113-K279 HydrophobicContact CB-CD 4.36Å; L113-K279 HydrophobicContact CB-CG 4.14Å; L113-K279 HydrophobicContact CD1-CB 3.96Å; L113-K279 HydrophobicContact CD1-CG 4.43Å
114	Q	96.2	Very high	95.9	Very high	84 Å²	84	64 Å²	64	39%	0.393	33%	0.326	S	S	.	.	H	α-helix	trans	-71.5	-35.5	171.1	-174.9	63.5	39.4	0	0	112.2	K110 I111 E112 A118	K110-Q114 WeakPolarHBondContact O-CB 3.44Å; K110-Q114 PolarHBondContact O-N 2.74Å; I111-Q114 PolarHBondContact O-N 3.49Å; E112-Q114 PolarHBondContact O-N 2.87Å; Q114-A118 WeakPolarHBondContact O-CB 3.26Å; Q114-A118 PolarHBondContact O-N 3.25Å
115	L	96.1	Very high	96	Very high	105 Å²	105	63.6 Å²	63.6	55%	0.55	32%	0.324	S	S	.	.	H	α-helix	trans	-67.2	-45.5	173.9	176.8	62.4	0	0	0	111	I111 E112 I117 A118 L119	I111-L115 WeakPolarHBondContact O-CB 3.46Å; I111-L115 PolarHBondContact O-N 3.05Å; E112-L115 WeakPolarHBondContact O-CB 3.44Å; E112-L115 PolarHBondContact O-N 3.08Å; L115-I117 PolarHBondContact O-N 2.86Å; L115-A118 PolarHBondContact O-N 3.12Å; L115-L119 HydrophobicContact CD1-CD1 4.34Å; L115-L119 HydrophobicContact CD1-CG 4.32Å; L115-L119 HydrophobicContact CG-CD1 4.16Å; L115-L119 VanDerWaalsContact O-CG 3.32Å; L115-L119 WeakPolarHBondContact O-CG 3.33Å; L115-L119 PolarHBondContact O-N 3.07Å
116	E	93.3	Very high	96.1	Very high	71 Å²	71	63.8 Å²	63.8	33%	0.332	33%	0.329	S	S	.	.	H	α-helix	trans	-61.6	-42.5	176.9	-69	173.8	-175.1	0	0	111.7	R47 E112 L113 L119 L120 M275	R47-E116 IonicContact NH2-OE1 3.11Å; E112-E116 PolarHBondContact O-N 3.44Å; L113-E116 WeakPolarHBondContact CD2-OE2 3.13Å; E116-L119 PolarHBondContact O-N 3.49Å; E116-L120 WeakPolarHBondContact O-CG 3.5Å; E116-L120 PolarHBondContact O-N 3.24Å; E116-M275 HydrophobicContact CB-CE 4.4Å; E116-M275 WeakPolarHBondContact OE2-CE 3.26Å
117	I	96.1	Very high	96.3	Very high	4 Å²	4	63.1 Å²	63.1	2%	0.021	33%	0.327	C	S	.	.	H	α-helix	trans	-60.8	-44.6	171.7	-75.3	166.5	0	0	0	111.7	L113 L115 L119 L120 Q121 L272 M275 E276 K279	L113-I117 WeakPolarHBondContact O-CB 3.39Å; L113-I117 VanDerWaalsContact O-CD1 3.3Å; L113-I117 WeakPolarHBondContact O-CD1 3.4Å; L113-I117 WeakPolarHBondContact O-CG1 3.45Å; L113-I117 PolarHBondContact O-N 3.19Å; L115-I117 PolarHBondContact O-N 2.86Å; I117-L119 PolarHBondContact O-N 3.22Å; I117-L120 PolarHBondContact O-N 3.49Å; I117-Q121 WeakPolarHBondContact O-CB 3.3Å; I117-Q121 VanDerWaalsContact O-CG 3.27Å; I117-Q121 WeakPolarHBondContact O-CG 3.48Å; I117-Q121 PolarHBondContact O-N 2.92Å; I117-L272 HydrophobicContact CB-CD1 4.45Å; I117-L272 HydrophobicContact CG2-CD1 3.95Å; I117-M275 HydrophobicContact CG1-CB 3.99Å; I117-E276 HydrophobicContact CD1-CG 3.9Å; I117-E276 HydrophobicContact CG1-CG 4.28Å; I117-K279 HydrophobicContact CD1-CB 4.26Å; I117-K279 HydrophobicContact CD1-CD 3.47Å; I117-K279 VanDerWaalsContact CD1-CD 3.47Å
118	A	96.4	Very high	96.4	Very high	46 Å²	46	63.5 Å²	63.5	38%	0.38	33%	0.328	S	S	.	.	H	α-helix	trans	-66.7	-35.8	179.8	0	0	0	0	0	112.7	Q114 L115 Q121 G122	Q114-A118 WeakPolarHBondContact O-CB 3.26Å; Q114-A118 PolarHBondContact O-N 3.25Å; L115-A118 PolarHBondContact O-N 3.12Å; A118-Q121 PolarHBondContact O-N 3.42Å; A118-G122 PolarHBondContact O-N 3.19Å
119	L	97.9	Very high	96.6	Very high	102 Å²	102	62.4 Å²	62.4	53%	0.534	32%	0.323	S	S	.	.	H	α-helix	trans	-65.6	-47	173.6	-70.9	169.4	0	0	0	111.2	L115 E116 I117 Q121 G122 E123	L115-L119 HydrophobicContact CD1-CD1 4.34Å; L115-L119 HydrophobicContact CD1-CG 4.32Å; L115-L119 HydrophobicContact CG-CD1 4.16Å; L115-L119 VanDerWaalsContact O-CG 3.32Å; L115-L119 WeakPolarHBondContact O-CG 3.33Å; L115-L119 PolarHBondContact O-N 3.07Å; E116-L119 PolarHBondContact O-N 3.49Å; I117-L119 PolarHBondContact O-N 3.22Å; L119-Q121 VanDerWaalsContact C-N 3.32Å; L119-Q121 PolarHBondContact O-N 3.02Å; L119-G122 PolarHBondContact O-N 3.49Å; L119-G122 VanDerWaalsContact O-N 3.12Å; L119-E123 PolarHBondContact O-N 2.96Å
120	L	98.1	Very high	96.7	Very high	31 Å²	31	64.5 Å²	64.5	16%	0.162	33%	0.331	C	S	.	.	H	α-helix	trans	-62.8	-35.7	175.4	-73.1	173.3	0	0	0	112.7	E116 I117 L124 L268 L272 M275	E116-L120 WeakPolarHBondContact O-CG 3.5Å; E116-L120 PolarHBondContact O-N 3.24Å; I117-L120 PolarHBondContact O-N 3.49Å; L120-L124 WeakPolarHBondContact O-CB 3.42Å; L120-L124 PolarHBondContact O-N 3.49Å; L120-L268 HydrophobicContact CD2-CD2 4.08Å; L120-L272 HydrophobicContact CB-CD1 4.11Å; L120-M275 HydrophobicContact CD1-CB 4.38Å; L120-M275 HydrophobicContact CD1-CG 3.61Å
121	Q	98.1	Very high	96.8	Very high	82 Å²	82	61.7 Å²	61.7	38%	0.383	32%	0.32	S	S	.	.	H	α-helix	trans	-64.8	-39.8	172.5	-75.2	170.6	-7.9	0	0	111.7	I117 A118 L119 Q125 L272	I117-Q121 WeakPolarHBondContact O-CB 3.3Å; I117-Q121 VanDerWaalsContact O-CG 3.27Å; I117-Q121 WeakPolarHBondContact O-CG 3.48Å; I117-Q121 PolarHBondContact O-N 2.92Å; A118-Q121 PolarHBondContact O-N 3.42Å; L119-Q121 VanDerWaalsContact C-N 3.32Å; L119-Q121 PolarHBondContact O-N 3.02Å; Q121-Q125 WeakPolarHBondContact O-CB 3.5Å; Q121-Q125 PolarHBondContact O-N 3.25Å; Q121-L272 HydrophobicContact CG-CD1 3.75Å; Q121-L272 HydrophobicContact CG-CD2 3.82Å; Q121-L272 HydrophobicContact CG-CG 4.47Å
122	G	97.9	Very high	97	Very high	38 Å²	38	62 Å²	62	39%	0.392	32%	0.319	S	S	.	.	H	α-helix	trans	-62.8	-51.4	173.5	0	0	0	0	0	112.9	A118 L119 L124 Q125 T126	A118-G122 PolarHBondContact O-N 3.19Å; L119-G122 PolarHBondContact O-N 3.49Å; L119-G122 VanDerWaalsContact O-N 3.12Å; G122-L124 PolarHBondContact O-N 2.6Å; G122-Q125 PolarHBondContact O-N 3.46Å; G122-T126 WeakPolarHBondContact O-CG2 3.47Å; G122-T126 PolarHBondContact O-N 3.05Å; G122-T126 PolarHBondContact O-OG1 3.16Å
123	E	97.5	Very high	97.1	Very high	88 Å²	88	65.4 Å²	65.4	41%	0.411	33%	0.329	S	S	.	.	H	α-helix	trans	-55.9	-52.7	175	-74.8	-173.1	-146.3	0	0	110.9	L119 Q125 T126 E127 R264 L268	L119-E123 PolarHBondContact O-N 2.96Å; E123-Q125 VanDerWaalsContact C-N 3.3Å; E123-Q125 PolarHBondContact O-N 3.13Å; E123-T126 PolarHBondContact O-N 3.24Å; E123-T126 VanDerWaalsContact O-N 3.12Å; E123-T126 PolarHBondContact O-OG1 3.3Å; E123-E127 WeakPolarHBondContact O-CB 3.25Å; E123-E127 VanDerWaalsContact O-CG 3.22Å; E123-E127 WeakPolarHBondContact O-CG 3.38Å; E123-E127 PolarHBondContact O-N 3.08Å; E123-R264 IonicContact OE2-NH2 3.11Å; E123-R264 PolarHBondContact OE2-NH2 2.82Å; E123-L268 HydrophobicContact CB-CD1 4.33Å; E123-L268 HydrophobicContact CB-CD2 4.4Å
124	L	98.1	Very high	97.3	Very high	15 Å²	15	67.7 Å²	67.7	8%	0.079	34%	0.34	C	S	.	.	H	α-helix	trans	-55.9	-40.9	179.3	177.5	63.1	0	0	0	112.9	L120 G122 K128 V265 L268 E269 L272	L120-L124 WeakPolarHBondContact O-CB 3.42Å; L120-L124 PolarHBondContact O-N 3.49Å; G122-L124 PolarHBondContact O-N 2.6Å; L124-K128 HydrophobicContact CD1-CD 4.27Å; L124-K128 HydrophobicContact CD1-CG 4.39Å; L124-K128 HydrophobicContact CG-CD 4.29Å; L124-K128 WeakPolarHBondContact O-CB 3.44Å; L124-K128 VanDerWaalsContact O-CG 3.31Å; L124-K128 WeakPolarHBondContact O-CG 3.41Å; L124-K128 PolarHBondContact O-N 3.27Å; L124-V265 HydrophobicContact CD1-CG1 3.97Å; L124-L268 HydrophobicContact CB-CB 4.32Å; L124-L268 HydrophobicContact CD1-CB 3.89Å; L124-E269 HydrophobicContact CD1-CG 3.7Å; L124-E269 HydrophobicContact CD2-CG 3.96Å; L124-E269 HydrophobicContact CG-CG 4.48Å; L124-L272 HydrophobicContact CD2-CD2 3.9Å
125	Q	98.3	Very high	97.4	Very high	98 Å²	98	65.4 Å²	65.4	46%	0.458	33%	0.333	S	S	.	.	H	α-helix	trans	-65.7	-47.8	176.4	178.1	58.3	27.3	0	0	111.2	Q121 G122 E123 E127 K128 E129	Q121-Q125 WeakPolarHBondContact O-CB 3.5Å; Q121-Q125 PolarHBondContact O-N 3.25Å; G122-Q125 PolarHBondContact O-N 3.46Å; E123-Q125 VanDerWaalsContact C-N 3.3Å; E123-Q125 PolarHBondContact O-N 3.13Å; Q125-E127 VanDerWaalsContact C-N 3.3Å; Q125-E127 PolarHBondContact O-N 3.03Å; Q125-K128 PolarHBondContact O-N 2.73Å; Q125-E129 PolarHBondContact NE2-OE1 2.99Å; Q125-E129 WeakPolarHBondContact O-CG 3.37Å; Q125-E129 PolarHBondContact O-N 3.43Å
126	T	97	Very high	97.5	Very high	70 Å²	70	65.7 Å²	65.7	43%	0.429	33%	0.332	S	S	.	.	H	α-helix	trans	-64	-34.2	179.3	59.6	0	0	0	0	113.2	G122 E123 Q130	G122-T126 WeakPolarHBondContact O-CG2 3.47Å; G122-T126 PolarHBondContact O-N 3.05Å; G122-T126 PolarHBondContact O-OG1 3.16Å; E123-T126 PolarHBondContact O-N 3.24Å; E123-T126 VanDerWaalsContact O-N 3.12Å; E123-T126 PolarHBondContact O-OG1 3.3Å; T126-Q130 VanDerWaalsContact O-CG 3.31Å; T126-Q130 WeakPolarHBondContact O-CG 3.22Å; T126-Q130 PolarHBondContact O-N 3.01Å; T126-Q130 VanDerWaalsContact O-N 3.09Å; T126-Q130 PolarHBondContact O-NE2 3.45Å; T126-Q130 VanDerWaalsContact O-NE2 3.11Å
127	E	97.3	Very high	97.7	Very high	33 Å²	33	66.5 Å²	66.5	15%	0.154	33%	0.334	C	S	.	.	H	α-helix	trans	-73	-39.2	176.4	-65.9	-95.6	-153.2	0	0	111	E123 Q125 Q130 L131 R264 V265 L268	E123-E127 WeakPolarHBondContact O-CB 3.25Å; E123-E127 VanDerWaalsContact O-CG 3.22Å; E123-E127 WeakPolarHBondContact O-CG 3.38Å; E123-E127 PolarHBondContact O-N 3.08Å; Q125-E127 VanDerWaalsContact C-N 3.3Å; Q125-E127 PolarHBondContact O-N 3.03Å; E127-Q130 PolarHBondContact O-N 2.84Å; E127-L131 WeakPolarHBondContact O-CB 3.38Å; E127-L131 PolarHBondContact O-N 3.04Å; E127-R264 VanDerWaalsContact CD-CG 3.43Å; E127-R264 HydrophobicContact CG-CG 4.42Å; E127-R264 VanDerWaalsContact OE1-CG 3.27Å; E127-R264 WeakPolarHBondContact OE1-CG 3.25Å; E127-R264 IonicContact OE1-CZ 3.98Å; E127-R264 IonicContact OE1-NE 3.61Å; E127-R264 PolarHBondContact OE1-NE 2.97Å; E127-R264 IonicContact OE1-NH2 2.66Å; E127-R264 PolarHBondContact OE1-NH2 3.46Å; E127-R264 WeakPolarHBondContact OE2-CG 3.41Å; E127-V265 HydrophobicContact CB-CG2 3.87Å; E127-L268 HydrophobicContact CB-CD1 4.17Å; E127-L268 HydrophobicContact CG-CD1 3.71Å
128	K	98.3	Very high	97.8	Very high	75 Å²	75	66.8 Å²	66.8	33%	0.326	34%	0.336	S	S	.	.	H	α-helix	trans	-62	-41.9	172.7	-82.5	178.7	173	179.8	0	112.8	L124 Q125 L131 Q132 V265 E269	L124-K128 HydrophobicContact CD1-CD 4.27Å; L124-K128 HydrophobicContact CD1-CG 4.39Å; L124-K128 HydrophobicContact CG-CD 4.29Å; L124-K128 WeakPolarHBondContact O-CB 3.44Å; L124-K128 VanDerWaalsContact O-CG 3.31Å; L124-K128 WeakPolarHBondContact O-CG 3.41Å; L124-K128 PolarHBondContact O-N 3.27Å; Q125-K128 PolarHBondContact O-N 2.73Å; K128-L131 PolarHBondContact O-N 3.15Å; K128-Q132 WeakPolarHBondContact O-CB 3.29Å; K128-Q132 PolarHBondContact O-N 3.04Å; K128-V265 HydrophobicContact CD-CG1 4.38Å; K128-V265 HydrophobicContact CG-CG1 3.74Å; K128-V265 HydrophobicContact CG-CG2 3.94Å; K128-E269 VanDerWaalsContact CE-OE1 3.29Å; K128-E269 WeakPolarHBondContact CE-OE1 3.35Å; K128-E269 IonicContact NZ-OE1 3.46Å; K128-E269 PolarHBondContact NZ-OE1 3.29Å
129	E	97.8	Very high	97.9	Very high	63 Å²	63	70 Å²	70	29%	0.294	35%	0.346	S	S	.	.	H	α-helix	trans	-69.6	-34.7	175.8	-65.8	174.4	-158.5	0	0	112.6	Q125 Q132 R133	Q125-E129 PolarHBondContact NE2-OE1 2.99Å; Q125-E129 WeakPolarHBondContact O-CG 3.37Å; Q125-E129 PolarHBondContact O-N 3.43Å; E129-Q132 PolarHBondContact O-N 3.31Å; E129-R133 VanDerWaalsContact O-CG 3.25Å; E129-R133 WeakPolarHBondContact O-CG 3.32Å; E129-R133 PolarHBondContact O-N 2.99Å; E129-R133 PolarHBondContact O-NH1 2.78Å; E129-R133 IonicContact OE2-CZ 3.56Å; E129-R133 IonicContact OE2-NH1 3.56Å; E129-R133 IonicContact OE2-NH2 2.75Å; E129-R133 PolarHBondContact OE2-NH2 3.31Å
130	Q	96.7	Very high	97.9	Very high	86 Å²	86	68 Å²	68	40%	0.402	34%	0.344	S	S	.	.	H	α-helix	trans	-63.9	-48.7	172.4	-78.1	172.3	76.8	0	0	110.8	T126 E127 Q132 R133 H134	T126-Q130 VanDerWaalsContact O-CG 3.31Å; T126-Q130 WeakPolarHBondContact O-CG 3.22Å; T126-Q130 PolarHBondContact O-N 3.01Å; T126-Q130 VanDerWaalsContact O-N 3.09Å; T126-Q130 PolarHBondContact O-NE2 3.45Å; T126-Q130 VanDerWaalsContact O-NE2 3.11Å; E127-Q130 PolarHBondContact O-N 2.84Å; Q130-Q132 VanDerWaalsContact C-N 3.3Å; Q130-Q132 PolarHBondContact O-N 3.04Å; Q130-R133 PolarHBondContact O-N 2.94Å; Q130-R133 VanDerWaalsContact O-N 3.15Å; Q130-H134 PolarHBondContact O-CD2 2.88Å; Q130-H134 PolarHBondContact O-N 2.95Å
131	L	98.2	Very high	97.8	Very high	26 Å²	26	67.6 Å²	67.6	14%	0.136	34%	0.342	C	S	.	.	H	α-helix	trans	-53.8	-45.9	172.9	175.4	60.6	0	0	0	111.5	E127 K128 R133 H134 S135 V258 A261 Q262 V265	E127-L131 WeakPolarHBondContact O-CB 3.38Å; E127-L131 PolarHBondContact O-N 3.04Å; K128-L131 PolarHBondContact O-N 3.15Å; L131-R133 PolarHBondContact O-N 3.24Å; L131-H134 PolarHBondContact O-N 3.46Å; L131-S135 WeakPolarHBondContact O-CB 3.41Å; L131-S135 PolarHBondContact O-N 3.4Å; L131-S135 PolarHBondContact O-OG 3.18Å; L131-S135 VanDerWaalsContact O-OG 3.1Å; L131-V258 HydrophobicContact CD1-CG1 3.96Å; L131-V258 WeakPolarHBondContact CD1-O 3.36Å; L131-A261 HydrophobicContact CB-CB 4.19Å; L131-A261 HydrophobicContact CD1-CB 4Å; L131-Q262 HydrophobicContact CD1-CB 4.09Å; L131-Q262 HydrophobicContact CD2-CB 4.18Å; L131-V265 HydrophobicContact CD2-CB 4.47Å; L131-V265 HydrophobicContact CD2-CG2 4.14Å
132	Q	98.3	Very high	97.7	Very high	113 Å²	113	66.1 Å²	66.1	53%	0.528	34%	0.335	S	S	.	.	H	α-helix	trans	-59.6	-46.3	176.6	-177.1	177.4	-9	0	0	112.3	K128 E129 Q130 S135 Q136	K128-Q132 WeakPolarHBondContact O-CB 3.29Å; K128-Q132 PolarHBondContact O-N 3.04Å; E129-Q132 PolarHBondContact O-N 3.31Å; Q130-Q132 VanDerWaalsContact C-N 3.3Å; Q130-Q132 PolarHBondContact O-N 3.04Å; Q132-S135 PolarHBondContact O-N 2.8Å; Q132-Q136 WeakPolarHBondContact O-CB 3.29Å; Q132-Q136 VanDerWaalsContact O-CG 3.28Å; Q132-Q136 WeakPolarHBondContact O-CG 3.31Å; Q132-Q136 PolarHBondContact O-N 3.05Å
133	R	97.6	Very high	97.7	Very high	133 Å²	133	68.4 Å²	68.4	50%	0.502	34%	0.336	S	S	.	.	H	α-helix	trans	-62.4	-42.5	177.9	-68.6	166.1	-168.3	117.1	5.1	111.9	E129 Q130 L131 Q136 K137	E129-R133 VanDerWaalsContact O-CG 3.25Å; E129-R133 WeakPolarHBondContact O-CG 3.32Å; E129-R133 PolarHBondContact O-N 2.99Å; E129-R133 PolarHBondContact O-NH1 2.78Å; E129-R133 IonicContact OE2-CZ 3.56Å; E129-R133 IonicContact OE2-NH1 3.56Å; E129-R133 IonicContact OE2-NH2 2.75Å; E129-R133 PolarHBondContact OE2-NH2 3.31Å; Q130-R133 PolarHBondContact O-N 2.94Å; Q130-R133 VanDerWaalsContact O-N 3.15Å; L131-R133 PolarHBondContact O-N 3.24Å; R133-Q136 PolarHBondContact O-N 3.27Å; R133-K137 PolarHBondContact O-N 3.43Å
134	H	97.8	Very high	97.6	Very high	58 Å²	58	68.3 Å²	68.3	27%	0.269	34%	0.335	S	S	.	.	H	α-helix	trans	-67.7	-42.3	177.2	-76.2	-68.8	0	0	0	112.4	Q130 L131 K137 L138 Q254 V257 V258	Q130-H134 PolarHBondContact O-CD2 2.88Å; Q130-H134 PolarHBondContact O-N 2.95Å; L131-H134 PolarHBondContact O-N 3.46Å; H134-K137 PolarHBondContact O-N 3.12Å; H134-L138 WeakPolarHBondContact O-CB 3.47Å; H134-L138 PolarHBondContact O-N 3.09Å; H134-Q254 PolarHBondContact ND1-OE1 3.06Å; H134-Q254 VanDerWaalsContact ND1-OE1 3.07Å; H134-V257 HydrophobicContact CB-CG1 4.39Å; H134-V258 HydrophobicContact CB-CG2 3.74Å
135	S	98.2	Very high	97.4	Very high	37 Å²	37	69 Å²	69	26%	0.259	34%	0.343	S	S	.	.	H	α-helix	trans	-64.1	-39.2	175	-65.1	0	0	0	0	112.5	L131 Q132 L138 L139	L131-S135 WeakPolarHBondContact O-CB 3.41Å; L131-S135 PolarHBondContact O-N 3.4Å; L131-S135 PolarHBondContact O-OG 3.18Å; L131-S135 VanDerWaalsContact O-OG 3.1Å; Q132-S135 PolarHBondContact O-N 2.8Å; S135-L138 PolarHBondContact O-N 3.4Å; S135-L139 VanDerWaalsContact O-CG 3.3Å; S135-L139 WeakPolarHBondContact O-CG 3.14Å; S135-L139 PolarHBondContact O-N 3.03Å
136	Q	98.4	Very high	97.2	Very high	111 Å²	111	71.9 Å²	71.9	52%	0.519	35%	0.35	S	S	.	.	H	α-helix	trans	-62.7	-44.1	173.3	-76.1	172.4	-24.2	0	0	111.8	Q132 R133 L139 A140	Q132-Q136 WeakPolarHBondContact O-CB 3.29Å; Q132-Q136 VanDerWaalsContact O-CG 3.28Å; Q132-Q136 WeakPolarHBondContact O-CG 3.31Å; Q132-Q136 PolarHBondContact O-N 3.05Å; R133-Q136 PolarHBondContact O-N 3.27Å; Q136-L139 PolarHBondContact O-N 3.46Å; Q136-A140 WeakPolarHBondContact O-CB 3.48Å; Q136-A140 PolarHBondContact O-N 3.46Å
137	K	97.6	Very high	97.1	Very high	88 Å²	88	73.7 Å²	73.7	38%	0.383	35%	0.353	S	S	.	.	H	α-helix	trans	-63.5	-42.6	175.4	-175.9	-178.2	170.1	-167.7	0	112.1	R133 H134 A140 L141 E250 Q254	R133-K137 PolarHBondContact O-N 3.43Å; H134-K137 PolarHBondContact O-N 3.12Å; K137-A140 PolarHBondContact O-N 3.38Å; K137-L141 HydrophobicContact CG-CD1 4.15Å; K137-L141 WeakPolarHBondContact O-CG 3.38Å; K137-L141 PolarHBondContact O-N 3.36Å; K137-E250 IonicContact NZ-OE1 3.32Å; K137-E250 PolarHBondContact NZ-OE1 3.39Å; K137-Q254 HydrophobicContact CD-CG 4.19Å
138	L	98.2	Very high	96.7	Very high	10 Å²	10	76.1 Å²	76.1	5%	0.052	36%	0.361	C	S	.	.	H	α-helix	trans	-59.5	-47.1	177.2	176	63.1	0	0	0	111.5	H134 S135 A140 L141 Q142 I251 Q254 Q255 V258	H134-L138 WeakPolarHBondContact O-CB 3.47Å; H134-L138 PolarHBondContact O-N 3.09Å; S135-L138 PolarHBondContact O-N 3.4Å; L138-A140 PolarHBondContact O-N 3.05Å; L138-L141 PolarHBondContact O-N 2.94Å; L138-Q142 HydrophobicContact CD1-CG 4.36Å; L138-Q142 WeakPolarHBondContact O-CB 3.37Å; L138-Q142 WeakPolarHBondContact O-CG 3.29Å; L138-Q142 PolarHBondContact O-N 3.11Å; L138-I251 HydrophobicContact CD1-CG2 3.99Å; L138-Q254 HydrophobicContact CB-CB 4.26Å; L138-Q254 HydrophobicContact CD1-CB 4.12Å; L138-Q255 HydrophobicContact CD1-CB 4.21Å; L138-Q255 HydrophobicContact CD2-CB 4.38Å; L138-V258 HydrophobicContact CB-CG2 4.45Å; L138-V258 HydrophobicContact CD2-CB 4.37Å; L138-V258 HydrophobicContact CD2-CG2 4.01Å
139	L	98.3	Very high	96.4	Very high	112 Å²	112	78.3 Å²	78.3	59%	0.586	37%	0.373	S	S	*	.	H	α-helix	trans	-62.1	-41.3	176.4	-72	168.3	0	0	0	112.2	S135 Q136 Q142 Q143	S135-L139 VanDerWaalsContact O-CG 3.3Å; S135-L139 WeakPolarHBondContact O-CG 3.14Å; S135-L139 PolarHBondContact O-N 3.03Å; Q136-L139 PolarHBondContact O-N 3.46Å; L139-Q142 PolarHBondContact O-N 3.25Å; L139-Q143 WeakPolarHBondContact O-CB 3.15Å; L139-Q143 PolarHBondContact O-N 3.45Å
140	A	97.6	Very high	96.1	Very high	61 Å²	61	82.5 Å²	82.5	50%	0.504	39%	0.39	S	S	.	.	H	α-helix	trans	-62.7	-43.2	176.8	0	0	0	0	0	112.3	Q136 K137 L138 Q143 Q144	Q136-A140 WeakPolarHBondContact O-CB 3.48Å; Q136-A140 PolarHBondContact O-N 3.46Å; K137-A140 PolarHBondContact O-N 3.38Å; L138-A140 PolarHBondContact O-N 3.05Å; A140-Q143 PolarHBondContact O-N 2.83Å; A140-Q144 WeakPolarHBondContact O-CB 3.38Å; A140-Q144 PolarHBondContact O-N 2.91Å
141	L	96.6	Very high	95.9	Very high	23 Å²	23	84 Å²	84	12%	0.12	40%	0.397	C	S	.	.	H	α-helix	trans	-65.3	-43.3	175.6	-70	165.2	0	0	0	112.2	K137 L138 Q143 Q144 A145 E250 I251 Q254	K137-L141 HydrophobicContact CG-CD1 4.15Å; K137-L141 WeakPolarHBondContact O-CG 3.38Å; K137-L141 PolarHBondContact O-N 3.36Å; L138-L141 PolarHBondContact O-N 2.94Å; L141-Q143 VanDerWaalsContact C-N 3.29Å; L141-Q143 PolarHBondContact O-N 3.34Å; L141-Q144 PolarHBondContact O-N 2.82Å; L141-A145 PolarHBondContact O-N 3.17Å; L141-E250 HydrophobicContact CD1-CG 3.79Å; L141-E250 HydrophobicContact CD2-CG 4.4Å; L141-I251 HydrophobicContact CB-CD1 4.28Å; L141-I251 HydrophobicContact CB-CG1 3.63Å; L141-I251 HydrophobicContact CD1-CG1 4.48Å; L141-Q254 HydrophobicContact CD1-CG 3.84Å
142	Q	96.9	Very high	95.5	Very high	51 Å²	51	84.7 Å²	84.7	24%	0.238	40%	0.398	C	S	.	.	H	α-helix	trans	-63.1	-35.4	176.4	-74.2	175.1	-8.1	0	0	112.3	L138 L139 R146 I251	L138-Q142 HydrophobicContact CD1-CG 4.36Å; L138-Q142 WeakPolarHBondContact O-CB 3.37Å; L138-Q142 WeakPolarHBondContact O-CG 3.29Å; L138-Q142 PolarHBondContact O-N 3.11Å; L139-Q142 PolarHBondContact O-N 3.25Å; Q142-R146 WeakPolarHBondContact O-CD 3.44Å; Q142-R146 VanDerWaalsContact O-CG 3.31Å; Q142-R146 WeakPolarHBondContact O-CG 3.46Å; Q142-R146 PolarHBondContact O-N 3.42Å; Q142-I251 HydrophobicContact CG-CD1 4.47Å; Q142-I251 HydrophobicContact CG-CG2 4.07Å
143	Q	97	Very high	95.1	Very high	86 Å²	86	87.5 Å²	87.5	40%	0.402	40%	0.404	S	S	.	.	H	α-helix	trans	-69.8	-45.2	173.8	-177.1	60.1	20.4	0	0	111.4	L139 A140 L141 A145 R146 E147	L139-Q143 WeakPolarHBondContact O-CB 3.15Å; L139-Q143 PolarHBondContact O-N 3.45Å; A140-Q143 PolarHBondContact O-N 2.83Å; L141-Q143 VanDerWaalsContact C-N 3.29Å; L141-Q143 PolarHBondContact O-N 3.34Å; Q143-A145 VanDerWaalsContact C-N 3.31Å; Q143-A145 PolarHBondContact O-N 2.88Å; Q143-R146 PolarHBondContact O-N 3.02Å; Q143-E147 WeakPolarHBondContact CG-OE1 3.5Å; Q143-E147 PolarHBondContact NE2-OE1 3.49Å; Q143-E147 WeakPolarHBondContact O-CG 3.47Å; Q143-E147 PolarHBondContact O-N 3.31Å
144	Q	95.4	Very high	94.9	Very high	85 Å²	85	83.8 Å²	83.8	40%	0.397	40%	0.396	S	S	.	.	H	α-helix	trans	-60.3	-39.1	178.1	-168.6	179.1	28.2	0	0	112.4	A140 L141 E147 R148 M247	A140-Q144 WeakPolarHBondContact O-CB 3.38Å; A140-Q144 PolarHBondContact O-N 2.91Å; L141-Q144 PolarHBondContact O-N 2.82Å; Q144-E147 PolarHBondContact O-N 2.71Å; Q144-R148 WeakPolarHBondContact O-CG 3.48Å; Q144-R148 PolarHBondContact O-N 3Å; Q144-M247 HydrophobicContact CB-CE 4.42Å; Q144-M247 HydrophobicContact CB-SD 4.5Å; Q144-M247 HydrophobicContact CG-CE 3.88Å; Q144-M247 HydrophobicContact CG-SD 4.45Å; Q144-M247 VanDerWaalsContact OE1-CE 3.31Å
145	A	93.5	Very high	94.5	Very high	30 Å²	30	83.7 Å²	83.7	25%	0.248	40%	0.398	C	S	.	.	H	α-helix	trans	-61.3	-47.4	174.6	0	0	0	0	0	111.9	L141 Q143 E147 R148 E149 M247 I251	L141-A145 PolarHBondContact O-N 3.17Å; Q143-A145 VanDerWaalsContact C-N 3.31Å; Q143-A145 PolarHBondContact O-N 2.88Å; A145-E147 VanDerWaalsContact C-N 3.3Å; A145-E147 PolarHBondContact O-N 3.21Å; A145-R148 PolarHBondContact O-N 2.86Å; A145-E149 PolarHBondContact O-N 3.48Å; A145-M247 HydrophobicContact CB-SD 3.83Å; A145-I251 HydrophobicContact CB-CD1 4.02Å
146	R	94.6	Very high	94.1	Very high	158 Å²	158	86.1 Å²	86.1	60%	0.596	40%	0.402	S	S	*	.	H	α-helix	trans	-63	-35.3	177.1	-68.9	166.4	178.9	175	0.2	112.8	Q142 Q143 K150	Q142-R146 WeakPolarHBondContact O-CD 3.44Å; Q142-R146 VanDerWaalsContact O-CG 3.31Å; Q142-R146 WeakPolarHBondContact O-CG 3.46Å; Q142-R146 PolarHBondContact O-N 3.42Å; Q143-R146 PolarHBondContact O-N 3.02Å; R146-K150 VanDerWaalsContact O-CB 3.23Å; R146-K150 WeakPolarHBondContact O-CB 3.49Å; R146-K150 PolarHBondContact O-N 2.67Å
147	E	94.6	Very high	94	Very high	108 Å²	108	86 Å²	86	51%	0.505	40%	0.404	S	S	.	.	H	α-helix	trans	-70	-40.3	177.2	-74.5	170	178.7	0	0	111.8	Q143 Q144 A145 H151	Q143-E147 WeakPolarHBondContact CG-OE1 3.5Å; Q143-E147 PolarHBondContact NE2-OE1 3.49Å; Q143-E147 WeakPolarHBondContact O-CG 3.47Å; Q143-E147 PolarHBondContact O-N 3.31Å; Q144-E147 PolarHBondContact O-N 2.71Å; A145-E147 VanDerWaalsContact C-N 3.3Å; A145-E147 PolarHBondContact O-N 3.21Å; E147-H151 WeakPolarHBondContact O-CB 3.14Å; E147-H151 PolarHBondContact O-N 3.4Å
148	R	89.9	Confident	93.9	Very high	84 Å²	84	86.1 Å²	86.1	32%	0.317	40%	0.404	S	S	.	.	H	α-helix	trans	-62.8	-51	171.6	-74.5	175.8	169.6	-143	-4.4	112.3	Q144 A145 K150 H151 K152 T243	Q144-R148 WeakPolarHBondContact O-CG 3.48Å; Q144-R148 PolarHBondContact O-N 3Å; A145-R148 PolarHBondContact O-N 2.86Å; R148-K150 VanDerWaalsContact C-N 3.28Å; R148-K150 PolarHBondContact O-N 3.37Å; R148-H151 WeakPolarHBondContact O-CA 3.41Å; R148-H151 WeakPolarHBondContact O-CB 3.23Å; R148-H151 PolarHBondContact O-N 3.28Å; R148-K152 PolarHBondContact O-N 3.18Å; R148-T243 PolarHBondContact NH1-OG1 3.47Å
149	E	91.1	Very high	93.6	Very high	122 Å²	122	88.2 Å²	88.2	57%	0.57	41%	0.414	S	S	*	.	H	α-helix	trans	-59.3	-41.2	179	-166.2	-164.1	151.1	0	0	111.2	A145 R153	A145-E149 PolarHBondContact O-N 3.48Å; E149-R153 VanDerWaalsContact O-CB 3.27Å; E149-R153 WeakPolarHBondContact O-CB 3.44Å; E149-R153 PolarHBondContact O-N 3.38Å
150	K	92.7	Very high	93.4	Very high	151 Å²	151	89.3 Å²	89.3	66%	0.657	41%	0.41	S	S	*	.	H	α-helix	trans	-60.5	-44.7	172.5	-177.8	-172.8	174.2	-168.5	0	111.8	R146 R148 R153 T154	R146-K150 VanDerWaalsContact O-CB 3.23Å; R146-K150 WeakPolarHBondContact O-CB 3.49Å; R146-K150 PolarHBondContact O-N 2.67Å; R148-K150 VanDerWaalsContact C-N 3.28Å; R148-K150 PolarHBondContact O-N 3.37Å; K150-R153 PolarHBondContact O-N 2.97Å; K150-T154 WeakPolarHBondContact O-CG2 3.34Å; K150-T154 PolarHBondContact O-N 3.39Å
151	H	92.1	Very high	93.3	Very high	118 Å²	118	91.6 Å²	91.6	55%	0.546	41%	0.41	S	S	.	.	H	α-helix	trans	-58.4	-58.3	177.6	-164.8	-14.6	0	0	0	110	E147 R148 R153 T154 D155	E147-H151 WeakPolarHBondContact O-CB 3.14Å; E147-H151 PolarHBondContact O-N 3.4Å; R148-H151 WeakPolarHBondContact O-CA 3.41Å; R148-H151 WeakPolarHBondContact O-CB 3.23Å; R148-H151 PolarHBondContact O-N 3.28Å; H151-R153 VanDerWaalsContact C-N 3.27Å; H151-R153 PolarHBondContact O-N 3.44Å; H151-T154 WeakPolarHBondContact O-CA 3.37Å; H151-T154 PolarHBondContact O-N 2.99Å; H151-T154 PolarHBondContact O-OG1 2.78Å; H151-D155 IonicContact CE1-OD2 3.87Å; H151-D155 PolarHBondContact CE1-OD2 3.34Å; H151-D155 IonicContact CG-OD2 3.75Å; H151-D155 IonicContact ND1-OD2 2.86Å; H151-D155 PolarHBondContact ND1-OD2 3.14Å; H151-D155 PolarHBondContact O-N 2.97Å
152	K	88.4	Confident	93.3	Very high	39 Å²	39	98.2 Å²	98.2	17%	0.17	43%	0.434	C	S	.	.	H	α-helix	trans	-51	-44.9	176.9	-66.9	-169.2	176.1	-149.6	0	112.6	R148 T154 D155 R156 E240 E244	R148-K152 PolarHBondContact O-N 3.18Å; K152-T154 VanDerWaalsContact C-N 3.33Å; K152-T154 PolarHBondContact O-N 3.5Å; K152-D155 PolarHBondContact O-N 3.31Å; K152-R156 WeakPolarHBondContact O-CG 3.48Å; K152-R156 PolarHBondContact O-N 2.84Å; K152-E240 WeakPolarHBondContact CE-OE2 3.45Å; K152-E240 IonicContact NZ-OE2 3.74Å; K152-E240 PolarHBondContact NZ-OE2 2.66Å; K152-E244 WeakPolarHBondContact CE-OE1 3.43Å; K152-E244 VanDerWaalsContact CE-OE2 3.23Å; K152-E244 WeakPolarHBondContact CE-OE2 3.36Å; K152-E244 VanDerWaalsContact NZ-CD 3.27Å; K152-E244 IonicContact NZ-OE1 2.99Å; K152-E244 IonicContact NZ-OE2 2.73Å; K152-E244 PolarHBondContact NZ-OE2 2.95Å
153	R	90.2	Very high	93.4	Very high	172 Å²	172	96.4 Å²	96.4	65%	0.649	43%	0.426	S	S	*	.	H	α-helix	trans	-63.4	-36.5	177.3	-169.7	173.4	-173.3	141.3	3.4	112.6	E149 K150 H151 L157	E149-R153 VanDerWaalsContact O-CB 3.27Å; E149-R153 WeakPolarHBondContact O-CB 3.44Å; E149-R153 PolarHBondContact O-N 3.38Å; K150-R153 PolarHBondContact O-N 2.97Å; H151-R153 VanDerWaalsContact C-N 3.27Å; H151-R153 PolarHBondContact O-N 3.44Å; R153-L157 WeakPolarHBondContact O-CD1 3.23Å; R153-L157 VanDerWaalsContact O-CG 3.25Å; R153-L157 WeakPolarHBondContact O-CG 3.41Å; R153-L157 PolarHBondContact O-N 3.25Å
154	T	93.6	Very high	93.4	Very high	55 Å²	55	97.4 Å²	97.4	34%	0.337	43%	0.43	S	S	.	.	H	α-helix	trans	-70.7	-31	173.2	61.5	0	0	0	0	113.3	K150 H151 K152 K158	K150-T154 WeakPolarHBondContact O-CG2 3.34Å; K150-T154 PolarHBondContact O-N 3.39Å; H151-T154 WeakPolarHBondContact O-CA 3.37Å; H151-T154 PolarHBondContact O-N 2.99Å; H151-T154 PolarHBondContact O-OG1 2.78Å; K152-T154 VanDerWaalsContact C-N 3.33Å; K152-T154 PolarHBondContact O-N 3.5Å; T154-K158 WeakPolarHBondContact O-CE 3.29Å; T154-K158 VanDerWaalsContact O-CG 3.29Å; T154-K158 WeakPolarHBondContact O-CG 3.43Å; T154-K158 PolarHBondContact O-N 2.75Å; T154-K158 VanDerWaalsContact O-N 3.09Å
155	D	90	Very high	93.5	Very high	57 Å²	57	99.1 Å²	99.1	31%	0.305	44%	0.437	S	S	.	.	H	α-helix	trans	-79.3	-41.3	179.4	-62.8	-59.5	0	0	0	112.7	H151 K152 L157 K158 E159	H151-D155 IonicContact CE1-OD2 3.87Å; H151-D155 PolarHBondContact CE1-OD2 3.34Å; H151-D155 IonicContact CG-OD2 3.75Å; H151-D155 IonicContact ND1-OD2 2.86Å; H151-D155 PolarHBondContact ND1-OD2 3.14Å; H151-D155 PolarHBondContact O-N 2.97Å; K152-D155 PolarHBondContact O-N 3.31Å; D155-L157 PolarHBondContact O-N 3.34Å; D155-K158 PolarHBondContact O-N 3.24Å; D155-K158 WeakPolarHBondContact OD1-CD 3.46Å; D155-K158 WeakPolarHBondContact OD1-CE 3.46Å; D155-K158 IonicContact OD1-NZ 3.92Å; D155-K158 PolarHBondContact OD1-NZ 2.96Å; D155-E159 WeakPolarHBondContact O-CB 3.12Å; D155-E159 PolarHBondContact O-N 2.95Å
156	R	90.5	Very high	93.7	Very high	88 Å²	88	99.9 Å²	99.9	33%	0.332	44%	0.435	S	S	.	.	H	α-helix	trans	-54.1	-38.3	168.2	-70.8	-178.5	-179	-154.3	-1.6	111.6	K152 R160 Q223 E224	K152-R156 WeakPolarHBondContact O-CG 3.48Å; K152-R156 PolarHBondContact O-N 2.84Å; R156-R160 WeakPolarHBondContact O-CB 3.33Å; R156-R160 WeakPolarHBondContact O-CD 3.4Å; R156-R160 VanDerWaalsContact O-CG 3.23Å; R156-R160 WeakPolarHBondContact O-CG 3.39Å; R156-R160 PolarHBondContact O-N 2.92Å; R156-Q223 PolarHBondContact NH2-O 3.03Å; R156-E224 HydrophobicContact CG-CG 4.11Å; R156-E224 PolarHBondContact NH1-O 3Å; R156-E224 PolarHBondContact NH2-O 3.2Å
157	L	94.4	Very high	93.9	Very high	109 Å²	109	96.6 Å²	96.6	57%	0.571	42%	0.423	S	S	*	.	H	α-helix	trans	-67.1	-44.1	173.9	-74.8	169.9	0	0	0	113.1	R153 D155 E159 R160 E161	R153-L157 WeakPolarHBondContact O-CD1 3.23Å; R153-L157 VanDerWaalsContact O-CG 3.25Å; R153-L157 WeakPolarHBondContact O-CG 3.41Å; R153-L157 PolarHBondContact O-N 3.25Å; D155-L157 PolarHBondContact O-N 3.34Å; L157-E159 VanDerWaalsContact C-N 3.31Å; L157-E159 PolarHBondContact O-N 2.79Å; L157-R160 PolarHBondContact O-N 2.92Å; L157-E161 WeakPolarHBondContact O-CB 3.41Å; L157-E161 PolarHBondContact O-N 3Å
158	K	95.4	Very high	94	Very high	89 Å²	89	96.9 Å²	96.9	39%	0.387	42%	0.424	S	S	.	.	H	α-helix	trans	-62.6	-38.3	175.3	-67.7	163.5	-152.5	164.1	0	111.7	T154 D155 E161 R162	T154-K158 WeakPolarHBondContact O-CE 3.29Å; T154-K158 VanDerWaalsContact O-CG 3.29Å; T154-K158 WeakPolarHBondContact O-CG 3.43Å; T154-K158 PolarHBondContact O-N 2.75Å; T154-K158 VanDerWaalsContact O-N 3.09Å; D155-K158 PolarHBondContact O-N 3.24Å; D155-K158 WeakPolarHBondContact OD1-CD 3.46Å; D155-K158 WeakPolarHBondContact OD1-CE 3.46Å; D155-K158 IonicContact OD1-NZ 3.92Å; D155-K158 PolarHBondContact OD1-NZ 2.96Å; K158-E161 WeakPolarHBondContact O-CB 3.4Å; K158-E161 PolarHBondContact O-N 3.11Å; K158-R162 WeakPolarHBondContact O-CG 3.47Å; K158-R162 PolarHBondContact O-N 3.43Å
159	E	93	Very high	94.4	Very high	55 Å²	55	100 Å²	100	26%	0.257	44%	0.435	S	S	.	.	H	α-helix	trans	-68.6	-45.2	-179.6	-173.6	149.9	-127.1	0	0	111.4	D155 L157 E161 R162 L163 V220	D155-E159 WeakPolarHBondContact O-CB 3.12Å; D155-E159 PolarHBondContact O-N 2.95Å; L157-E159 VanDerWaalsContact C-N 3.31Å; L157-E159 PolarHBondContact O-N 2.79Å; E159-E161 VanDerWaalsContact C-N 3.28Å; E159-E161 PolarHBondContact O-N 2.8Å; E159-R162 WeakPolarHBondContact O-CB 3.49Å; E159-R162 PolarHBondContact O-N 3.38Å; E159-L163 PolarHBondContact O-N 3.47Å; E159-V220 HydrophobicContact CG-CG1 4.02Å; E159-V220 HydrophobicContact CG-CG2 3.71Å
160	R	93.1	Very high	94.8	Very high	134 Å²	134	94.9 Å²	94.9	51%	0.506	41%	0.412	S	S	.	.	H	α-helix	trans	-58.6	-37.2	170.3	-71.6	165.7	169.4	-86.9	4	112.7	R156 L157 R162 L163 E164 E224	R156-R160 WeakPolarHBondContact O-CB 3.33Å; R156-R160 WeakPolarHBondContact O-CD 3.4Å; R156-R160 VanDerWaalsContact O-CG 3.23Å; R156-R160 WeakPolarHBondContact O-CG 3.39Å; R156-R160 PolarHBondContact O-N 2.92Å; L157-R160 PolarHBondContact O-N 2.92Å; R160-R162 VanDerWaalsContact C-N 3.33Å; R160-L163 PolarHBondContact O-N 2.92Å; R160-E164 PolarHBondContact O-N 2.93Å; R160-E164 VanDerWaalsContact O-N 3.08Å; R160-E224 IonicContact CZ-OE1 3.55Å; R160-E224 IonicContact CZ-OE2 3.94Å; R160-E224 VanDerWaalsContact CZ-OE2 3.31Å; R160-E224 IonicContact NE-OE1 2.74Å; R160-E224 PolarHBondContact NE-OE1 3.42Å; R160-E224 IonicContact NE-OE2 2.89Å; R160-E224 PolarHBondContact NE-OE2 2.93Å; R160-E224 IonicContact NH2-OE1 3.28Å; R160-E224 PolarHBondContact NH2-OE1 3Å; R160-E224 IonicContact NH2-OE2 2.8Å; R160-E224 PolarHBondContact NH2-OE2 2.71Å
161	E	96.9	Very high	95	Very high	109 Å²	109	91 Å²	91	51%	0.509	40%	0.396	S	S	.	.	H	α-helix	trans	-66.3	-32.1	173.5	-161.6	-158	145.5	0	0	112.8	L157 K158 E159 K165	L157-E161 WeakPolarHBondContact O-CB 3.41Å; L157-E161 PolarHBondContact O-N 3Å; K158-E161 WeakPolarHBondContact O-CB 3.4Å; K158-E161 PolarHBondContact O-N 3.11Å; E159-E161 VanDerWaalsContact C-N 3.28Å; E159-E161 PolarHBondContact O-N 2.8Å; E161-K165 WeakPolarHBondContact O-CD 3.33Å; E161-K165 VanDerWaalsContact O-CG 3.31Å; E161-K165 WeakPolarHBondContact O-CG 3.4Å; E161-K165 PolarHBondContact O-N 3.29Å; E161-K165 VanDerWaalsContact OE1-CE 3.31Å; E161-K165 WeakPolarHBondContact OE1-CE 3.47Å; E161-K165 IonicContact OE1-NZ 3.05Å; E161-K165 PolarHBondContact OE1-NZ 3.38Å
162	R	96.9	Very high	95.3	Very high	162 Å²	162	90.9 Å²	90.9	61%	0.611	40%	0.396	S	S	*	.	H	α-helix	trans	-74.9	-43	174.3	-64	168.6	-173.5	-151.3	3.1	111.4	K158 E159 R160 E164 K165 E166 W216	K158-R162 WeakPolarHBondContact O-CG 3.47Å; K158-R162 PolarHBondContact O-N 3.43Å; E159-R162 WeakPolarHBondContact O-CB 3.49Å; E159-R162 PolarHBondContact O-N 3.38Å; R160-R162 VanDerWaalsContact C-N 3.33Å; R162-E164 VanDerWaalsContact C-N 3.31Å; R162-E164 PolarHBondContact O-N 3.11Å; R162-K165 PolarHBondContact O-N 3.4Å; R162-E166 PolarHBondContact O-N 3.37Å; R162-E166 VanDerWaalsContact O-N 3.1Å; R162-W216 HydrophobicContact CB-CH2 3.67Å; R162-W216 HydrophobicContact CB-CZ2 4.03Å
163	L	97.1	Very high	95.7	Very high	13 Å²	13	92 Å²	92	7%	0.068	40%	0.403	C	S	.	.	H	α-helix	trans	-55.5	-46.7	175	-76.6	175.8	0	0	0	111	E159 R160 K165 E166 R167 F213 W216 E217 V220	E159-L163 PolarHBondContact O-N 3.47Å; R160-L163 PolarHBondContact O-N 2.92Å; L163-K165 VanDerWaalsContact C-N 3.31Å; L163-K165 PolarHBondContact O-N 3.04Å; L163-E166 PolarHBondContact O-N 3.05Å; L163-R167 WeakPolarHBondContact O-CB 3.33Å; L163-R167 PolarHBondContact O-N 3.04Å; L163-F213 HydrophobicContact CB-CE2 4.43Å; L163-F213 HydrophobicContact CD2-CD2 4.45Å; L163-F213 HydrophobicContact CD2-CE2 3.86Å; L163-F213 WeakPolarHBondContact O-CE2 3.23Å; L163-W216 HydrophobicContact CD2-CD2 3.53Å; L163-W216 HydrophobicContact CD2-CE3 3.61Å; L163-W216 HydrophobicContact CD2-CG 4.09Å; L163-W216 HydrophobicContact CD2-CH2 3.85Å; L163-W216 HydrophobicContact CD2-CZ2 3.79Å; L163-W216 HydrophobicContact CD2-CZ3 3.78Å; L163-W216 HydrophobicContact CG-CH2 4.17Å; L163-W216 HydrophobicContact CG-CZ2 4.03Å; L163-E217 HydrophobicContact CD1-CG 4.4Å; L163-E217 HydrophobicContact CD2-CG 3.83Å; L163-V220 HydrophobicContact CD1-CB 4.14Å; L163-V220 HydrophobicContact CD1-CG1 4Å; L163-V220 HydrophobicContact CD1-CG2 4.12Å
164	E	97.5	Very high	96	Very high	107 Å²	107	87.6 Å²	87.6	50%	0.5	39%	0.389	S	S	.	.	H	α-helix	trans	-68.2	-29.3	-178.1	-161.7	59.4	-161.3	0	0	113.2	R160 R162 R167 H168	R160-E164 PolarHBondContact O-N 2.93Å; R160-E164 VanDerWaalsContact O-N 3.08Å; R162-E164 VanDerWaalsContact C-N 3.31Å; R162-E164 PolarHBondContact O-N 3.11Å; E164-R167 IonicContact OE1-NE 2.66Å; E164-R167 IonicContact OE2-CZ 3.45Å; E164-R167 IonicContact OE2-NE 3.34Å; E164-R167 PolarHBondContact OE2-NE 2.93Å; E164-R167 IonicContact OE2-NH2 2.8Å; E164-R167 PolarHBondContact OE2-NH2 2.91Å; E164-H168 PolarHBondContact O-N 3.17Å
165	K	97.9	Very high	96.2	Very high	121 Å²	121	89.4 Å²	89.4	53%	0.526	39%	0.392	S	S	.	.	H	α-helix	trans	-67.8	-42.6	171.9	-72.6	167.6	-171.7	172	0	112.1	E161 R162 L163 H168 R169	E161-K165 WeakPolarHBondContact O-CD 3.33Å; E161-K165 VanDerWaalsContact O-CG 3.31Å; E161-K165 WeakPolarHBondContact O-CG 3.4Å; E161-K165 PolarHBondContact O-N 3.29Å; E161-K165 VanDerWaalsContact OE1-CE 3.31Å; E161-K165 WeakPolarHBondContact OE1-CE 3.47Å; E161-K165 IonicContact OE1-NZ 3.05Å; E161-K165 PolarHBondContact OE1-NZ 3.38Å; R162-K165 PolarHBondContact O-N 3.4Å; L163-K165 VanDerWaalsContact C-N 3.31Å; L163-K165 PolarHBondContact O-N 3.04Å; K165-H168 WeakPolarHBondContact O-CB 3.46Å; K165-H168 PolarHBondContact O-N 3.13Å; K165-R169 PolarHBondContact O-N 3.13Å
166	E	97.6	Very high	96.6	Very high	46 Å²	46	89.4 Å²	89.4	22%	0.215	40%	0.397	C	S	.	.	H	α-helix	trans	-70.9	-37.5	177.9	-164.4	62.8	-163.2	0	0	111.3	R162 L163 H168 R169 L170 F213 W216	R162-E166 PolarHBondContact O-N 3.37Å; R162-E166 VanDerWaalsContact O-N 3.1Å; L163-E166 PolarHBondContact O-N 3.05Å; E166-H168 VanDerWaalsContact C-N 3.29Å; E166-H168 PolarHBondContact O-N 2.9Å; E166-R169 WeakPolarHBondContact O-CB 3.46Å; E166-R169 PolarHBondContact O-N 2.76Å; E166-R169 WeakPolarHBondContact OE1-CD 3.03Å; E166-R169 IonicContact OE1-CZ 2.86Å; E166-R169 IonicContact OE1-NE 3.75Å; E166-R169 IonicContact OE1-NH1 3.08Å; E166-R169 PolarHBondContact OE1-NH1 3.03Å; E166-R169 WeakPolarHBondContact OE2-CD 3.42Å; E166-R169 IonicContact OE2-NH1 2.7Å; E166-R169 PolarHBondContact OE2-NH1 3.47Å; E166-L170 WeakPolarHBondContact O-CG 3.49Å; E166-L170 PolarHBondContact O-N 3.25Å; E166-F213 HydrophobicContact CB-CD2 3.92Å; E166-F213 HydrophobicContact CB-CE2 4.09Å; E166-F213 HydrophobicContact CG-CD2 3.84Å; E166-F213 HydrophobicContact CG-CE2 4.49Å; E166-W216 HydrophobicContact CB-CZ3 3.88Å; E166-W216 HydrophobicContact CG-CZ3 4.24Å
167	R	98.1	Very high	96.8	Very high	89 Å²	89	85.4 Å²	85.4	34%	0.336	38%	0.382	S	S	.	.	H	α-helix	trans	-55.7	-43.9	170	-162.7	-166.4	-49.8	-67.4	-2.9	111.6	L163 E164 L170 E171 F213 E217	L163-R167 WeakPolarHBondContact O-CB 3.33Å; L163-R167 PolarHBondContact O-N 3.04Å; E164-R167 IonicContact OE1-NE 2.66Å; E164-R167 IonicContact OE2-CZ 3.45Å; E164-R167 IonicContact OE2-NE 3.34Å; E164-R167 PolarHBondContact OE2-NE 2.93Å; E164-R167 IonicContact OE2-NH2 2.8Å; E164-R167 PolarHBondContact OE2-NH2 2.91Å; R167-L170 PolarHBondContact O-N 2.97Å; R167-E171 WeakPolarHBondContact O-CB 3.4Å; R167-E171 PolarHBondContact O-N 2.7Å; R167-E171 VanDerWaalsContact O-N 3.14Å; R167-F213 HydrophobicContact CB-CE1 4.45Å; R167-F213 HydrophobicContact CB-CE2 4.31Å; R167-F213 HydrophobicContact CB-CZ 3.81Å; R167-F213 HydrophobicContact CG-CE1 4.41Å; R167-F213 HydrophobicContact CG-CZ 4.19Å; R167-E217 IonicContact CZ-OE1 3.58Å; R167-E217 VanDerWaalsContact CZ-OE1 3.28Å; R167-E217 IonicContact NH1-OE1 2.81Å; R167-E217 PolarHBondContact NH1-OE1 2.99Å; R167-E217 IonicContact NH1-OE2 3.97Å; R167-E217 PolarHBondContact NH1-OE2 2.94Å; R167-E217 IonicContact NH2-OE1 2.67Å; R167-E217 PolarHBondContact NH2-OE1 2.72Å
168	H	98.4	Very high	96.9	Very high	115 Å²	115	83.7 Å²	83.7	53%	0.532	37%	0.371	S	S	.	.	H	α-helix	trans	-62.9	-47.3	177	-162.6	69.6	0	0	0	111.8	E164 K165 E166 L170 E171 E172	E164-H168 PolarHBondContact O-N 3.17Å; K165-H168 WeakPolarHBondContact O-CB 3.46Å; K165-H168 PolarHBondContact O-N 3.13Å; E166-H168 VanDerWaalsContact C-N 3.29Å; E166-H168 PolarHBondContact O-N 2.9Å; H168-L170 VanDerWaalsContact C-N 3.33Å; H168-L170 PolarHBondContact O-N 3.03Å; H168-E171 PolarHBondContact O-N 3.14Å; H168-E171 VanDerWaalsContact O-N 3.17Å; H168-E172 IonicContact NE2-OE1 3.54Å; H168-E172 PolarHBondContact O-N 3.17Å
169	R	97.9	Very high	97	Very high	148 Å²	148	85.2 Å²	85.2	56%	0.558	38%	0.38	S	S	*	.	H	α-helix	trans	-57.8	-40.7	177	-179.9	-170.5	173.1	-152.1	-2.2	112.8	K165 E166 E172 L173	K165-R169 PolarHBondContact O-N 3.13Å; E166-R169 WeakPolarHBondContact O-CB 3.46Å; E166-R169 PolarHBondContact O-N 2.76Å; E166-R169 WeakPolarHBondContact OE1-CD 3.03Å; E166-R169 IonicContact OE1-CZ 2.86Å; E166-R169 IonicContact OE1-NE 3.75Å; E166-R169 IonicContact OE1-NH1 3.08Å; E166-R169 PolarHBondContact OE1-NH1 3.03Å; E166-R169 WeakPolarHBondContact OE2-CD 3.42Å; E166-R169 IonicContact OE2-NH1 2.7Å; E166-R169 PolarHBondContact OE2-NH1 3.47Å; R169-E172 PolarHBondContact O-N 3.49Å; R169-L173 WeakPolarHBondContact O-CB 3.31Å; R169-L173 PolarHBondContact O-N 3.47Å
170	L	98.2	Very high	97	Very high	15 Å²	15	85.2 Å²	85.2	8%	0.079	38%	0.377	C	S	.	.	H	α-helix	trans	-66.7	-40.6	176.5	-70.3	175	0	0	0	112.2	E166 R167 H168 E172 L173 K174 A209 I210 F213	E166-L170 WeakPolarHBondContact O-CG 3.49Å; E166-L170 PolarHBondContact O-N 3.25Å; R167-L170 PolarHBondContact O-N 2.97Å; H168-L170 VanDerWaalsContact C-N 3.33Å; H168-L170 PolarHBondContact O-N 3.03Å; L170-E172 VanDerWaalsContact C-N 3.35Å; L170-L173 PolarHBondContact O-N 3.46Å; L170-K174 VanDerWaalsContact O-CB 3.29Å; L170-K174 WeakPolarHBondContact O-CB 3.4Å; L170-K174 PolarHBondContact O-N 2.9Å; L170-A209 HydrophobicContact CD2-CB 3.6Å; L170-I210 HydrophobicContact CD1-CG1 4.29Å; L170-I210 HydrophobicContact CD2-CG1 4.14Å; L170-F213 HydrophobicContact CD1-CB 3.5Å; L170-F213 HydrophobicContact CD1-CD1 3.71Å; L170-F213 HydrophobicContact CD1-CD2 4.23Å; L170-F213 HydrophobicContact CD1-CG 3.54Å
171	E	97.8	Very high	97.1	Very high	71 Å²	71	83 Å²	83	33%	0.332	37%	0.373	S	S	.	.	H	α-helix	trans	-71.5	-27	177.4	173.8	64.9	-168.4	0	0	112.4	R167 H168 K174 K175	R167-E171 WeakPolarHBondContact O-CB 3.4Å; R167-E171 PolarHBondContact O-N 2.7Å; R167-E171 VanDerWaalsContact O-N 3.14Å; H168-E171 PolarHBondContact O-N 3.14Å; H168-E171 VanDerWaalsContact O-N 3.17Å; E171-K174 IonicContact OE2-NZ 3.87Å; E171-K174 PolarHBondContact OE2-NZ 3.36Å; E171-K175 VanDerWaalsContact CG-NZ 3.29Å; E171-K175 WeakPolarHBondContact O-CD 3.08Å; E171-K175 WeakPolarHBondContact O-CG 3.49Å; E171-K175 PolarHBondContact O-N 2.87Å; E171-K175 WeakPolarHBondContact OE1-CE 3.48Å; E171-K175 IonicContact OE1-NZ 3.26Å; E171-K175 PolarHBondContact OE1-NZ 2.71Å
172	E	97.9	Very high	97	Very high	114 Å²	114	84.3 Å²	84.3	53%	0.533	38%	0.377	S	S	.	.	H	α-helix	trans	-69	-48.3	165.9	-71.3	-177.2	136.4	0	0	112.1	H168 R169 L170 K174 K175 S176	H168-E172 IonicContact NE2-OE1 3.54Å; H168-E172 PolarHBondContact O-N 3.17Å; R169-E172 PolarHBondContact O-N 3.49Å; L170-E172 VanDerWaalsContact C-N 3.35Å; E172-K174 VanDerWaalsContact C-N 3.28Å; E172-K174 PolarHBondContact O-N 3.22Å; E172-K175 PolarHBondContact O-N 3.22Å; E172-K175 VanDerWaalsContact O-N 3.17Å; E172-S176 PolarHBondContact O-N 3.21Å
173	L	96.8	Very high	96.9	Very high	63 Å²	63	81.5 Å²	81.5	33%	0.33	37%	0.373	S	S	.	.	H	α-helix	trans	-60	-39.8	179	-178.9	60.3	0	0	0	111.7	R169 L170 S176 C177 M206	R169-L173 WeakPolarHBondContact O-CB 3.31Å; R169-L173 PolarHBondContact O-N 3.47Å; L170-L173 PolarHBondContact O-N 3.46Å; L173-S176 WeakPolarHBondContact O-CB 3.4Å; L173-S176 PolarHBondContact O-N 3.06Å; L173-C177 PolarHBondContact O-N 3.36Å; L173-C177 PolarHBondContact O-SG 2.66Å; L173-M206 HydrophobicContact CD2-CB 3.77Å; L173-M206 HydrophobicContact CD2-CG 3.99Å; L173-M206 HydrophobicContact CG-CB 4.01Å; L173-M206 HydrophobicContact CG-CG 4.01Å
174	K	97.9	Very high	96.6	Very high	80 Å²	80	81.8 Å²	81.8	35%	0.348	38%	0.375	S	S	.	.	H	α-helix	trans	-61.9	-46.2	173.5	178.1	-178.2	154.1	-148.1	0	112.7	L170 E171 E172 S176 C177 E178 M206	L170-K174 VanDerWaalsContact O-CB 3.29Å; L170-K174 WeakPolarHBondContact O-CB 3.4Å; L170-K174 PolarHBondContact O-N 2.9Å; E171-K174 IonicContact OE2-NZ 3.87Å; E171-K174 PolarHBondContact OE2-NZ 3.36Å; E172-K174 VanDerWaalsContact C-N 3.28Å; E172-K174 PolarHBondContact O-N 3.22Å; K174-S176 VanDerWaalsContact C-N 3.34Å; K174-S176 PolarHBondContact O-N 3.1Å; K174-C177 PolarHBondContact O-N 3.33Å; K174-E178 WeakPolarHBondContact O-CG 3.48Å; K174-E178 PolarHBondContact O-N 3.48Å; K174-M206 WeakPolarHBondContact CA-SD 3.25Å; K174-M206 HydrophobicContact CB-SD 3.8Å; K174-M206 HydrophobicContact CG-SD 4.26Å
175	K	97.8	Very high	96.4	Very high	93 Å²	93	80.7 Å²	80.7	40%	0.404	38%	0.377	S	S	.	.	H	α-helix	trans	-59.3	-44.2	174.8	-77	164.8	-176.9	141.4	0	111.8	E171 E172 C177 E178 E179	E171-K175 VanDerWaalsContact CG-NZ 3.29Å; E171-K175 WeakPolarHBondContact O-CD 3.08Å; E171-K175 WeakPolarHBondContact O-CG 3.49Å; E171-K175 PolarHBondContact O-N 2.87Å; E171-K175 WeakPolarHBondContact OE1-CE 3.48Å; E171-K175 IonicContact OE1-NZ 3.26Å; E171-K175 PolarHBondContact OE1-NZ 2.71Å; E172-K175 PolarHBondContact O-N 3.22Å; E172-K175 VanDerWaalsContact O-N 3.17Å; K175-C177 VanDerWaalsContact C-N 3.34Å; K175-C177 PolarHBondContact O-N 3.06Å; K175-E178 PolarHBondContact O-N 3.14Å; K175-E179 WeakPolarHBondContact O-CB 3.33Å; K175-E179 VanDerWaalsContact O-CG 3.31Å; K175-E179 WeakPolarHBondContact O-CG 3.35Å; K175-E179 PolarHBondContact O-N 3.42Å
176	S	96.9	Very high	96	Very high	57 Å²	57	78.8 Å²	78.8	40%	0.399	38%	0.379	S	S	.	.	H	α-helix	trans	-58.4	-43.4	175.3	-176.3	0	0	0	0	112.6	E172 L173 K174 E179 R180	E172-S176 PolarHBondContact O-N 3.21Å; L173-S176 WeakPolarHBondContact O-CB 3.4Å; L173-S176 PolarHBondContact O-N 3.06Å; K174-S176 VanDerWaalsContact C-N 3.34Å; K174-S176 PolarHBondContact O-N 3.1Å; S176-E179 PolarHBondContact O-N 3.4Å; S176-R180 WeakPolarHBondContact O-CB 3.26Å; S176-R180 PolarHBondContact O-N 3.26Å
177	C	96.3	Very high	95.8	Very high	3 Å²	3	79.9 Å²	79.9	2%	0.02	38%	0.384	C	S	.	.	H	α-helix	trans	-63.4	-47.2	174.8	-66.1	0	0	0	0	112	L173 K174 K175 E179 R180 E181 L199 K203 M206	L173-C177 PolarHBondContact O-N 3.36Å; L173-C177 PolarHBondContact O-SG 2.66Å; K174-C177 PolarHBondContact O-N 3.33Å; K175-C177 VanDerWaalsContact C-N 3.34Å; K175-C177 PolarHBondContact O-N 3.06Å; C177-E179 PolarHBondContact O-N 2.91Å; C177-R180 PolarHBondContact O-N 2.83Å; C177-E181 WeakPolarHBondContact O-CB 3.44Å; C177-E181 PolarHBondContact O-N 2.88Å; C177-L199 HydrophobicContact CB-CD1 4.33Å; C177-L199 WeakPolarHBondContact O-CD1 3.32Å; C177-K203 HydrophobicContact CB-CG 4.39Å; C177-M206 HydrophobicContact CB-SD 4.28Å
178	E	96.4	Very high	95.4	Very high	74 Å²	74	78.8 Å²	78.8	35%	0.346	39%	0.388	S	S	.	.	H	α-helix	trans	-64.4	-38	177.7	-68.9	-175.4	-154.3	0	0	113.1	K174 K175 E181 K182	K174-E178 WeakPolarHBondContact O-CG 3.48Å; K174-E178 PolarHBondContact O-N 3.48Å; K175-E178 PolarHBondContact O-N 3.14Å; E178-E181 PolarHBondContact O-N 3.12Å; E178-K182 WeakPolarHBondContact O-CD 3.42Å; E178-K182 VanDerWaalsContact O-CE 3.29Å; E178-K182 WeakPolarHBondContact O-CE 3.32Å; E178-K182 WeakPolarHBondContact O-CG 3.06Å; E178-K182 PolarHBondContact O-N 3.23Å; E178-K182 IonicContact OE2-NZ 2.74Å; E178-K182 PolarHBondContact OE2-NZ 3.01Å
179	E	96.2	Very high	94.8	Very high	120 Å²	120	80.6 Å²	80.6	56%	0.561	40%	0.397	S	S	*	.	H	α-helix	trans	-65.5	-44.9	177.8	-78	174.8	-167.5	0	0	111.1	K175 S176 C177 E181 K182 L183	K175-E179 WeakPolarHBondContact O-CB 3.33Å; K175-E179 VanDerWaalsContact O-CG 3.31Å; K175-E179 WeakPolarHBondContact O-CG 3.35Å; K175-E179 PolarHBondContact O-N 3.42Å; S176-E179 PolarHBondContact O-N 3.4Å; C177-E179 PolarHBondContact O-N 2.91Å; E179-E181 VanDerWaalsContact C-N 3.34Å; E179-E181 PolarHBondContact O-N 2.88Å; E179-K182 PolarHBondContact O-N 3.39Å; E179-L183 WeakPolarHBondContact O-CG 3.37Å; E179-L183 PolarHBondContact O-N 3.45Å; E179-L183 VanDerWaalsContact O-N 3.13Å
180	R	93.4	Very high	94.3	Very high	55 Å²	55	78.8 Å²	78.8	21%	0.208	41%	0.407	C	S	.	.	H	α-helix	trans	-67.3	-35.1	176.7	-168.2	159.7	49.7	95.3	15.5	112.3	S176 C177 L183 I184 Q198 E202	S176-R180 WeakPolarHBondContact O-CB 3.26Å; S176-R180 PolarHBondContact O-N 3.26Å; C177-R180 PolarHBondContact O-N 2.83Å; R180-L183 PolarHBondContact O-N 3.42Å; R180-I184 WeakPolarHBondContact O-CG1 3.47Å; R180-I184 PolarHBondContact O-N 2.98Å; R180-I184 VanDerWaalsContact O-N 3.17Å; R180-Q198 PolarHBondContact NH1-O 3.39Å; R180-E202 IonicContact CZ-OE1 2.73Å; R180-E202 IonicContact CZ-OE2 2.83Å; R180-E202 IonicContact NE-OE1 2.71Å; R180-E202 IonicContact NE-OE2 2.83Å; R180-E202 IonicContact NH1-OE1 2.77Å; R180-E202 PolarHBondContact NH1-OE1 3.05Å; R180-E202 IonicContact NH1-OE2 3.24Å; R180-E202 VanDerWaalsContact NH2-CB 3.26Å; R180-E202 IonicContact NH2-OE1 3.18Å; R180-E202 PolarHBondContact NH2-OE1 3.24Å; R180-E202 IonicContact NH2-OE2 3.47Å; R180-E202 PolarHBondContact NH2-OE2 3.02Å
181	E	95.4	Very high	94	Very high	88 Å²	88	82.4 Å²	82.4	41%	0.411	42%	0.423	S	S	.	.	H	α-helix	trans	-60	-45.4	169.8	-175	156.7	-135.2	0	0	112.6	C177 E178 E179 L183 I184 P185 L199 K203	C177-E181 WeakPolarHBondContact O-CB 3.44Å; C177-E181 PolarHBondContact O-N 2.88Å; E178-E181 PolarHBondContact O-N 3.12Å; E179-E181 VanDerWaalsContact C-N 3.34Å; E179-E181 PolarHBondContact O-N 2.88Å; E181-L183 PolarHBondContact O-N 3.15Å; E181-I184 PolarHBondContact O-N 2.94Å; E181-P185 VanDerWaalsContact O-CD 3.24Å; E181-P185 WeakPolarHBondContact O-CD 3.23Å; E181-L199 HydrophobicContact CB-CD1 4.47Å; E181-L199 HydrophobicContact CB-CD2 3.58Å; E181-L199 HydrophobicContact CG-CD2 3.86Å; E181-K203 IonicContact OE1-NZ 2.7Å; E181-K203 PolarHBondContact OE1-NZ 3.08Å; E181-K203 WeakPolarHBondContact OE2-CE 3.31Å; E181-K203 IonicContact OE2-NZ 3.13Å; E181-K203 PolarHBondContact OE2-NZ 3.5Å
182	K	95.3	Very high	93.7	Very high	136 Å²	136	83 Å²	83	59%	0.591	42%	0.423	S	S	*	.	H	α-helix	trans	-62.9	-25.5	176	-67.1	153.8	-160.2	163.3	0	112.3	E178 E179	E178-K182 WeakPolarHBondContact O-CD 3.42Å; E178-K182 VanDerWaalsContact O-CE 3.29Å; E178-K182 WeakPolarHBondContact O-CE 3.32Å; E178-K182 WeakPolarHBondContact O-CG 3.06Å; E178-K182 PolarHBondContact O-N 3.23Å; E178-K182 IonicContact OE2-NZ 2.74Å; E178-K182 PolarHBondContact OE2-NZ 3.01Å; E179-K182 PolarHBondContact O-N 3.39Å
183	L	93.5	Very high	93.3	Very high	104 Å²	104	85.5 Å²	85.5	55%	0.545	43%	0.434	S	S	.	.	H	α-helix	trans	-83.8	-34	179.5	-70.8	169.8	0	0	0	114.3	E179 R180 E181 S186	E179-L183 WeakPolarHBondContact O-CG 3.37Å; E179-L183 PolarHBondContact O-N 3.45Å; E179-L183 VanDerWaalsContact O-N 3.13Å; R180-L183 PolarHBondContact O-N 3.42Å; E181-L183 PolarHBondContact O-N 3.15Å; L183-S186 WeakPolarHBondContact O-CB 3.42Å; L183-S186 PolarHBondContact O-N 2.84Å; L183-S186 PolarHBondContact O-OG 2.7Å
184	I	92.3	Very high	93.2	Very high	18 Å²	18	88.4 Å²	88.4	9%	0.092	45%	0.446	C	S	.	.	G	3₁₀ helix	trans	-53	-43.4	-174.8	-73.4	166.8	0	0	0	114.2	R180 E181 S186 Q187 R192 L195 L199	R180-I184 WeakPolarHBondContact O-CG1 3.47Å; R180-I184 PolarHBondContact O-N 2.98Å; R180-I184 VanDerWaalsContact O-N 3.17Å; E181-I184 PolarHBondContact O-N 2.94Å; I184-S186 PolarHBondContact O-N 3.19Å; I184-S186 VanDerWaalsContact O-N 3.09Å; I184-Q187 WeakPolarHBondContact O-CB 3.47Å; I184-Q187 PolarHBondContact O-N 3.42Å; I184-R192 HydrophobicContact CG2-CG 4.49Å; I184-L195 HydrophobicContact CD1-CB 4.23Å; I184-L195 WeakPolarHBondContact CD1-O 3.41Å; I184-L195 HydrophobicContact CG1-CB 3.97Å; I184-L199 HydrophobicContact CD1-CB 3.86Å; I184-L199 HydrophobicContact CD1-CD2 3.65Å; I184-L199 HydrophobicContact CD1-CG 4.39Å
185	P	92.8	Very high	93	Very high	85 Å²	85	87.1 Å²	87.1	55%	0.552	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-57.6	-25.6	177.6	-27.9	36.5	0	0	0	114.7	E181 Q187 R192	E181-P185 VanDerWaalsContact O-CD 3.24Å; E181-P185 WeakPolarHBondContact O-CD 3.23Å; P185-Q187 VanDerWaalsContact C-N 3.3Å; P185-Q187 PolarHBondContact O-N 2.63Å; P185-R192 PolarHBondContact O-NH2 2.98Å
186	S	90.2	Very high	92.8	Very high	80 Å²	80	86.1 Å²	86.1	56%	0.559	44%	0.444	S	S	*	.	G	3₁₀ helix	trans	-75.9	-14.1	178.2	72.7	0	0	0	0	114.4	L183 I184	L183-S186 WeakPolarHBondContact O-CB 3.42Å; L183-S186 PolarHBondContact O-N 2.84Å; L183-S186 PolarHBondContact O-OG 2.7Å; I184-S186 PolarHBondContact O-N 3.19Å; I184-S186 VanDerWaalsContact O-N 3.09Å
187	Q	91.7	Very high	92.7	Very high	69 Å²	69	89.5 Å²	89.5	32%	0.322	46%	0.457	S	S	.	.	S	Bend	trans	-89.1	159.8	-170.4	-59.7	-57.7	-59.1	0	0	113	I184 P185 R192 L195	I184-Q187 WeakPolarHBondContact O-CB 3.47Å; I184-Q187 PolarHBondContact O-N 3.42Å; P185-Q187 VanDerWaalsContact C-N 3.3Å; P185-Q187 PolarHBondContact O-N 2.63Å; Q187-R192 HydrophobicContact CB-CG 4.49Å; Q187-R192 PolarHBondContact O-NE 2.92Å; Q187-L195 HydrophobicContact CB-CD1 3.99Å; Q187-L195 HydrophobicContact CG-CD1 3.83Å
188	P	91.4	Very high	92.6	Very high	66 Å²	66	93.2 Å²	93.2	43%	0.429	47%	0.474	S	S	.	.			trans	-60.9	144.7	177.8	-22.2	34	0	0	0	112.9	S190 Q191 R192	P188-S190 VanDerWaalsContact C-N 3.28Å; P188-S190 PolarHBondContact O-N 2.95Å; P188-Q191 PolarHBondContact O-N 3.42Å; P188-R192 PolarHBondContact O-N 2.96Å
189	E	84.5	Confident	92.6	Very high	153 Å²	153	90 Å²	90	72%	0.715	46%	0.46	S	S	*	.	H	α-helix	trans	-58.8	-36.3	-174.3	-73	-179.2	162.5	0	0	113.9	Q191 R192	E189-Q191 PolarHBondContact O-N 3.1Å; E189-Q191 VanDerWaalsContact O-N 3.15Å; E189-R192 PolarHBondContact O-N 2.95Å; E189-R192 IonicContact OE1-NH1 3.12Å; E189-R192 PolarHBondContact OE1-NH1 3.29Å; E189-R192 VanDerWaalsContact OE1-NH1 3.12Å
190	S	88.5	Confident	92.7	Very high	110 Å²	110	88.6 Å²	88.6	77%	0.769	45%	0.453	S	S	*	.	H	α-helix	trans	-66.4	-9.7	174.8	53.9	0	0	0	0	114.9	P188	P188-S190 VanDerWaalsContact C-N 3.28Å; P188-S190 PolarHBondContact O-N 2.95Å
191	Q	90.3	Very high	92.8	Very high	91 Å²	91	92.7 Å²	92.7	43%	0.425	48%	0.475	S	S	.	.	H	α-helix	trans	-115.8	-22.8	178.3	-65.7	178.4	-12.4	0	0	112.8	P188 E189 E193 Q194 L195	P188-Q191 PolarHBondContact O-N 3.42Å; E189-Q191 PolarHBondContact O-N 3.1Å; E189-Q191 VanDerWaalsContact O-N 3.15Å; Q191-E193 VanDerWaalsContact C-N 3.33Å; Q191-E193 PolarHBondContact O-N 3.03Å; Q191-Q194 PolarHBondContact O-N 3.36Å; Q191-L195 HydrophobicContact CB-CD1 4.38Å; Q191-L195 WeakPolarHBondContact O-CG 3.46Å; Q191-L195 PolarHBondContact O-N 3.36Å
192	R	91.9	Very high	92.9	Very high	85 Å²	85	92.5 Å²	92.5	32%	0.321	47%	0.474	S	S	.	.	H	α-helix	trans	-53.3	-45.6	-179.5	-77.3	-179.1	-176.7	159.5	-3.1	113	I184 P185 Q187 P188 E189 L195 T196	I184-R192 HydrophobicContact CG2-CG 4.49Å; P185-R192 PolarHBondContact O-NH2 2.98Å; Q187-R192 HydrophobicContact CB-CG 4.49Å; Q187-R192 PolarHBondContact O-NE 2.92Å; P188-R192 PolarHBondContact O-N 2.96Å; E189-R192 PolarHBondContact O-N 2.95Å; E189-R192 IonicContact OE1-NH1 3.12Å; E189-R192 PolarHBondContact OE1-NH1 3.29Å; E189-R192 VanDerWaalsContact OE1-NH1 3.12Å; R192-L195 PolarHBondContact O-N 3.33Å; R192-T196 WeakPolarHBondContact O-CB 3.44Å; R192-T196 PolarHBondContact O-N 2.69Å; R192-T196 PolarHBondContact O-OG1 3.11Å
193	E	90.5	Very high	93	Very high	165 Å²	165	88.1 Å²	88.1	77%	0.771	46%	0.455	S	S	*	.	H	α-helix	trans	-63.9	-46	-177.6	-172.3	171.1	-155.8	0	0	111.8	Q191 L195 T196 L197	Q191-E193 VanDerWaalsContact C-N 3.33Å; Q191-E193 PolarHBondContact O-N 3.03Å; E193-L195 PolarHBondContact O-N 2.67Å; E193-T196 PolarHBondContact O-N 3.16Å; E193-L197 PolarHBondContact O-N 2.86Å
194	Q	93.1	Very high	93.2	Very high	125 Å²	125	87.9 Å²	87.9	58%	0.584	45%	0.451	S	S	*	.	H	α-helix	trans	-61.5	-44.9	176.1	-176.4	179.6	3.1	0	0	112.1	Q191 T196 L197 Q198	Q191-Q194 PolarHBondContact O-N 3.36Å; Q194-T196 VanDerWaalsContact C-N 3.32Å; Q194-T196 PolarHBondContact O-N 2.93Å; Q194-L197 PolarHBondContact O-N 2.85Å; Q194-Q198 WeakPolarHBondContact O-CG 3.43Å; Q194-Q198 PolarHBondContact O-N 2.67Å
195	L	93.6	Very high	93.4	Very high	52 Å²	52	89.1 Å²	89.1	27%	0.272	47%	0.468	S	S	.	.	H	α-helix	trans	-67.7	-32.8	178.5	-66.5	170.2	0	0	0	112.2	I184 Q187 Q191 R192 E193 Q198 L199	I184-L195 HydrophobicContact CD1-CB 4.23Å; I184-L195 WeakPolarHBondContact CD1-O 3.41Å; I184-L195 HydrophobicContact CG1-CB 3.97Å; Q187-L195 HydrophobicContact CB-CD1 3.99Å; Q187-L195 HydrophobicContact CG-CD1 3.83Å; Q191-L195 HydrophobicContact CB-CD1 4.38Å; Q191-L195 WeakPolarHBondContact O-CG 3.46Å; Q191-L195 PolarHBondContact O-N 3.36Å; R192-L195 PolarHBondContact O-N 3.33Å; E193-L195 PolarHBondContact O-N 2.67Å; L195-Q198 PolarHBondContact O-N 3.38Å; L195-L199 WeakPolarHBondContact O-CB 2.97Å; L195-L199 PolarHBondContact O-N 3.15Å
196	T	94	Very high	93.7	Very high	72 Å²	72	86.1 Å²	86.1	44%	0.442	45%	0.447	S	S	.	.	H	α-helix	trans	-68	-41.3	175.2	-54.8	0	0	0	0	111.1	R192 E193 Q194 L199 Q200	R192-T196 WeakPolarHBondContact O-CB 3.44Å; R192-T196 PolarHBondContact O-N 2.69Å; R192-T196 PolarHBondContact O-OG1 3.11Å; E193-T196 PolarHBondContact O-N 3.16Å; Q194-T196 VanDerWaalsContact C-N 3.32Å; Q194-T196 PolarHBondContact O-N 2.93Å; T196-L199 PolarHBondContact O-N 3.33Å; T196-Q200 WeakPolarHBondContact O-CB 3.43Å; T196-Q200 PolarHBondContact O-N 2.99Å
197	L	95.2	Very high	94	Very high	128 Å²	128	86.4 Å²	86.4	67%	0.67	44%	0.439	S	S	*	.	H	α-helix	trans	-64.5	-39.8	175	-172.9	65.1	0	0	0	112.1	E193 Q194 Q200 Q201	E193-L197 PolarHBondContact O-N 2.86Å; Q194-L197 PolarHBondContact O-N 2.85Å; L197-Q200 PolarHBondContact O-N 3.04Å; L197-Q201 PolarHBondContact O-N 2.82Å
198	Q	95.3	Very high	94.3	Very high	81 Å²	81	85.4 Å²	85.4	38%	0.379	44%	0.443	S	S	.	.	H	α-helix	trans	-66.3	-37.7	173.9	-72.4	175.6	-18.9	0	0	112.5	R180 Q194 L195 E202	R180-Q198 PolarHBondContact NH1-O 3.39Å; Q194-Q198 WeakPolarHBondContact O-CG 3.43Å; Q194-Q198 PolarHBondContact O-N 2.67Å; L195-Q198 PolarHBondContact O-N 3.38Å; Q198-E202 PolarHBondContact O-N 2.85Å
199	L	95.9	Very high	94.6	Very high	8 Å²	8	83.7 Å²	83.7	4%	0.042	43%	0.434	C	S	.	.	H	α-helix	trans	-63.3	-44.6	172.4	174.6	64.3	0	0	0	111.4	C177 E181 I184 L195 T196 Q201 E202 K203	C177-L199 HydrophobicContact CB-CD1 4.33Å; C177-L199 WeakPolarHBondContact O-CD1 3.32Å; E181-L199 HydrophobicContact CB-CD1 4.47Å; E181-L199 HydrophobicContact CB-CD2 3.58Å; E181-L199 HydrophobicContact CG-CD2 3.86Å; I184-L199 HydrophobicContact CD1-CB 3.86Å; I184-L199 HydrophobicContact CD1-CD2 3.65Å; I184-L199 HydrophobicContact CD1-CG 4.39Å; L195-L199 WeakPolarHBondContact O-CB 2.97Å; L195-L199 PolarHBondContact O-N 3.15Å; T196-L199 PolarHBondContact O-N 3.33Å; L199-Q201 PolarHBondContact O-N 2.96Å; L199-E202 PolarHBondContact O-N 3.47Å; L199-K203 HydrophobicContact CD1-CD 4.33Å; L199-K203 HydrophobicContact CD1-CG 4.14Å; L199-K203 HydrophobicContact CG-CD 4.18Å; L199-K203 HydrophobicContact CG-CG 4.39Å; L199-K203 WeakPolarHBondContact O-CB 3.47Å; L199-K203 WeakPolarHBondContact O-CG 3.29Å; L199-K203 PolarHBondContact O-N 3.05Å
200	Q	97.1	Very high	95.3	Very high	90 Å²	90	78.9 Å²	78.9	42%	0.421	41%	0.413	S	S	.	.	H	α-helix	trans	-59.8	-46.5	178.9	-177.7	58	29.9	0	0	111.6	T196 L197 E202 K203 E204	T196-Q200 WeakPolarHBondContact O-CB 3.43Å; T196-Q200 PolarHBondContact O-N 2.99Å; L197-Q200 PolarHBondContact O-N 3.04Å; Q200-E202 VanDerWaalsContact C-N 3.35Å; Q200-E202 PolarHBondContact O-N 3.06Å; Q200-K203 PolarHBondContact O-N 3.35Å; Q200-E204 WeakPolarHBondContact CG-OE1 3.26Å; Q200-E204 PolarHBondContact NE2-OE1 2.64Å; Q200-E204 WeakPolarHBondContact O-CG 3.27Å; Q200-E204 PolarHBondContact O-N 3.42Å
201	Q	97.4	Very high	95.7	Very high	141 Å²	141	79.5 Å²	79.5	66%	0.659	40%	0.398	S	S	*	.	H	α-helix	trans	-61.1	-40.3	177.5	-172.7	179.8	9.8	0	0	112.9	L197 L199 G205	L197-Q201 PolarHBondContact O-N 2.82Å; L199-Q201 PolarHBondContact O-N 2.96Å; Q201-G205 PolarHBondContact O-N 2.62Å
202	E	96.2	Very high	96	Very high	84 Å²	84	77.9 Å²	77.9	39%	0.393	40%	0.401	S	S	.	.	H	α-helix	trans	-73.5	-33	176.9	-79.4	173.2	-109.1	0	0	112.9	R180 Q198 L199 Q200 G205 M206	R180-E202 IonicContact CZ-OE1 2.73Å; R180-E202 IonicContact CZ-OE2 2.83Å; R180-E202 IonicContact NE-OE1 2.71Å; R180-E202 IonicContact NE-OE2 2.83Å; R180-E202 IonicContact NH1-OE1 2.77Å; R180-E202 PolarHBondContact NH1-OE1 3.05Å; R180-E202 IonicContact NH1-OE2 3.24Å; R180-E202 VanDerWaalsContact NH2-CB 3.26Å; R180-E202 IonicContact NH2-OE1 3.18Å; R180-E202 PolarHBondContact NH2-OE1 3.24Å; R180-E202 IonicContact NH2-OE2 3.47Å; R180-E202 PolarHBondContact NH2-OE2 3.02Å; Q198-E202 PolarHBondContact O-N 2.85Å; L199-E202 PolarHBondContact O-N 3.47Å; Q200-E202 VanDerWaalsContact C-N 3.35Å; Q200-E202 PolarHBondContact O-N 3.06Å; E202-G205 PolarHBondContact O-N 3.29Å; E202-M206 WeakPolarHBondContact O-CB 3.31Å; E202-M206 PolarHBondContact O-N 2.93Å
203	K	97.4	Very high	96.3	Very high	43 Å²	43	74.5 Å²	74.5	19%	0.187	39%	0.388	C	S	.	.	H	α-helix	trans	-62	-45.4	170.1	-78.4	-178.1	171.2	-168.4	0	111.3	C177 E181 L199 Q200 G205 M206 E207	C177-K203 HydrophobicContact CB-CG 4.39Å; E181-K203 IonicContact OE1-NZ 2.7Å; E181-K203 PolarHBondContact OE1-NZ 3.08Å; E181-K203 WeakPolarHBondContact OE2-CE 3.31Å; E181-K203 IonicContact OE2-NZ 3.13Å; E181-K203 PolarHBondContact OE2-NZ 3.5Å; L199-K203 HydrophobicContact CD1-CD 4.33Å; L199-K203 HydrophobicContact CD1-CG 4.14Å; L199-K203 HydrophobicContact CG-CD 4.18Å; L199-K203 HydrophobicContact CG-CG 4.39Å; L199-K203 WeakPolarHBondContact O-CB 3.47Å; L199-K203 WeakPolarHBondContact O-CG 3.29Å; L199-K203 PolarHBondContact O-N 3.05Å; Q200-K203 PolarHBondContact O-N 3.35Å; K203-G205 VanDerWaalsContact C-N 3.32Å; K203-G205 PolarHBondContact O-N 2.9Å; K203-M206 WeakPolarHBondContact O-CB 3.47Å; K203-M206 PolarHBondContact O-N 3.35Å; K203-E207 WeakPolarHBondContact O-CG 3.37Å; K203-E207 PolarHBondContact O-N 2.99Å
204	E	97.8	Very high	96.7	Very high	100 Å²	100	71 Å²	71	47%	0.467	37%	0.372	S	S	.	.	H	α-helix	trans	-61.1	-40.2	175.6	-72.8	167.3	-166.5	0	0	112	Q200 E207 A208	Q200-E204 WeakPolarHBondContact CG-OE1 3.26Å; Q200-E204 PolarHBondContact NE2-OE1 2.64Å; Q200-E204 WeakPolarHBondContact O-CG 3.27Å; Q200-E204 PolarHBondContact O-N 3.42Å; E204-E207 PolarHBondContact O-N 3.11Å; E204-A208 WeakPolarHBondContact O-CB 3.45Å; E204-A208 PolarHBondContact O-N 2.66Å
205	G	97.4	Very high	96.8	Very high	43 Å²	43	69.6 Å²	69.6	44%	0.443	37%	0.369	S	S	.	.	H	α-helix	trans	-65	-40.5	173.4	0	0	0	0	0	113.6	Q201 E202 K203 A208 A209	Q201-G205 PolarHBondContact O-N 2.62Å; E202-G205 PolarHBondContact O-N 3.29Å; K203-G205 VanDerWaalsContact C-N 3.32Å; K203-G205 PolarHBondContact O-N 2.9Å; G205-A208 PolarHBondContact O-N 3.35Å; G205-A209 PolarHBondContact O-N 2.83Å
206	M	97.5	Very high	96.9	Very high	22 Å²	22	70 Å²	70	11%	0.108	37%	0.367	C	S	.	.	H	α-helix	trans	-64.1	-46.5	173.5	174.3	-163	73.4	0	0	111.6	L173 K174 C177 E202 K203 A208 A209 I210	L173-M206 HydrophobicContact CD2-CB 3.77Å; L173-M206 HydrophobicContact CD2-CG 3.99Å; L173-M206 HydrophobicContact CG-CB 4.01Å; L173-M206 HydrophobicContact CG-CG 4.01Å; K174-M206 WeakPolarHBondContact CA-SD 3.25Å; K174-M206 HydrophobicContact CB-SD 3.8Å; K174-M206 HydrophobicContact CG-SD 4.26Å; C177-M206 HydrophobicContact CB-SD 4.28Å; E202-M206 WeakPolarHBondContact O-CB 3.31Å; E202-M206 PolarHBondContact O-N 2.93Å; K203-M206 WeakPolarHBondContact O-CB 3.47Å; K203-M206 PolarHBondContact O-N 3.35Å; M206-A208 VanDerWaalsContact C-N 3.32Å; M206-A208 PolarHBondContact O-N 2.92Å; M206-A209 WeakPolarHBondContact O-CB 3Å; M206-A209 PolarHBondContact O-N 3.4Å; M206-A209 VanDerWaalsContact O-N 3.12Å; M206-I210 HydrophobicContact CE-CD1 4.44Å; M206-I210 HydrophobicContact CG-CD1 4.06Å; M206-I210 WeakPolarHBondContact O-CG1 3.48Å; M206-I210 PolarHBondContact O-N 3.44Å
207	E	97.8	Very high	96.9	Very high	87 Å²	87	69.1 Å²	69.1	41%	0.407	36%	0.357	S	S	.	.	H	α-helix	trans	-62.8	-37.3	177	-75	-179.5	-157.5	0	0	112.6	K203 E204 A209 I210 R211	K203-E207 WeakPolarHBondContact O-CG 3.37Å; K203-E207 PolarHBondContact O-N 2.99Å; E204-E207 PolarHBondContact O-N 3.11Å; E207-A209 VanDerWaalsContact C-N 3.33Å; E207-I210 PolarHBondContact O-N 3.23Å; E207-R211 PolarHBondContact O-N 3.46Å; E207-R211 IonicContact OE2-NH1 3.54Å
208	A	97.8	Very high	96.9	Very high	48 Å²	48	69.2 Å²	69.2	40%	0.397	35%	0.353	S	S	.	.	H	α-helix	trans	-64.1	-38.2	172.7	0	0	0	0	0	111.9	E204 G205 M206 A212	E204-A208 WeakPolarHBondContact O-CB 3.45Å; E204-A208 PolarHBondContact O-N 2.66Å; G205-A208 PolarHBondContact O-N 3.35Å; M206-A208 VanDerWaalsContact C-N 3.32Å; M206-A208 PolarHBondContact O-N 2.92Å; A208-A212 WeakPolarHBondContact O-CB 3.39Å; A208-A212 PolarHBondContact O-N 2.89Å
209	A	97.6	Very high	96.6	Very high	30 Å²	30	72.2 Å²	72.2	25%	0.248	36%	0.36	C	S	.	.	H	α-helix	trans	-70.3	-35.3	175.1	0	0	0	0	0	112.8	L170 G205 M206 E207 F213	L170-A209 HydrophobicContact CD2-CB 3.6Å; G205-A209 PolarHBondContact O-N 2.83Å; M206-A209 WeakPolarHBondContact O-CB 3Å; M206-A209 PolarHBondContact O-N 3.4Å; M206-A209 VanDerWaalsContact O-N 3.12Å; E207-A209 VanDerWaalsContact C-N 3.33Å; A209-F213 WeakPolarHBondContact O-CB 3.1Å; A209-F213 PolarHBondContact O-N 2.75Å; A209-F213 VanDerWaalsContact O-N 3.08Å
210	I	97.9	Very high	96.3	Very high	51 Å²	51	72.1 Å²	72.1	26%	0.262	36%	0.36	S	S	.	.	H	α-helix	trans	-62.1	-50.9	172.7	-69	166.6	0	0	0	110.2	L170 M206 E207 A212 F213 E214	L170-I210 HydrophobicContact CD1-CG1 4.29Å; L170-I210 HydrophobicContact CD2-CG1 4.14Å; M206-I210 HydrophobicContact CE-CD1 4.44Å; M206-I210 HydrophobicContact CG-CD1 4.06Å; M206-I210 WeakPolarHBondContact O-CG1 3.48Å; M206-I210 PolarHBondContact O-N 3.44Å; E207-I210 PolarHBondContact O-N 3.23Å; I210-A212 PolarHBondContact O-N 3.32Å; I210-F213 WeakPolarHBondContact O-CA 3.08Å; I210-F213 WeakPolarHBondContact O-CB 3.5Å; I210-F213 PolarHBondContact O-N 2.88Å; I210-E214 HydrophobicContact CG2-CG 4.37Å; I210-E214 WeakPolarHBondContact O-CG 3.19Å; I210-E214 PolarHBondContact O-N 2.81Å
211	R	98.1	Very high	96	Very high	123 Å²	123	72.6 Å²	72.6	46%	0.464	37%	0.365	S	S	.	.	H	α-helix	trans	-59	-44.7	177.7	-71.7	-175.9	-68.2	-95.3	-0.2	112.3	E207 F213 E214 D215	E207-R211 PolarHBondContact O-N 3.46Å; E207-R211 IonicContact OE2-NH1 3.54Å; R211-F213 PolarHBondContact O-N 3.15Å; R211-E214 PolarHBondContact O-N 3.28Å; R211-D215 WeakPolarHBondContact O-CB 3.36Å; R211-D215 PolarHBondContact O-N 3.37Å
212	A	97.4	Very high	95.5	Very high	58 Å²	58	70.6 Å²	70.6	48%	0.479	36%	0.356	S	S	.	.	H	α-helix	trans	-64	-24.2	177.1	0	0	0	0	0	113.9	A208 I210 W216	A208-A212 WeakPolarHBondContact O-CB 3.39Å; A208-A212 PolarHBondContact O-N 2.89Å; I210-A212 PolarHBondContact O-N 3.32Å; A212-W216 PolarHBondContact O-N 3.45Å
213	F	97.9	Very high	94.8	Very high	13 Å²	13	71.3 Å²	71.3	6%	0.057	36%	0.359	C	S	.	.	H	α-helix	trans	-81.8	-40.8	172.3	170.6	-97.6	0	0	0	112.1	L163 E166 R167 L170 A209 I210 R211 W216 E217	L163-F213 HydrophobicContact CB-CE2 4.43Å; L163-F213 HydrophobicContact CD2-CD2 4.45Å; L163-F213 HydrophobicContact CD2-CE2 3.86Å; L163-F213 WeakPolarHBondContact O-CE2 3.23Å; E166-F213 HydrophobicContact CB-CD2 3.92Å; E166-F213 HydrophobicContact CB-CE2 4.09Å; E166-F213 HydrophobicContact CG-CD2 3.84Å; E166-F213 HydrophobicContact CG-CE2 4.49Å; R167-F213 HydrophobicContact CB-CE1 4.45Å; R167-F213 HydrophobicContact CB-CE2 4.31Å; R167-F213 HydrophobicContact CB-CZ 3.81Å; R167-F213 HydrophobicContact CG-CE1 4.41Å; R167-F213 HydrophobicContact CG-CZ 4.19Å; L170-F213 HydrophobicContact CD1-CB 3.5Å; L170-F213 HydrophobicContact CD1-CD1 3.71Å; L170-F213 HydrophobicContact CD1-CD2 4.23Å; L170-F213 HydrophobicContact CD1-CG 3.54Å; A209-F213 WeakPolarHBondContact O-CB 3.1Å; A209-F213 PolarHBondContact O-N 2.75Å; A209-F213 VanDerWaalsContact O-N 3.08Å; I210-F213 WeakPolarHBondContact O-CA 3.08Å; I210-F213 WeakPolarHBondContact O-CB 3.5Å; I210-F213 PolarHBondContact O-N 2.88Å; R211-F213 PolarHBondContact O-N 3.15Å; F213-W216 HydrophobicContact CD2-CE3 4.18Å; F213-W216 HydrophobicContact CD2-CZ3 4.47Å; F213-W216 CarbonylContact O-C 3.6Å; F213-W216 WeakPolarHBondContact O-CA 3.41Å; F213-W216 PolarHBondContact O-N 3.29Å; F213-E217 HydrophobicContact CD1-CG 4.41Å; F213-E217 VanDerWaalsContact CE1-CD 3.48Å; F213-E217 HydrophobicContact CE1-CG 3.83Å; F213-E217 WeakPolarHBondContact CE1-OE2 3.46Å; F213-E217 HydrophobicContact CE2-CG 4.14Å; F213-E217 VanDerWaalsContact CZ-CD 3.44Å; F213-E217 HydrophobicContact CZ-CG 3.67Å; F213-E217 PolarHBondContact O-N 2.98Å
214	E	97.3	Very high	94.1	Very high	92 Å²	92	70.9 Å²	70.9	43%	0.43	36%	0.357	S	S	.	.	H	α-helix	trans	-57.2	-49.5	171.1	-68.4	170.4	152.9	0	0	110.3	I210 R211 W216 E217 F218	I210-E214 HydrophobicContact CG2-CG 4.37Å; I210-E214 WeakPolarHBondContact O-CG 3.19Å; I210-E214 PolarHBondContact O-N 2.81Å; R211-E214 PolarHBondContact O-N 3.28Å; E214-W216 PolarHBondContact O-N 3.4Å; E214-W216 VanDerWaalsContact O-N 3.09Å; E214-E217 PolarHBondContact O-N 2.9Å; E214-E217 VanDerWaalsContact O-N 3.12Å; E214-F218 WeakPolarHBondContact O-CD2 3.43Å; E214-F218 PolarHBondContact O-N 3Å
215	D	95.8	Very high	93.3	Very high	96 Å²	96	69.4 Å²	69.4	51%	0.513	36%	0.358	S	S	.	.	H	α-helix	trans	-57.4	-22.9	173.8	-68.1	-26.7	0	0	0	113.2	R211 R219	R211-D215 WeakPolarHBondContact O-CB 3.36Å; R211-D215 PolarHBondContact O-N 3.37Å; D215-R219 WeakPolarHBondContact O-CG 3.44Å; D215-R219 PolarHBondContact O-NE 3.29Å; D215-R219 PolarHBondContact O-NH2 3.32Å
216	W	95.3	Very high	92	Very high	61 Å²	61	68.9 Å²	68.9	23%	0.231	35%	0.353	C	S	.	.	H	α-helix	trans	-90.1	-40.4	174.6	179.6	28.2	0	0	0	112.1	R162 L163 E166 A212 F213 E214 F218 R219 V220	R162-W216 HydrophobicContact CB-CH2 3.67Å; R162-W216 HydrophobicContact CB-CZ2 4.03Å; L163-W216 HydrophobicContact CD2-CD2 3.53Å; L163-W216 HydrophobicContact CD2-CE3 3.61Å; L163-W216 HydrophobicContact CD2-CG 4.09Å; L163-W216 HydrophobicContact CD2-CH2 3.85Å; L163-W216 HydrophobicContact CD2-CZ2 3.79Å; L163-W216 HydrophobicContact CD2-CZ3 3.78Å; L163-W216 HydrophobicContact CG-CH2 4.17Å; L163-W216 HydrophobicContact CG-CZ2 4.03Å; E166-W216 HydrophobicContact CB-CZ3 3.88Å; E166-W216 HydrophobicContact CG-CZ3 4.24Å; A212-W216 PolarHBondContact O-N 3.45Å; F213-W216 HydrophobicContact CD2-CE3 4.18Å; F213-W216 HydrophobicContact CD2-CZ3 4.47Å; F213-W216 CarbonylContact O-C 3.6Å; F213-W216 WeakPolarHBondContact O-CA 3.41Å; F213-W216 PolarHBondContact O-N 3.29Å; E214-W216 PolarHBondContact O-N 3.4Å; E214-W216 VanDerWaalsContact O-N 3.09Å; W216-F218 VanDerWaalsContact C-N 3.28Å; W216-F218 PolarHBondContact O-N 3.42Å; W216-R219 PolarHBondContact O-N 2.91Å; W216-V220 WeakPolarHBondContact O-CG2 3.45Å; W216-V220 PolarHBondContact O-N 3.29Å
217	E	95.6	Very high	90	Very high	52 Å²	52	73.6 Å²	73.6	24%	0.243	38%	0.377	C	S	.	.	H	α-helix	trans	-56.7	-42.5	171.3	-74.4	-157.2	114.2	0	0	111.2	L163 R167 F213 E214 V220 L221	L163-E217 HydrophobicContact CD1-CG 4.4Å; L163-E217 HydrophobicContact CD2-CG 3.83Å; R167-E217 IonicContact CZ-OE1 3.58Å; R167-E217 VanDerWaalsContact CZ-OE1 3.28Å; R167-E217 IonicContact NH1-OE1 2.81Å; R167-E217 PolarHBondContact NH1-OE1 2.99Å; R167-E217 IonicContact NH1-OE2 3.97Å; R167-E217 PolarHBondContact NH1-OE2 2.94Å; R167-E217 IonicContact NH2-OE1 2.67Å; R167-E217 PolarHBondContact NH2-OE1 2.72Å; F213-E217 HydrophobicContact CD1-CG 4.41Å; F213-E217 VanDerWaalsContact CE1-CD 3.48Å; F213-E217 HydrophobicContact CE1-CG 3.83Å; F213-E217 WeakPolarHBondContact CE1-OE2 3.46Å; F213-E217 HydrophobicContact CE2-CG 4.14Å; F213-E217 VanDerWaalsContact CZ-CD 3.44Å; F213-E217 HydrophobicContact CZ-CG 3.67Å; F213-E217 PolarHBondContact O-N 2.98Å; E214-E217 PolarHBondContact O-N 2.9Å; E214-E217 VanDerWaalsContact O-N 3.12Å; E217-V220 PolarHBondContact O-N 2.71Å; E217-L221 VanDerWaalsContact O-CG 3.29Å; E217-L221 WeakPolarHBondContact O-CG 3.33Å; E217-L221 PolarHBondContact O-N 3.48Å
218	F	93.7	Very high	87.8	Confident	131 Å²	131	72.5 Å²	72.5	58%	0.575	39%	0.39	S	S	*	.	H	α-helix	trans	-59.1	-50.9	175	-77.6	-65	0	0	0	112.7	E214 W216 V220 L221 E222	E214-F218 WeakPolarHBondContact O-CD2 3.43Å; E214-F218 PolarHBondContact O-N 3Å; W216-F218 VanDerWaalsContact C-N 3.28Å; W216-F218 PolarHBondContact O-N 3.42Å; F218-V220 VanDerWaalsContact C-N 3.29Å; F218-V220 PolarHBondContact O-N 3.01Å; F218-L221 WeakPolarHBondContact O-CB 3.47Å; F218-L221 PolarHBondContact O-N 2.9Å; F218-E222 WeakPolarHBondContact O-CG 3.35Å; F218-E222 PolarHBondContact O-N 2.83Å
219	R	89.6	Confident	85.6	Confident	144 Å²	144	75 Å²	75	54%	0.543	39%	0.393	S	S	.	.	H	α-helix	trans	-62.2	-32.1	179.1	-75.3	177.9	-68.3	161.8	1.1	113.8	D215 W216 E222 Q223	D215-R219 WeakPolarHBondContact O-CG 3.44Å; D215-R219 PolarHBondContact O-NE 3.29Å; D215-R219 PolarHBondContact O-NH2 3.32Å; W216-R219 PolarHBondContact O-N 2.91Å; R219-E222 WeakPolarHBondContact CA-OE2 3.26Å; R219-Q223 WeakPolarHBondContact O-CB 3.25Å; R219-Q223 PolarHBondContact O-N 2.91Å; R219-Q223 VanDerWaalsContact O-N 3.11Å
220	V	90.6	Very high	83.4	Confident	5 Å²	5	82.3 Å²	82.3	3%	0.03	42%	0.422	C	S	.	.	H	α-helix	trans	-70.4	-39.6	173.4	176.4	0	0	0	0	110.9	E159 L163 W216 E217 F218 Q223 E224	E159-V220 HydrophobicContact CG-CG1 4.02Å; E159-V220 HydrophobicContact CG-CG2 3.71Å; L163-V220 HydrophobicContact CD1-CB 4.14Å; L163-V220 HydrophobicContact CD1-CG1 4Å; L163-V220 HydrophobicContact CD1-CG2 4.12Å; W216-V220 WeakPolarHBondContact O-CG2 3.45Å; W216-V220 PolarHBondContact O-N 3.29Å; E217-V220 PolarHBondContact O-N 2.71Å; F218-V220 VanDerWaalsContact C-N 3.29Å; F218-V220 PolarHBondContact O-N 3.01Å; V220-Q223 PolarHBondContact O-N 3.17Å; V220-E224 HydrophobicContact CG1-CG 4.4Å; V220-E224 WeakPolarHBondContact O-CB 3.4Å; V220-E224 WeakPolarHBondContact O-CG 3.5Å; V220-E224 PolarHBondContact O-N 3.44Å
221	L	90.5	Very high	80.9	Confident	101 Å²	101	87.6 Å²	87.6	53%	0.529	45%	0.451	S	S	.	.	H	α-helix	trans	-66.9	-37.9	176.4	-69.2	167.8	0	0	0	112.5	E217 F218 E224 S225	E217-L221 VanDerWaalsContact O-CG 3.29Å; E217-L221 WeakPolarHBondContact O-CG 3.33Å; E217-L221 PolarHBondContact O-N 3.48Å; F218-L221 WeakPolarHBondContact O-CB 3.47Å; F218-L221 PolarHBondContact O-N 2.9Å; L221-E224 PolarHBondContact O-N 2.89Å; L221-S225 VanDerWaalsContact O-CB 3.26Å; L221-S225 WeakPolarHBondContact O-CB 3.47Å; L221-S225 PolarHBondContact O-N 3.09Å; L221-S225 PolarHBondContact O-OG 3.28Å
222	E	85.8	Confident	79	Confident	99 Å²	99	90.3 Å²	90.3	46%	0.463	47%	0.469	S	S	.	.	H	α-helix	trans	-62.1	-45.6	172.3	-70.7	163.9	171.3	0	0	111.5	F218 R219 S225 G226 I227	F218-E222 WeakPolarHBondContact O-CG 3.35Å; F218-E222 PolarHBondContact O-N 2.83Å; R219-E222 WeakPolarHBondContact CA-OE2 3.26Å; E222-S225 PolarHBondContact O-N 3.32Å; E222-S225 PolarHBondContact O-OG 2.95Å; E222-G226 PolarHBondContact O-N 3.01Å; E222-I227 PolarHBondContact O-N 2.83Å
223	Q	81.8	Confident	76.4	Confident	98 Å²	98	95.4 Å²	95.4	46%	0.458	49%	0.488	S	S	.	.	H	α-helix	trans	-74.1	-23.3	178.3	-170.5	170.6	-26.6	0	0	113.1	R156 R219 V220	R156-Q223 PolarHBondContact NH2-O 3.03Å; R219-Q223 WeakPolarHBondContact O-CB 3.25Å; R219-Q223 PolarHBondContact O-N 2.91Å; R219-Q223 VanDerWaalsContact O-N 3.11Å; V220-Q223 PolarHBondContact O-N 3.17Å
224	E	83.8	Confident	74.1	Confident	34 Å²	34	98.6 Å²	98.6	16%	0.159	53%	0.525	C	S	.	.	H	α-helix	trans	-82.5	-28.2	173	-80.1	-162.5	133.7	0	0	114.1	R156 R160 V220 L221	R156-E224 HydrophobicContact CG-CG 4.11Å; R156-E224 PolarHBondContact NH1-O 3Å; R156-E224 PolarHBondContact NH2-O 3.2Å; R160-E224 IonicContact CZ-OE1 3.55Å; R160-E224 IonicContact CZ-OE2 3.94Å; R160-E224 VanDerWaalsContact CZ-OE2 3.31Å; R160-E224 IonicContact NE-OE1 2.74Å; R160-E224 PolarHBondContact NE-OE1 3.42Å; R160-E224 IonicContact NE-OE2 2.89Å; R160-E224 PolarHBondContact NE-OE2 2.93Å; R160-E224 IonicContact NH2-OE1 3.28Å; R160-E224 PolarHBondContact NH2-OE1 3Å; R160-E224 IonicContact NH2-OE2 2.8Å; R160-E224 PolarHBondContact NH2-OE2 2.71Å; V220-E224 HydrophobicContact CG1-CG 4.4Å; V220-E224 WeakPolarHBondContact O-CB 3.4Å; V220-E224 WeakPolarHBondContact O-CG 3.5Å; V220-E224 PolarHBondContact O-N 3.44Å; L221-E224 PolarHBondContact O-N 2.89Å
225	S	80.3	Confident	71.5	Confident	70 Å²	70	102.8 Å²	102.8	49%	0.49	54%	0.544	S	S	.	.	H	α-helix	trans	-86.3	-12.2	-177.6	54.2	0	0	0	0	114.9	L221 E222	L221-S225 VanDerWaalsContact O-CB 3.26Å; L221-S225 WeakPolarHBondContact O-CB 3.47Å; L221-S225 PolarHBondContact O-N 3.09Å; L221-S225 PolarHBondContact O-OG 3.28Å; E222-S225 PolarHBondContact O-N 3.32Å; E222-S225 PolarHBondContact O-OG 2.95Å
226	G	69.2	Low	69	Low	32 Å²	32	107.9 Å²	107.9	33%	0.33	57%	0.565	S	S	.	*	T	Hydrogen-bonded Turn	trans	75.8	30.4	-179.2	0	0	0	0	0	113.2	E222 E241	E222-G226 PolarHBondContact O-N 3.01Å; G226-E241 WeakPolarHBondContact CA-OE2 3.37Å
227	I	55.7	Low	66.6	Low	121 Å²	121	112.1 Å²	112.1	62%	0.621	59%	0.585	S	S	*	*			trans	-101.3	-22.9	-178.9	-62.7	177.8	0	0	0	111.3	E222 E229	E222-I227 PolarHBondContact O-N 2.83Å; I227-E229 VanDerWaalsContact C-N 3.27Å; I227-E229 PolarHBondContact O-N 3.09Å
228	G	51.4	Low	64.2	Low	64 Å²	64	114.6 Å²	114.6	66%	0.66	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	33.8	-175.9	0	0	0	0	0	117.7
229	E	52.6	Low	62.2	Low	100 Å²	100	116.2 Å²	116.2	47%	0.467	61%	0.612	S	S	.	*	T	Hydrogen-bonded Turn	trans	-110.1	-0.6	171.6	-78.4	-152.8	174.2	0	0	114.4	I227 E241 G242	I227-E229 VanDerWaalsContact C-N 3.27Å; I227-E229 PolarHBondContact O-N 3.09Å; E229-E241 PolarHBondContact OE1-N 3.49Å; E229-G242 PolarHBondContact OE1-N 3.21Å
230	E	50.3	Low	60.5	Low	184 Å²	184	113.9 Å²	113.9	86%	0.86	61%	0.608	S	S	*	*	S	Bend	trans	-110.5	-21.8	-174.3	-63.2	-157.8	145.8	0	0	117.8
231	D	45.9	Very low	58.8	Low	161 Å²	161	117.1 Å²	117.1	86%	0.861	62%	0.623	S	S	*	*			trans	-93.6	159.7	-174.7	-79.2	-51	0	0	0	115.3
232	E	59	Low	57.3	Low	181 Å²	181	114 Å²	114	85%	0.846	61%	0.614	S	S	*	*			trans	-83	169.3	-160.8	-64.4	-175.8	112.4	0	0	116.7
233	D	43.4	Very low	56.6	Low	164 Å²	164	112.1 Å²	112.1	88%	0.877	61%	0.61	S	S	*	*	S	Bend	trans	62.3	105.5	164	-73.3	-15.1	0	0	0	120.6
234	G	48.6	Very low	56.4	Low	81 Å²	81	110.1 Å²	110.1	84%	0.835	60%	0.6	S	S	*	*	S	Bend		137.2	-34.9	122.4	0	0	0	0	0	118.5
235	E	42.5	Very low	56.3	Low	179 Å²	179	109.6 Å²	109.6	84%	0.836	60%	0.604	S	S	*	*			trans	-132	137.7	-178.8	-69.7	-162.5	150.1	0	0	112.9	K237	E235-K237 PolarHBondContact O-N 3.08Å
236	E	43.8	Very low	56.6	Low	203 Å²	203	110.4 Å²	110.4	95%	0.949	60%	0.6	S	S	*	*			trans	-74.4	68.2	175.7	-68.1	-168.2	116.5	0	0	112.3
237	K	44.5	Very low	57.5	Low	150 Å²	150	109.9 Å²	109.9	65%	0.652	59%	0.589	S	S	*	*			trans	-66.1	127.8	156.8	-87.2	-170.7	174.1	-177.4	0	108.4	E235	E235-K237 PolarHBondContact O-N 3.08Å
238	P	45.5	Very low	59.2	Low	104 Å²	104	110.6 Å²	110.6	68%	0.675	59%	0.59	S	S	*	*			trans	-74.2	148.1	-170.3	29	-35.3	0	0	0	112.5	E240	P238-E240 PolarHBondContact O-N 2.71Å
239	K	51.6	Low	61.3	Low	165 Å²	165	114.6 Å²	114.6	72%	0.717	59%	0.589	S	S	*	*			trans	-67.7	59.4	-175.8	-58.9	174.7	179.7	-179.4	0	113.7	G242 T243	K239-G242 PolarHBondContact O-N 2.73Å; K239-T243 WeakPolarHBondContact O-CG2 3.4Å; K239-T243 PolarHBondContact O-N 2.77Å
240	E	54.8	Low	63.3	Low	96 Å²	96	111.8 Å²	111.8	45%	0.449	58%	0.576	S	S	.	*	H	α-helix	trans	-63.4	-45.5	-172.4	-77.2	-147.2	138	0	0	112.8	K152 P238 G242 T243 E244	K152-E240 WeakPolarHBondContact CE-OE2 3.45Å; K152-E240 IonicContact NZ-OE2 3.74Å; K152-E240 PolarHBondContact NZ-OE2 2.66Å; P238-E240 PolarHBondContact O-N 2.71Å; E240-G242 VanDerWaalsContact C-N 3.33Å; E240-T243 CarbonylContact O-C 3.58Å; E240-T243 WeakPolarHBondContact O-CA 3.31Å; E240-T243 PolarHBondContact O-N 2.87Å; E240-T243 PolarHBondContact O-OG1 3.04Å; E240-E244 PolarHBondContact O-N 2.84Å
241	E	53.3	Low	65.5	Low	73 Å²	73	104.3 Å²	104.3	34%	0.341	54%	0.542	S	S	.	.	H	α-helix	trans	-69	-37.9	-177.4	-53.6	-158.3	149.6	0	0	110.2	G226 E229 T243 E244 G245	G226-E241 WeakPolarHBondContact CA-OE2 3.37Å; E229-E241 PolarHBondContact OE1-N 3.49Å; E241-T243 VanDerWaalsContact C-N 3.3Å; E241-T243 PolarHBondContact O-N 3.43Å; E241-E244 PolarHBondContact O-N 3.39Å; E241-E244 VanDerWaalsContact O-N 3.16Å; E241-G245 PolarHBondContact O-N 3.39Å
242	G	60.3	Low	68	Low	34 Å²	34	100.1 Å²	100.1	35%	0.351	53%	0.525	S	S	.	.	H	α-helix	trans	-49.9	-44.8	163.7	0	0	0	0	0	113.7	E229 K239 E240 E246	E229-G242 PolarHBondContact OE1-N 3.21Å; K239-G242 PolarHBondContact O-N 2.73Å; E240-G242 VanDerWaalsContact C-N 3.33Å; G242-E246 WeakPolarHBondContact O-CG 3.31Å; G242-E246 PolarHBondContact O-N 3.42Å; G242-E246 VanDerWaalsContact O-N 3.11Å
243	T	69.8	Low	69.8	Low	60 Å²	60	98.6 Å²	98.6	37%	0.368	51%	0.511	S	S	.	.	H	α-helix	trans	-74.8	-29.1	177.1	73.6	0	0	0	0	114.5	R148 K239 E240 E241 E246 M247	R148-T243 PolarHBondContact NH1-OG1 3.47Å; K239-T243 WeakPolarHBondContact O-CG2 3.4Å; K239-T243 PolarHBondContact O-N 2.77Å; E240-T243 CarbonylContact O-C 3.58Å; E240-T243 WeakPolarHBondContact O-CA 3.31Å; E240-T243 PolarHBondContact O-N 2.87Å; E240-T243 PolarHBondContact O-OG1 3.04Å; E241-T243 VanDerWaalsContact C-N 3.3Å; E241-T243 PolarHBondContact O-N 3.43Å; T243-E246 PolarHBondContact O-N 3.46Å; T243-M247 WeakPolarHBondContact O-CB 3.21Å; T243-M247 PolarHBondContact O-N 2.86Å
244	E	77.7	Confident	72.4	Confident	57 Å²	57	91.2 Å²	91.2	27%	0.266	47%	0.472	S	S	.	.	H	α-helix	trans	-74.1	-44.3	176.5	-71.7	-172.4	137.8	0	0	111.1	K152 E240 E241 E246 M247 E248	K152-E244 WeakPolarHBondContact CE-OE1 3.43Å; K152-E244 VanDerWaalsContact CE-OE2 3.23Å; K152-E244 WeakPolarHBondContact CE-OE2 3.36Å; K152-E244 VanDerWaalsContact NZ-CD 3.27Å; K152-E244 IonicContact NZ-OE1 2.99Å; K152-E244 IonicContact NZ-OE2 2.73Å; K152-E244 PolarHBondContact NZ-OE2 2.95Å; E240-E244 PolarHBondContact O-N 2.84Å; E241-E244 PolarHBondContact O-N 3.39Å; E241-E244 VanDerWaalsContact O-N 3.16Å; E244-E246 PolarHBondContact O-N 2.87Å; E244-M247 WeakPolarHBondContact O-CB 3.37Å; E244-M247 PolarHBondContact O-N 2.89Å; E244-E248 PolarHBondContact O-N 2.84Å
245	G	82.9	Confident	74.7	Confident	22 Å²	22	90.7 Å²	90.7	23%	0.227	45%	0.447	C	S	.	.	H	α-helix	trans	-60.8	-29.8	170.8	0	0	0	0	0	112.8	E241 K249	E241-G245 PolarHBondContact O-N 3.39Å; G245-K249 WeakPolarHBondContact O-CD 3.42Å; G245-K249 WeakPolarHBondContact O-CE 3.35Å; G245-K249 WeakPolarHBondContact O-CG 3.36Å; G245-K249 PolarHBondContact O-N 2.89Å; G245-K249 PolarHBondContact O-NZ 3.27Å
246	E	85.6	Confident	77.3	Confident	87 Å²	87	87.9 Å²	87.9	41%	0.407	43%	0.434	S	S	.	.	H	α-helix	trans	-74.6	-37.5	168.6	-77.7	-163.8	176.6	0	0	113.5	G242 T243 E244 K249 E250 R492	G242-E246 WeakPolarHBondContact O-CG 3.31Å; G242-E246 PolarHBondContact O-N 3.42Å; G242-E246 VanDerWaalsContact O-N 3.11Å; T243-E246 PolarHBondContact O-N 3.46Å; E244-E246 PolarHBondContact O-N 2.87Å; E246-K249 PolarHBondContact O-N 3.24Å; E246-E250 WeakPolarHBondContact O-CB 3.38Å; E246-E250 PolarHBondContact O-N 2.92Å; E246-R492 VanDerWaalsContact CD-NH1 3.27Å; E246-R492 VanDerWaalsContact CD-NH2 3.33Å; E246-R492 IonicContact OE1-CZ 3.93Å; E246-R492 IonicContact OE1-NH1 3.28Å; E246-R492 PolarHBondContact OE1-NH1 3.43Å; E246-R492 IonicContact OE1-NH2 3.25Å; E246-R492 IonicContact OE2-CZ 2.84Å; E246-R492 IonicContact OE2-NH1 3.27Å; E246-R492 PolarHBondContact OE2-NH1 2.8Å; E246-R492 VanDerWaalsContact OE2-NH1 3.15Å; E246-R492 IonicContact OE2-NH2 3.58Å; E246-R492 PolarHBondContact OE2-NH2 2.93Å
247	M	88.9	Confident	79.9	Confident	21 Å²	21	80.7 Å²	80.7	10%	0.103	40%	0.404	C	S	.	.	H	α-helix	trans	-64.7	-43.5	177.7	-177	169.5	-72.1	0	0	111.9	Q144 A145 T243 E244 E250 I251	Q144-M247 HydrophobicContact CB-CE 4.42Å; Q144-M247 HydrophobicContact CB-SD 4.5Å; Q144-M247 HydrophobicContact CG-CE 3.88Å; Q144-M247 HydrophobicContact CG-SD 4.45Å; Q144-M247 VanDerWaalsContact OE1-CE 3.31Å; A145-M247 HydrophobicContact CB-SD 3.83Å; T243-M247 WeakPolarHBondContact O-CB 3.21Å; T243-M247 PolarHBondContact O-N 2.86Å; E244-M247 WeakPolarHBondContact O-CB 3.37Å; E244-M247 PolarHBondContact O-N 2.89Å; M247-E250 PolarHBondContact O-N 2.94Å; M247-I251 HydrophobicContact CG-CD1 4.08Å; M247-I251 WeakPolarHBondContact O-CG1 3.23Å; M247-I251 PolarHBondContact O-N 2.87Å
248	E	91.8	Very high	82.5	Confident	137 Å²	137	73.9 Å²	73.9	64%	0.64	38%	0.375	S	S	*	.	H	α-helix	trans	-66.1	-38.2	177.1	-171.2	178.7	-147.4	0	0	112.1	E244 E250 I251 S252	E244-E248 PolarHBondContact O-N 2.84Å; E248-E250 VanDerWaalsContact C-N 3.33Å; E248-E250 PolarHBondContact O-N 3.37Å; E248-I251 PolarHBondContact O-N 3.49Å; E248-S252 WeakPolarHBondContact O-CB 3.44Å; E248-S252 PolarHBondContact O-N 3.2Å; E248-S252 PolarHBondContact O-OG 3.42Å
249	K	93.8	Very high	85	Confident	148 Å²	148	72.3 Å²	72.3	64%	0.643	36%	0.361	S	S	*	.	H	α-helix	trans	-63	-38.8	172.1	-70.8	163.1	-157.3	150.9	0	111.3	G245 E246 R253	G245-K249 WeakPolarHBondContact O-CD 3.42Å; G245-K249 WeakPolarHBondContact O-CE 3.35Å; G245-K249 WeakPolarHBondContact O-CG 3.36Å; G245-K249 PolarHBondContact O-N 2.89Å; G245-K249 PolarHBondContact O-NZ 3.27Å; E246-K249 PolarHBondContact O-N 3.24Å; K249-R253 WeakPolarHBondContact O-CB 3.42Å; K249-R253 PolarHBondContact O-N 3.28Å
250	E	95.4	Very high	87.2	Confident	40 Å²	40	67.3 Å²	67.3	19%	0.187	34%	0.344	C	S	.	.	H	α-helix	trans	-71.4	-39.4	175.7	179.7	61.2	-174.1	0	0	112.7	K137 L141 E246 M247 E248 R253 Q254	K137-E250 IonicContact NZ-OE1 3.32Å; K137-E250 PolarHBondContact NZ-OE1 3.39Å; L141-E250 HydrophobicContact CD1-CG 3.79Å; L141-E250 HydrophobicContact CD2-CG 4.4Å; E246-E250 WeakPolarHBondContact O-CB 3.38Å; E246-E250 PolarHBondContact O-N 2.92Å; M247-E250 PolarHBondContact O-N 2.94Å; E248-E250 VanDerWaalsContact C-N 3.33Å; E248-E250 PolarHBondContact O-N 3.37Å; E250-R253 VanDerWaalsContact CD-NH2 3.27Å; E250-R253 PolarHBondContact O-N 2.95Å; E250-R253 IonicContact OE1-CZ 3.31Å; E250-R253 IonicContact OE1-NE 3.36Å; E250-R253 IonicContact OE1-NH2 2.93Å; E250-R253 PolarHBondContact OE1-NH2 3.18Å; E250-R253 IonicContact OE2-CZ 3.03Å; E250-R253 IonicContact OE2-NE 2.72Å; E250-R253 PolarHBondContact OE2-NE 2.84Å; E250-R253 IonicContact OE2-NH2 2.7Å; E250-R253 PolarHBondContact OE2-NH2 3.28Å; E250-Q254 WeakPolarHBondContact O-CG 3.27Å; E250-Q254 PolarHBondContact O-N 2.89Å; E250-Q254 PolarHBondContact OE1-NE2 3.37Å
251	I	97.2	Very high	89.1	Confident	28 Å²	28	63.3 Å²	63.3	14%	0.144	33%	0.328	C	S	.	.	H	α-helix	trans	-58.4	-50.1	171.7	-72.6	166.5	0	0	0	109.7	L138 L141 Q142 A145 M247 E248 R253 Q254 Q255	L138-I251 HydrophobicContact CD1-CG2 3.99Å; L141-I251 HydrophobicContact CB-CD1 4.28Å; L141-I251 HydrophobicContact CB-CG1 3.63Å; L141-I251 HydrophobicContact CD1-CG1 4.48Å; Q142-I251 HydrophobicContact CG-CD1 4.47Å; Q142-I251 HydrophobicContact CG-CG2 4.07Å; A145-I251 HydrophobicContact CB-CD1 4.02Å; M247-I251 HydrophobicContact CG-CD1 4.08Å; M247-I251 WeakPolarHBondContact O-CG1 3.23Å; M247-I251 PolarHBondContact O-N 2.87Å; E248-I251 PolarHBondContact O-N 3.49Å; I251-R253 VanDerWaalsContact C-N 3.3Å; I251-R253 PolarHBondContact O-N 3.35Å; I251-Q254 PolarHBondContact O-N 3.38Å; I251-Q255 WeakPolarHBondContact O-CB 3.34Å; I251-Q255 PolarHBondContact O-N 3Å
252	S	97.5	Very high	91.2	Very high	73 Å²	73	64.3 Å²	64.3	51%	0.51	33%	0.332	S	S	.	.	H	α-helix	trans	-58.8	-40.6	176.8	-60.5	0	0	0	0	112.1	E248 Q255 H256	E248-S252 WeakPolarHBondContact O-CB 3.44Å; E248-S252 PolarHBondContact O-N 3.2Å; E248-S252 PolarHBondContact O-OG 3.42Å; S252-Q255 PolarHBondContact O-N 2.79Å; S252-H256 PolarHBondContact O-N 2.66Å; S252-H256 VanDerWaalsContact O-N 3.08Å
253	R	96.8	Very high	93	Very high	148 Å²	148	68.1 Å²	68.1	56%	0.558	34%	0.341	S	S	*	.	H	α-helix	trans	-65	-45.4	175.6	-169.8	175.2	72.1	123.5	-1.8	112.3	K249 E250 I251 H256 V257	K249-R253 WeakPolarHBondContact O-CB 3.42Å; K249-R253 PolarHBondContact O-N 3.28Å; E250-R253 VanDerWaalsContact CD-NH2 3.27Å; E250-R253 PolarHBondContact O-N 2.95Å; E250-R253 IonicContact OE1-CZ 3.31Å; E250-R253 IonicContact OE1-NE 3.36Å; E250-R253 IonicContact OE1-NH2 2.93Å; E250-R253 PolarHBondContact OE1-NH2 3.18Å; E250-R253 IonicContact OE2-CZ 3.03Å; E250-R253 IonicContact OE2-NE 2.72Å; E250-R253 PolarHBondContact OE2-NE 2.84Å; E250-R253 IonicContact OE2-NH2 2.7Å; E250-R253 PolarHBondContact OE2-NH2 3.28Å; I251-R253 VanDerWaalsContact C-N 3.3Å; I251-R253 PolarHBondContact O-N 3.35Å; R253-H256 PolarHBondContact O-N 3.38Å; R253-V257 WeakPolarHBondContact O-CG2 3.4Å; R253-V257 PolarHBondContact O-N 3Å; R253-V257 VanDerWaalsContact O-N 3.16Å
254	Q	97.5	Very high	94.3	Very high	9 Å²	9	70.1 Å²	70.1	4%	0.042	34%	0.342	C	S	.	.	H	α-helix	trans	-67.7	-36.7	176.8	-65.1	-54.4	-41.1	0	0	111.8	H134 K137 L138 L141 E250 I251 H256 V257 V258	H134-Q254 PolarHBondContact ND1-OE1 3.06Å; H134-Q254 VanDerWaalsContact ND1-OE1 3.07Å; K137-Q254 HydrophobicContact CD-CG 4.19Å; L138-Q254 HydrophobicContact CB-CB 4.26Å; L138-Q254 HydrophobicContact CD1-CB 4.12Å; L141-Q254 HydrophobicContact CD1-CG 3.84Å; E250-Q254 WeakPolarHBondContact O-CG 3.27Å; E250-Q254 PolarHBondContact O-N 2.89Å; E250-Q254 PolarHBondContact OE1-NE2 3.37Å; I251-Q254 PolarHBondContact O-N 3.38Å; Q254-H256 VanDerWaalsContact C-N 3.35Å; Q254-H256 PolarHBondContact O-N 3.01Å; Q254-V257 PolarHBondContact O-N 3.39Å; Q254-V258 WeakPolarHBondContact O-CG2 3.43Å; Q254-V258 PolarHBondContact O-N 2.93Å
255	Q	98.1	Very high	95.3	Very high	70 Å²	70	67.9 Å²	67.9	33%	0.327	33%	0.332	S	S	.	.	H	α-helix	trans	-59.7	-43.7	174.6	-175.8	66.6	77.3	0	0	111.6	L138 I251 S252 V258 N259	L138-Q255 HydrophobicContact CD1-CB 4.21Å; L138-Q255 HydrophobicContact CD2-CB 4.38Å; I251-Q255 WeakPolarHBondContact O-CB 3.34Å; I251-Q255 PolarHBondContact O-N 3Å; S252-Q255 PolarHBondContact O-N 2.79Å; Q255-V258 PolarHBondContact O-N 2.93Å; Q255-N259 PolarHBondContact NE2-OD1 2.98Å; Q255-N259 PolarHBondContact O-N 3.41Å; Q255-N259 PolarHBondContact O-OD1 3.22Å; Q255-N259 VanDerWaalsContact O-OD1 3.06Å
256	H	97.7	Very high	96	Very high	120 Å²	120	72.2 Å²	72.2	56%	0.556	35%	0.347	S	S	*	.	H	α-helix	trans	-63.4	-43.3	175.6	-176.7	38.7	0	0	0	112.1	S252 R253 Q254 V258 N259 T260	S252-H256 PolarHBondContact O-N 2.66Å; S252-H256 VanDerWaalsContact O-N 3.08Å; R253-H256 PolarHBondContact O-N 3.38Å; Q254-H256 VanDerWaalsContact C-N 3.35Å; Q254-H256 PolarHBondContact O-N 3.01Å; H256-V258 PolarHBondContact O-N 2.97Å; H256-N259 PolarHBondContact O-N 3.42Å; H256-T260 PolarHBondContact O-N 3.45Å; H256-T260 PolarHBondContact O-OG1 3.29Å
257	V	97.8	Very high	96.6	Very high	53 Å²	53	72.2 Å²	72.2	32%	0.321	35%	0.346	S	S	.	.	H	α-helix	trans	-62	-42.9	176.3	173.5	0	0	0	0	111.8	H134 R253 Q254 A261	H134-V257 HydrophobicContact CB-CG1 4.39Å; R253-V257 WeakPolarHBondContact O-CG2 3.4Å; R253-V257 PolarHBondContact O-N 3Å; R253-V257 VanDerWaalsContact O-N 3.16Å; Q254-V257 PolarHBondContact O-N 3.39Å; V257-A261 VanDerWaalsContact O-CB 3.26Å; V257-A261 WeakPolarHBondContact O-CB 3.29Å; V257-A261 PolarHBondContact O-N 2.69Å
258	V	98.4	Very high	97.1	Very high	7 Å²	7	71.3 Å²	71.3	4%	0.042	34%	0.342	C	S	.	.	H	α-helix	trans	-59.2	-47.4	174.4	166.6	0	0	0	0	110.9	L131 H134 L138 Q254 Q255 H256 A261 Q262	L131-V258 HydrophobicContact CD1-CG1 3.96Å; L131-V258 WeakPolarHBondContact CD1-O 3.36Å; H134-V258 HydrophobicContact CB-CG2 3.74Å; L138-V258 HydrophobicContact CB-CG2 4.45Å; L138-V258 HydrophobicContact CD2-CB 4.37Å; L138-V258 HydrophobicContact CD2-CG2 4.01Å; Q254-V258 WeakPolarHBondContact O-CG2 3.43Å; Q254-V258 PolarHBondContact O-N 2.93Å; Q255-V258 PolarHBondContact O-N 2.93Å; H256-V258 PolarHBondContact O-N 2.97Å; V258-A261 PolarHBondContact O-N 2.74Å; V258-Q262 VanDerWaalsContact O-CB 3.3Å; V258-Q262 WeakPolarHBondContact O-CB 3.27Å; V258-Q262 PolarHBondContact O-N 2.98Å
259	N	97.9	Very high	97.4	Very high	70 Å²	70	67.5 Å²	67.5	37%	0.374	32%	0.324	S	S	.	.	H	α-helix	trans	-60.9	-49.3	-179.7	-66.5	4.2	0	0	0	111.6	Q255 H256 A261 Q262 E263	Q255-N259 PolarHBondContact NE2-OD1 2.98Å; Q255-N259 PolarHBondContact O-N 3.41Å; Q255-N259 PolarHBondContact O-OD1 3.22Å; Q255-N259 VanDerWaalsContact O-OD1 3.06Å; H256-N259 PolarHBondContact O-N 3.42Å; N259-A261 PolarHBondContact O-N 2.86Å; N259-Q262 WeakPolarHBondContact O-CB 3.45Å; N259-Q262 PolarHBondContact O-N 3.48Å; N259-E263 WeakPolarHBondContact O-CG 3.49Å; N259-E263 PolarHBondContact O-N 3.17Å
260	T	97.1	Very high	97.6	Very high	60 Å²	60	67 Å²	67	37%	0.368	32%	0.322	S	S	.	.	H	α-helix	trans	-67.4	-35.3	179.6	-61.9	0	0	0	0	112.5	H256 Q262 E263 R264	H256-T260 PolarHBondContact O-N 3.45Å; H256-T260 PolarHBondContact O-OG1 3.29Å; T260-Q262 VanDerWaalsContact C-N 3.35Å; T260-E263 PolarHBondContact O-N 3.02Å; T260-R264 VanDerWaalsContact O-CB 3.28Å; T260-R264 WeakPolarHBondContact O-CB 3.4Å; T260-R264 PolarHBondContact O-N 3.37Å
261	A	95.7	Very high	97.7	Very high	13 Å²	13	68.5 Å²	68.5	11%	0.107	33%	0.329	C	S	.	.	H	α-helix	trans	-66.9	-35.3	172.2	0	0	0	0	0	112.1	L131 V257 V258 N259 R264 V265	L131-A261 HydrophobicContact CB-CB 4.19Å; L131-A261 HydrophobicContact CD1-CB 4Å; V257-A261 VanDerWaalsContact O-CB 3.26Å; V257-A261 WeakPolarHBondContact O-CB 3.29Å; V257-A261 PolarHBondContact O-N 2.69Å; V258-A261 PolarHBondContact O-N 2.74Å; N259-A261 PolarHBondContact O-N 2.86Å; A261-R264 WeakPolarHBondContact O-CB 3.44Å; A261-R264 PolarHBondContact O-N 3.16Å; A261-V265 WeakPolarHBondContact O-CB 3.35Å; A261-V265 WeakPolarHBondContact O-CG2 3.4Å; A261-V265 PolarHBondContact O-N 3.08Å
262	Q	98.3	Very high	97.7	Very high	93 Å²	93	68 Å²	68	44%	0.435	33%	0.327	S	S	.	.	H	α-helix	trans	-67.6	-41.9	175.2	-179.6	171.3	-25.6	0	0	112.2	L131 V258 N259 T260 V265 Q266	L131-Q262 HydrophobicContact CD1-CB 4.09Å; L131-Q262 HydrophobicContact CD2-CB 4.18Å; V258-Q262 VanDerWaalsContact O-CB 3.3Å; V258-Q262 WeakPolarHBondContact O-CB 3.27Å; V258-Q262 PolarHBondContact O-N 2.98Å; N259-Q262 WeakPolarHBondContact O-CB 3.45Å; N259-Q262 PolarHBondContact O-N 3.48Å; T260-Q262 VanDerWaalsContact C-N 3.35Å; Q262-V265 PolarHBondContact O-N 3.24Å; Q262-Q266 WeakPolarHBondContact O-CG 3.38Å; Q262-Q266 PolarHBondContact O-N 2.82Å
263	E	97.6	Very high	97.7	Very high	115 Å²	115	69.3 Å²	69.3	54%	0.537	32%	0.323	S	S	.	.	H	α-helix	trans	-60.3	-44.8	171.2	-70.1	168	174.2	0	0	111.6	N259 T260 Q266 Q267	N259-E263 WeakPolarHBondContact O-CG 3.49Å; N259-E263 PolarHBondContact O-N 3.17Å; T260-E263 PolarHBondContact O-N 3.02Å; E263-Q266 PolarHBondContact O-N 3.03Å; E263-Q267 WeakPolarHBondContact O-CB 3.33Å; E263-Q267 PolarHBondContact O-N 2.85Å
264	R	97.1	Very high	97.8	Very high	101 Å²	101	66.3 Å²	66.3	38%	0.381	32%	0.315	S	S	.	.	H	α-helix	trans	-59.9	-45.4	177.5	-178.9	65.2	176.9	145	17.8	112	E123 E127 T260 A261 Q267 L268	E123-R264 IonicContact OE2-NH2 3.11Å; E123-R264 PolarHBondContact OE2-NH2 2.82Å; E127-R264 VanDerWaalsContact CD-CG 3.43Å; E127-R264 HydrophobicContact CG-CG 4.42Å; E127-R264 VanDerWaalsContact OE1-CG 3.27Å; E127-R264 WeakPolarHBondContact OE1-CG 3.25Å; E127-R264 IonicContact OE1-CZ 3.98Å; E127-R264 IonicContact OE1-NE 3.61Å; E127-R264 PolarHBondContact OE1-NE 2.97Å; E127-R264 IonicContact OE1-NH2 2.66Å; E127-R264 PolarHBondContact OE1-NH2 3.46Å; E127-R264 WeakPolarHBondContact OE2-CG 3.41Å; T260-R264 VanDerWaalsContact O-CB 3.28Å; T260-R264 WeakPolarHBondContact O-CB 3.4Å; T260-R264 PolarHBondContact O-N 3.37Å; A261-R264 WeakPolarHBondContact O-CB 3.44Å; A261-R264 PolarHBondContact O-N 3.16Å; R264-Q267 PolarHBondContact O-N 2.88Å; R264-L268 WeakPolarHBondContact O-CG 3.31Å; R264-L268 PolarHBondContact O-N 2.81Å
265	V	98.5	Very high	97.8	Very high	10 Å²	10	67.6 Å²	67.6	6%	0.061	32%	0.322	C	S	.	.	H	α-helix	trans	-61.4	-46.9	173.7	165.4	0	0	0	0	111.5	L124 E127 K128 L131 A261 Q262 Q267 L268 E269	L124-V265 HydrophobicContact CD1-CG1 3.97Å; E127-V265 HydrophobicContact CB-CG2 3.87Å; K128-V265 HydrophobicContact CD-CG1 4.38Å; K128-V265 HydrophobicContact CG-CG1 3.74Å; K128-V265 HydrophobicContact CG-CG2 3.94Å; L131-V265 HydrophobicContact CD2-CB 4.47Å; L131-V265 HydrophobicContact CD2-CG2 4.14Å; A261-V265 WeakPolarHBondContact O-CB 3.35Å; A261-V265 WeakPolarHBondContact O-CG2 3.4Å; A261-V265 PolarHBondContact O-N 3.08Å; Q262-V265 PolarHBondContact O-N 3.24Å; V265-Q267 VanDerWaalsContact C-N 3.33Å; V265-Q267 PolarHBondContact O-N 3.43Å; V265-L268 PolarHBondContact O-N 2.83Å; V265-E269 WeakPolarHBondContact O-CG 2.98Å; V265-E269 PolarHBondContact O-N 3.17Å
266	Q	98.3	Very high	97.7	Very high	114 Å²	114	68.3 Å²	68.3	53%	0.533	33%	0.325	S	S	.	.	H	α-helix	trans	-61.3	-40.3	178.5	-72.8	176	27.7	0	0	112.6	Q262 E263 E269 K270	Q262-Q266 WeakPolarHBondContact O-CG 3.38Å; Q262-Q266 PolarHBondContact O-N 2.82Å; E263-Q266 PolarHBondContact O-N 3.03Å; Q266-E269 PolarHBondContact O-N 3.16Å; Q266-K270 WeakPolarHBondContact O-CB 3.5Å; Q266-K270 PolarHBondContact O-N 3.45Å
267	Q	98.2	Very high	97.7	Very high	86 Å²	86	67.6 Å²	67.6	40%	0.402	32%	0.321	S	S	.	.	H	α-helix	trans	-65.8	-41.8	176.7	175.5	58	18.3	0	0	111.9	E263 R264 V265 K270 Q271	E263-Q267 WeakPolarHBondContact O-CB 3.33Å; E263-Q267 PolarHBondContact O-N 2.85Å; R264-Q267 PolarHBondContact O-N 2.88Å; V265-Q267 VanDerWaalsContact C-N 3.33Å; V265-Q267 PolarHBondContact O-N 3.43Å; Q267-K270 PolarHBondContact O-N 2.86Å; Q267-Q271 WeakPolarHBondContact O-CG 3.32Å; Q267-Q271 PolarHBondContact O-N 3.23Å
268	L	98	Very high	97.7	Very high	2 Å²	2	69.2 Å²	69.2	1%	0.01	32%	0.324	C	S	.	.	H	α-helix	trans	-65.5	-41.1	175	-75.3	169.1	0	0	0	112.1	L120 E123 L124 E127 R264 V265 K270 Q271 L272	L120-L268 HydrophobicContact CD2-CD2 4.08Å; E123-L268 HydrophobicContact CB-CD1 4.33Å; E123-L268 HydrophobicContact CB-CD2 4.4Å; L124-L268 HydrophobicContact CB-CB 4.32Å; L124-L268 HydrophobicContact CD1-CB 3.89Å; E127-L268 HydrophobicContact CB-CD1 4.17Å; E127-L268 HydrophobicContact CG-CD1 3.71Å; R264-L268 WeakPolarHBondContact O-CG 3.31Å; R264-L268 PolarHBondContact O-N 2.81Å; V265-L268 PolarHBondContact O-N 2.83Å; L268-K270 VanDerWaalsContact C-N 3.3Å; L268-K270 PolarHBondContact O-N 2.88Å; L268-Q271 PolarHBondContact O-N 3.45Å; L268-L272 WeakPolarHBondContact O-CB 3.41Å; L268-L272 PolarHBondContact O-N 3.07Å
269	E	98.1	Very high	97.5	Very high	57 Å²	57	71.3 Å²	71.3	27%	0.266	33%	0.333	S	S	.	.	H	α-helix	trans	-60.1	-39.7	172.6	-74.6	-153.6	176.1	0	0	112.7	L124 K128 V265 Q266 K273	L124-E269 HydrophobicContact CD1-CG 3.7Å; L124-E269 HydrophobicContact CD2-CG 3.96Å; L124-E269 HydrophobicContact CG-CG 4.48Å; K128-E269 VanDerWaalsContact CE-OE1 3.29Å; K128-E269 WeakPolarHBondContact CE-OE1 3.35Å; K128-E269 IonicContact NZ-OE1 3.46Å; K128-E269 PolarHBondContact NZ-OE1 3.29Å; V265-E269 WeakPolarHBondContact O-CG 2.98Å; V265-E269 PolarHBondContact O-N 3.17Å; Q266-E269 PolarHBondContact O-N 3.16Å; E269-K273 WeakPolarHBondContact O-CB 3.44Å; E269-K273 VanDerWaalsContact O-CD 3.29Å; E269-K273 WeakPolarHBondContact O-CD 3.44Å; E269-K273 WeakPolarHBondContact O-CG 3.21Å; E269-K273 PolarHBondContact O-N 2.96Å; E269-K273 VanDerWaalsContact O-N 3.1Å; E269-K273 IonicContact OE2-NZ 3.81Å; E269-K273 PolarHBondContact OE2-NZ 3.4Å
270	K	98.2	Very high	97.5	Very high	137 Å²	137	73.7 Å²	73.7	60%	0.596	34%	0.342	S	S	*	.	H	α-helix	trans	-66.7	-43	177.3	-177.1	-179.5	175.8	-176.6	0	111.3	Q266 Q267 L268 K273 E274	Q266-K270 WeakPolarHBondContact O-CB 3.5Å; Q266-K270 PolarHBondContact O-N 3.45Å; Q267-K270 PolarHBondContact O-N 2.86Å; L268-K270 VanDerWaalsContact C-N 3.3Å; L268-K270 PolarHBondContact O-N 2.88Å; K270-K273 PolarHBondContact O-N 2.99Å; K270-E274 PolarHBondContact O-N 3.4Å; K270-E274 VanDerWaalsContact O-N 3.1Å
271	Q	97.5	Very high	97.5	Very high	73 Å²	73	76.7 Å²	76.7	34%	0.341	35%	0.346	S	S	.	.	H	α-helix	trans	-63.7	-45	176.8	-74.6	175	-48.2	0	0	111.7	Q267 L268 K273 E274 M275	Q267-Q271 WeakPolarHBondContact O-CG 3.32Å; Q267-Q271 PolarHBondContact O-N 3.23Å; L268-Q271 PolarHBondContact O-N 3.45Å; Q271-K273 PolarHBondContact O-N 3.49Å; Q271-E274 WeakPolarHBondContact O-CB 3.37Å; Q271-E274 PolarHBondContact O-N 2.93Å; Q271-M275 WeakPolarHBondContact O-CG 3.25Å; Q271-M275 PolarHBondContact O-N 2.93Å
272	L	98.1	Very high	97.5	Very high	17 Å²	17	79.7 Å²	79.7	9%	0.089	36%	0.358	C	S	.	.	H	α-helix	trans	-56	-48.6	174.9	-176.9	64.2	0	0	0	111.7	I117 L120 Q121 L124 L268 E274 M275 E276	I117-L272 HydrophobicContact CB-CD1 4.45Å; I117-L272 HydrophobicContact CG2-CD1 3.95Å; L120-L272 HydrophobicContact CB-CD1 4.11Å; Q121-L272 HydrophobicContact CG-CD1 3.75Å; Q121-L272 HydrophobicContact CG-CD2 3.82Å; Q121-L272 HydrophobicContact CG-CG 4.47Å; L124-L272 HydrophobicContact CD2-CD2 3.9Å; L268-L272 WeakPolarHBondContact O-CB 3.41Å; L268-L272 PolarHBondContact O-N 3.07Å; L272-E274 PolarHBondContact O-N 3.5Å; L272-M275 PolarHBondContact O-N 2.75Å; L272-E276 WeakPolarHBondContact O-CG 3.31Å; L272-E276 PolarHBondContact O-N 3.35Å
273	K	97.8	Very high	97.5	Very high	101 Å²	101	75.8 Å²	75.8	44%	0.439	34%	0.34	S	S	.	.	H	α-helix	trans	-66.3	-15.1	177	-68.6	163.3	-166.6	162.2	0	113.9	E269 K270 Q271 K277	E269-K273 WeakPolarHBondContact O-CB 3.44Å; E269-K273 VanDerWaalsContact O-CD 3.29Å; E269-K273 WeakPolarHBondContact O-CD 3.44Å; E269-K273 WeakPolarHBondContact O-CG 3.21Å; E269-K273 PolarHBondContact O-N 2.96Å; E269-K273 VanDerWaalsContact O-N 3.1Å; E269-K273 IonicContact OE2-NZ 3.81Å; E269-K273 PolarHBondContact OE2-NZ 3.4Å; K270-K273 PolarHBondContact O-N 2.99Å; Q271-K273 PolarHBondContact O-N 3.49Å; K273-K277 WeakPolarHBondContact O-CD 3.3Å; K273-K277 WeakPolarHBondContact O-CE 3.39Å; K273-K277 VanDerWaalsContact O-CG 3.29Å; K273-K277 WeakPolarHBondContact O-CG 3.47Å
274	E	97.7	Very high	97.4	Very high	84 Å²	84	73.4 Å²	73.4	39%	0.393	33%	0.331	S	S	.	.	H	α-helix	trans	-86.7	-47.8	172.2	-163.1	67.9	-106.5	0	0	110.6	K270 Q271 L272 E276 K277 E278 R281	K270-E274 PolarHBondContact O-N 3.4Å; K270-E274 VanDerWaalsContact O-N 3.1Å; Q271-E274 WeakPolarHBondContact O-CB 3.37Å; Q271-E274 PolarHBondContact O-N 2.93Å; L272-E274 PolarHBondContact O-N 3.5Å; E274-E276 PolarHBondContact O-N 3.03Å; E274-K277 WeakPolarHBondContact O-CB 3.28Å; E274-K277 PolarHBondContact O-N 3.32Å; E274-K277 VanDerWaalsContact O-N 3.12Å; E274-E278 PolarHBondContact O-N 3.49Å; E274-R281 IonicContact OE1-CZ 3.95Å; E274-R281 IonicContact OE1-NH1 2.62Å; E274-R281 PolarHBondContact OE1-NH1 3.26Å; E274-R281 VanDerWaalsContact OE1-NH1 3.11Å; E274-R281 IonicContact OE1-NH2 3.68Å; E274-R281 PolarHBondContact OE1-NH2 3.02Å
275	M	97.3	Very high	97.5	Very high	36 Å²	36	70 Å²	70	18%	0.177	33%	0.325	C	S	.	.	H	α-helix	trans	-61.6	-39.8	178	-63.9	-52.8	-62.3	0	0	112.5	L113 E116 I117 L120 Q271 L272 K277 E278 K279	L113-M275 HydrophobicContact CD2-CE 4.02Å; E116-M275 HydrophobicContact CB-CE 4.4Å; E116-M275 WeakPolarHBondContact OE2-CE 3.26Å; I117-M275 HydrophobicContact CG1-CB 3.99Å; L120-M275 HydrophobicContact CD1-CB 4.38Å; L120-M275 HydrophobicContact CD1-CG 3.61Å; Q271-M275 WeakPolarHBondContact O-CG 3.25Å; Q271-M275 PolarHBondContact O-N 2.93Å; L272-M275 PolarHBondContact O-N 2.75Å; M275-K277 VanDerWaalsContact C-N 3.29Å; M275-K277 PolarHBondContact O-N 2.87Å; M275-E278 PolarHBondContact O-N 3.37Å; M275-K279 WeakPolarHBondContact O-CB 3.22Å; M275-K279 PolarHBondContact O-N 3.37Å
276	E	96.8	Very high	97.3	Very high	85 Å²	85	70.2 Å²	70.2	40%	0.397	33%	0.325	S	S	.	.	H	α-helix	trans	-59.7	-39.3	174.6	-75.2	175.6	159.3	0	0	112.1	I117 L272 E274 E280	I117-E276 HydrophobicContact CD1-CG 3.9Å; I117-E276 HydrophobicContact CG1-CG 4.28Å; L272-E276 WeakPolarHBondContact O-CG 3.31Å; L272-E276 PolarHBondContact O-N 3.35Å; E274-E276 PolarHBondContact O-N 3.03Å; E276-E280 PolarHBondContact O-N 2.67Å
277	K	97.9	Very high	97.2	Very high	106 Å²	106	69.8 Å²	69.8	46%	0.461	32%	0.319	S	S	.	.	H	α-helix	trans	-73.3	-39.4	175.7	-65.8	169.4	-168.7	162.3	0	111.7	K273 E274 M275 E280 R281	K273-K277 WeakPolarHBondContact O-CD 3.3Å; K273-K277 WeakPolarHBondContact O-CE 3.39Å; K273-K277 VanDerWaalsContact O-CG 3.29Å; K273-K277 WeakPolarHBondContact O-CG 3.47Å; E274-K277 WeakPolarHBondContact O-CB 3.28Å; E274-K277 PolarHBondContact O-N 3.32Å; E274-K277 VanDerWaalsContact O-N 3.12Å; M275-K277 VanDerWaalsContact C-N 3.29Å; M275-K277 PolarHBondContact O-N 2.87Å; K277-E280 PolarHBondContact O-N 2.99Å; K277-R281 WeakPolarHBondContact O-CG 3.3Å; K277-R281 PolarHBondContact O-N 3.44Å
278	E	96.5	Very high	97.2	Very high	86 Å²	86	71 Å²	71	40%	0.402	32%	0.323	S	S	.	.	H	α-helix	trans	-60.7	-46.6	176.2	-174.5	162.6	-174.2	0	0	111.9	E274 M275 E280 R281 E282	E274-E278 PolarHBondContact O-N 3.49Å; M275-E278 PolarHBondContact O-N 3.37Å; E278-E280 VanDerWaalsContact C-N 3.29Å; E278-E280 PolarHBondContact O-N 3.31Å; E278-R281 WeakPolarHBondContact O-CB 3.46Å; E278-R281 PolarHBondContact O-N 3.19Å; E278-R281 VanDerWaalsContact O-N 3.16Å; E278-E282 PolarHBondContact O-N 3.09Å
279	K	95.6	Very high	97	Very high	51 Å²	51	75.8 Å²	75.8	22%	0.222	34%	0.344	C	S	.	.	H	α-helix	trans	-54.7	-42	170.3	176.1	-176.9	156.9	-159.9	0	112.8	L113 I117 M275 L283	L113-K279 HydrophobicContact CB-CB 4.03Å; L113-K279 HydrophobicContact CB-CD 4.36Å; L113-K279 HydrophobicContact CB-CG 4.14Å; L113-K279 HydrophobicContact CD1-CB 3.96Å; L113-K279 HydrophobicContact CD1-CG 4.43Å; I117-K279 HydrophobicContact CD1-CB 4.26Å; I117-K279 HydrophobicContact CD1-CD 3.47Å; I117-K279 VanDerWaalsContact CD1-CD 3.47Å; M275-K279 WeakPolarHBondContact O-CB 3.22Å; M275-K279 PolarHBondContact O-N 3.37Å; K279-L283 HydrophobicContact CG-CD1 3.87Å; K279-L283 VanDerWaalsContact O-CB 3.28Å; K279-L283 WeakPolarHBondContact O-CB 3.38Å; K279-L283 WeakPolarHBondContact O-CD1 3.48Å; K279-L283 WeakPolarHBondContact O-CG 3.4Å; K279-L283 PolarHBondContact O-N 3.03Å
280	E	97.4	Very high	96.8	Very high	121 Å²	121	76.2 Å²	76.2	57%	0.565	35%	0.345	S	S	*	.	H	α-helix	trans	-67.4	-47.3	174.5	179.7	164.7	-145.5	0	0	112.4	E276 K277 E278 E282 N284	E276-E280 PolarHBondContact O-N 2.67Å; K277-E280 PolarHBondContact O-N 2.99Å; E278-E280 VanDerWaalsContact C-N 3.29Å; E278-E280 PolarHBondContact O-N 3.31Å; E280-E282 PolarHBondContact O-N 3.34Å; E280-N284 WeakPolarHBondContact CG-ND2 3.28Å; E280-N284 VanDerWaalsContact O-CB 3.24Å; E280-N284 WeakPolarHBondContact O-CB 3.31Å; E280-N284 VanDerWaalsContact O-CG 3.28Å; E280-N284 PolarHBondContact O-N 3.22Å; E280-N284 PolarHBondContact O-ND2 3.06Å
281	R	97.9	Very high	96.7	Very high	122 Å²	122	76.9 Å²	76.9	46%	0.46	34%	0.343	S	S	.	.	H	α-helix	trans	-53.7	-53.7	179.5	-68.7	163.1	-164.6	140.3	-8.6	110.7	E274 K277 E278 N284 A285	E274-R281 IonicContact OE1-CZ 3.95Å; E274-R281 IonicContact OE1-NH1 2.62Å; E274-R281 PolarHBondContact OE1-NH1 3.26Å; E274-R281 VanDerWaalsContact OE1-NH1 3.11Å; E274-R281 IonicContact OE1-NH2 3.68Å; E274-R281 PolarHBondContact OE1-NH2 3.02Å; K277-R281 WeakPolarHBondContact O-CG 3.3Å; K277-R281 PolarHBondContact O-N 3.44Å; E278-R281 WeakPolarHBondContact O-CB 3.46Å; E278-R281 PolarHBondContact O-N 3.19Å; E278-R281 VanDerWaalsContact O-N 3.16Å; R281-N284 PolarHBondContact O-N 3.24Å; R281-A285 PolarHBondContact O-N 2.93Å
282	E	95.6	Very high	96.5	Very high	77 Å²	77	77.4 Å²	77.4	36%	0.36	35%	0.346	S	S	.	.	H	α-helix	trans	-72.7	-40.2	-175.1	-74.1	-51.7	121.2	0	0	113.6	L109 E278 E280 N284 A285 L286	L109-E282 HydrophobicContact CD2-CB 3.78Å; L109-E282 HydrophobicContact CD2-CG 4.45Å; E278-E282 PolarHBondContact O-N 3.09Å; E280-E282 PolarHBondContact O-N 3.34Å; E282-N284 PolarHBondContact O-N 2.8Å; E282-A285 WeakPolarHBondContact O-CB 3.44Å; E282-A285 PolarHBondContact O-N 2.89Å; E282-A285 VanDerWaalsContact O-N 3.12Å; E282-L286 PolarHBondContact O-N 2.86Å
283	L	96.6	Very high	96.2	Very high	10 Å²	10	78.3 Å²	78.3	5%	0.052	35%	0.351	C	S	.	.	H	α-helix	trans	-62.8	-33.4	173.1	-66.9	176	0	0	0	111.2	K106 K110 K279 R287	K106-L283 HydrophobicContact CG-CD2 3.75Å; K106-L283 WeakPolarHBondContact O-CD2 3.4Å; K110-L283 HydrophobicContact CB-CD1 4.43Å; K110-L283 HydrophobicContact CB-CD2 4.04Å; K279-L283 HydrophobicContact CG-CD1 3.87Å; K279-L283 VanDerWaalsContact O-CB 3.28Å; K279-L283 WeakPolarHBondContact O-CB 3.38Å; K279-L283 WeakPolarHBondContact O-CD1 3.48Å; K279-L283 WeakPolarHBondContact O-CG 3.4Å; K279-L283 PolarHBondContact O-N 3.03Å; L283-R287 VanDerWaalsContact O-CB 3.31Å; L283-R287 WeakPolarHBondContact O-CB 3.35Å; L283-R287 VanDerWaalsContact O-CD 3.25Å; L283-R287 WeakPolarHBondContact O-CD 3.23Å; L283-R287 WeakPolarHBondContact O-CG 3.44Å; L283-R287 PolarHBondContact O-N 2.89Å
284	N	97.4	Very high	95.8	Very high	65 Å²	65	76.5 Å²	76.5	35%	0.348	35%	0.345	S	S	.	.	H	α-helix	trans	-72.1	-35	172.5	-75.1	-25.8	0	0	0	113.2	E280 R281 E282 R287 K288	E280-N284 WeakPolarHBondContact CG-ND2 3.28Å; E280-N284 VanDerWaalsContact O-CB 3.24Å; E280-N284 WeakPolarHBondContact O-CB 3.31Å; E280-N284 VanDerWaalsContact O-CG 3.28Å; E280-N284 PolarHBondContact O-N 3.22Å; E280-N284 PolarHBondContact O-ND2 3.06Å; R281-N284 PolarHBondContact O-N 3.24Å; E282-N284 PolarHBondContact O-N 2.8Å; N284-R287 PolarHBondContact O-N 3.16Å; N284-R287 WeakPolarHBondContact OD1-CD 3.37Å; N284-R287 PolarHBondContact OD1-NH1 2.72Å; N284-K288 WeakPolarHBondContact O-CB 3.39Å; N284-K288 PolarHBondContact O-N 2.88Å
285	A	97.6	Very high	95.5	Very high	30 Å²	30	78.7 Å²	78.7	25%	0.248	36%	0.355	C	S	.	.	H	α-helix	trans	-64.5	-46.3	173	0	0	0	0	0	112.1	R281 E282 K288 K289	R281-A285 PolarHBondContact O-N 2.93Å; E282-A285 WeakPolarHBondContact O-CB 3.44Å; E282-A285 PolarHBondContact O-N 2.89Å; E282-A285 VanDerWaalsContact O-N 3.12Å; A285-K288 WeakPolarHBondContact O-CB 3.35Å; A285-K288 PolarHBondContact O-N 2.98Å; A285-K289 WeakPolarHBondContact O-CG 3.46Å; A285-K289 PolarHBondContact O-N 3.23Å
286	L	95.6	Very high	95	Very high	14 Å²	14	78.7 Å²	78.7	7%	0.073	36%	0.361	C	S	.	.	H	α-helix	trans	-65.7	-40.4	175.1	-67.2	175.8	0	0	0	112	I102 K106 L109 E282 K288 K289 K290	I102-L286 HydrophobicContact CG2-CD2 4.5Å; K106-L286 HydrophobicContact CB-CB 4.38Å; K106-L286 HydrophobicContact CB-CD1 3.98Å; K106-L286 HydrophobicContact CG-CB 4.33Å; K106-L286 HydrophobicContact CG-CD1 4.37Å; L109-L286 HydrophobicContact CD2-CD1 3.96Å; E282-L286 PolarHBondContact O-N 2.86Å; L286-K288 VanDerWaalsContact C-N 3.28Å; L286-K288 PolarHBondContact O-N 3.04Å; L286-K289 HydrophobicContact CD2-CD 4.34Å; L286-K289 PolarHBondContact O-N 3.25Å; L286-K290 WeakPolarHBondContact O-CB 3.46Å; L286-K290 PolarHBondContact O-N 3.4Å
287	R	96	Very high	94.4	Very high	106 Å²	106	75.7 Å²	75.7	40%	0.4	35%	0.349	S	S	.	.	H	α-helix	trans	-57.2	-39	170.3	-75.6	162.4	-178.9	143.8	-1	111.9	L283 N284 R291	L283-R287 VanDerWaalsContact O-CB 3.31Å; L283-R287 WeakPolarHBondContact O-CB 3.35Å; L283-R287 VanDerWaalsContact O-CD 3.25Å; L283-R287 WeakPolarHBondContact O-CD 3.23Å; L283-R287 WeakPolarHBondContact O-CG 3.44Å; L283-R287 PolarHBondContact O-N 2.89Å; N284-R287 PolarHBondContact O-N 3.16Å; N284-R287 WeakPolarHBondContact OD1-CD 3.37Å; N284-R287 PolarHBondContact OD1-NH1 2.72Å; R287-R291 WeakPolarHBondContact O-CG 3.23Å; R287-R291 PolarHBondContact O-N 2.93Å
288	K	97.3	Very high	93.6	Very high	111 Å²	111	76.4 Å²	76.4	48%	0.483	35%	0.353	S	S	.	.	H	α-helix	trans	-67.7	-52.9	177.4	-172.5	177.3	-177.4	-79.9	0	111.5	N284 A285 L286 K290 R291 E292	N284-K288 WeakPolarHBondContact O-CB 3.39Å; N284-K288 PolarHBondContact O-N 2.88Å; A285-K288 WeakPolarHBondContact O-CB 3.35Å; A285-K288 PolarHBondContact O-N 2.98Å; L286-K288 VanDerWaalsContact C-N 3.28Å; L286-K288 PolarHBondContact O-N 3.04Å; K288-K290 VanDerWaalsContact C-N 3.26Å; K288-K290 PolarHBondContact O-N 2.74Å; K288-R291 PolarHBondContact O-N 3.48Å; K288-E292 WeakPolarHBondContact CE-OE1 3.41Å; K288-E292 WeakPolarHBondContact CG-OE1 3.43Å; K288-E292 IonicContact NZ-OE1 3.94Å; K288-E292 PolarHBondContact NZ-OE1 3.06Å; K288-E292 WeakPolarHBondContact O-CG 3.41Å; K288-E292 PolarHBondContact O-N 3.49Å
289	K	94.9	Very high	92.6	Very high	103 Å²	103	75.5 Å²	75.5	45%	0.448	35%	0.354	S	S	.	.	H	α-helix	trans	-53.7	-41.8	176.3	-68.7	166.8	-179	169.7	0	111.9	I102 A285 L286 E292 L293	I102-K289 HydrophobicContact CD1-CB 4.35Å; A285-K289 WeakPolarHBondContact O-CG 3.46Å; A285-K289 PolarHBondContact O-N 3.23Å; L286-K289 HydrophobicContact CD2-CD 4.34Å; L286-K289 PolarHBondContact O-N 3.25Å; K289-E292 WeakPolarHBondContact CA-OE2 3.27Å; K289-E292 PolarHBondContact O-N 2.98Å; K289-L293 PolarHBondContact O-N 2.88Å
290	K	94.3	Very high	91	Very high	65 Å²	65	74.3 Å²	74.3	28%	0.283	35%	0.351	S	S	.	.	H	α-helix	trans	-61.9	-44.6	174.6	-178.8	174.5	178.6	175.6	0	112.9	I102 N103 L286 K288 E292 L293 I294	I102-K290 HydrophobicContact CG2-CB 4.08Å; N103-K290 VanDerWaalsContact OD1-CD 3.32Å; N103-K290 WeakPolarHBondContact OD1-CD 3.41Å; N103-K290 VanDerWaalsContact OD1-CE 3.3Å; N103-K290 WeakPolarHBondContact OD1-CE 3.33Å; N103-K290 PolarHBondContact OD1-NZ 3.12Å; L286-K290 WeakPolarHBondContact O-CB 3.46Å; L286-K290 PolarHBondContact O-N 3.4Å; K288-K290 VanDerWaalsContact C-N 3.26Å; K288-K290 PolarHBondContact O-N 2.74Å; K290-E292 VanDerWaalsContact C-N 3.34Å; K290-E292 PolarHBondContact O-N 3.02Å; K290-L293 PolarHBondContact O-N 3.28Å; K290-I294 HydrophobicContact CD-CD1 4.44Å; K290-I294 HydrophobicContact CG-CD1 3.84Å; K290-I294 HydrophobicContact CG-CG1 4.48Å; K290-I294 VanDerWaalsContact O-CG1 3.3Å; K290-I294 WeakPolarHBondContact O-CG1 3.49Å; K290-I294 PolarHBondContact O-N 3.41Å
291	R	94.9	Very high	89.1	Confident	151 Å²	151	72.1 Å²	72.1	57%	0.57	35%	0.347	S	S	*	.	H	α-helix	trans	-62.6	-41.3	177.7	-73.2	-176.5	-61.4	-111.4	2	111.7	R287 K288 I294 Q295	R287-R291 WeakPolarHBondContact O-CG 3.23Å; R287-R291 PolarHBondContact O-N 2.93Å; K288-R291 PolarHBondContact O-N 3.48Å; R291-I294 PolarHBondContact O-N 3.37Å; R291-Q295 WeakPolarHBondContact O-CB 3.32Å; R291-Q295 PolarHBondContact O-N 2.87Å
292	E	93.6	Very high	87	Confident	85 Å²	85	74 Å²	74	40%	0.397	36%	0.358	S	S	.	.	H	α-helix	trans	-63.2	-43.8	178.3	-68.8	162.3	165.8	0	0	111.6	K288 K289 K290 Q295 A296	K288-E292 WeakPolarHBondContact CE-OE1 3.41Å; K288-E292 WeakPolarHBondContact CG-OE1 3.43Å; K288-E292 IonicContact NZ-OE1 3.94Å; K288-E292 PolarHBondContact NZ-OE1 3.06Å; K288-E292 WeakPolarHBondContact O-CG 3.41Å; K288-E292 PolarHBondContact O-N 3.49Å; K289-E292 WeakPolarHBondContact CA-OE2 3.27Å; K289-E292 PolarHBondContact O-N 2.98Å; K290-E292 VanDerWaalsContact C-N 3.34Å; K290-E292 PolarHBondContact O-N 3.02Å; E292-Q295 PolarHBondContact O-N 3.47Å; E292-A296 PolarHBondContact O-N 3.42Å
293	L	91.1	Very high	84.8	Confident	35 Å²	35	75.9 Å²	75.9	18%	0.183	37%	0.367	C	S	.	.	H	α-helix	trans	-66.2	-38.5	174.2	-82.8	157.9	0	0	0	113.4	L95 R98 I99 I102 K289 K290 Q295 A296 T297	L95-L293 HydrophobicContact CD2-CD2 3.85Å; R98-L293 HydrophobicContact CG-CD1 3.76Å; R98-L293 HydrophobicContact CG-CD2 4.27Å; I99-L293 HydrophobicContact CD1-CB 4.24Å; I99-L293 HydrophobicContact CG1-CB 3.86Å; I102-L293 HydrophobicContact CD1-CD1 3.32Å; K289-L293 PolarHBondContact O-N 2.88Å; K290-L293 PolarHBondContact O-N 3.28Å; L293-Q295 VanDerWaalsContact C-N 3.34Å; L293-A296 PolarHBondContact O-N 2.99Å; L293-T297 WeakPolarHBondContact O-CB 3.47Å; L293-T297 PolarHBondContact O-N 2.87Å; L293-T297 PolarHBondContact O-OG1 3.5Å
294	I	90.3	Very high	82.6	Confident	63 Å²	63	83 Å²	83	32%	0.323	40%	0.398	S	S	.	.	H	α-helix	trans	-63.2	-42.8	173.2	-71.2	167.7	0	0	0	110.2	I99 K290 R291 T297 Q298	I99-I294 HydrophobicContact CD1-CG1 3.86Å; I99-I294 HydrophobicContact CG1-CG1 4.46Å; K290-I294 HydrophobicContact CD-CD1 4.44Å; K290-I294 HydrophobicContact CG-CD1 3.84Å; K290-I294 HydrophobicContact CG-CG1 4.48Å; K290-I294 VanDerWaalsContact O-CG1 3.3Å; K290-I294 WeakPolarHBondContact O-CG1 3.49Å; K290-I294 PolarHBondContact O-N 3.41Å; R291-I294 PolarHBondContact O-N 3.37Å; I294-T297 WeakPolarHBondContact O-CB 3.49Å; I294-T297 PolarHBondContact O-N 3.38Å; I294-Q298 WeakPolarHBondContact O-CG 3.49Å; I294-Q298 PolarHBondContact O-N 3.11Å
295	Q	90.1	Very high	80	Confident	131 Å²	131	88.9 Å²	88.9	61%	0.612	42%	0.421	S	S	*	.	H	α-helix	trans	-63.1	-43.3	177	-171.3	175.3	3.3	0	0	111.7	R291 E292 L293 T297 Q298 T299	R291-Q295 WeakPolarHBondContact O-CB 3.32Å; R291-Q295 PolarHBondContact O-N 2.87Å; E292-Q295 PolarHBondContact O-N 3.47Å; L293-Q295 VanDerWaalsContact C-N 3.34Å; Q295-T297 VanDerWaalsContact C-N 3.33Å; Q295-T297 PolarHBondContact O-N 3.46Å; Q295-Q298 CarbonylContact O-C 3.21Å; Q295-Q298 PolarHBondContact O-N 3.29Å; Q295-Q298 VanDerWaalsContact O-N 3.08Å; Q295-T299 PolarHBondContact O-N 3.1Å; Q295-T299 PolarHBondContact O-OG1 2.88Å
296	A	87.5	Confident	77.6	Confident	35 Å²	35	92.6 Å²	92.6	29%	0.289	44%	0.442	S	S	.	.	H	α-helix	trans	-60.4	-40.8	172.7	0	0	0	0	0	112.3	E292 L293 Q298 T299 V300	E292-A296 PolarHBondContact O-N 3.42Å; L293-A296 PolarHBondContact O-N 2.99Å; A296-Q298 PolarHBondContact O-N 3.48Å; A296-T299 WeakPolarHBondContact CA-OG1 3.34Å; A296-T299 PolarHBondContact O-N 3.35Å; A296-T299 PolarHBondContact O-OG1 3.46Å; A296-T299 VanDerWaalsContact O-OG1 3.1Å; A296-V300 WeakPolarHBondContact O-CG2 3.34Å; A296-V300 PolarHBondContact O-N 2.82Å; A296-V300 VanDerWaalsContact O-N 3.08Å
297	T	84.2	Confident	75.3	Confident	23 Å²	23	98.9 Å²	98.9	14%	0.141	48%	0.475	C	S	.	.	H	α-helix	trans	-65.2	-22.6	175.5	-50.3	0	0	0	0	112.3	L95 L293 I294 Q295 P301	L95-T297 WeakPolarHBondContact CB-OG1 3.5Å; L293-T297 WeakPolarHBondContact O-CB 3.47Å; L293-T297 PolarHBondContact O-N 2.87Å; L293-T297 PolarHBondContact O-OG1 3.5Å; I294-T297 WeakPolarHBondContact O-CB 3.49Å; I294-T297 PolarHBondContact O-N 3.38Å; Q295-T297 VanDerWaalsContact C-N 3.33Å; Q295-T297 PolarHBondContact O-N 3.46Å; T297-P301 WeakPolarHBondContact O-CD 3.48Å; T297-P301 VanDerWaalsContact O-CG 3.32Å; T297-P301 WeakPolarHBondContact O-CG 3.45Å
298	Q	81.3	Confident	73	Confident	120 Å²	120	100.2 Å²	100.2	56%	0.561	50%	0.495	S	S	*	.	H	α-helix	trans	-92.6	-15.3	175.2	-69.2	178.7	16	0	0	114.5	I294 Q295 A296 K302	I294-Q298 WeakPolarHBondContact O-CG 3.49Å; I294-Q298 PolarHBondContact O-N 3.11Å; Q295-Q298 CarbonylContact O-C 3.21Å; Q295-Q298 PolarHBondContact O-N 3.29Å; Q295-Q298 VanDerWaalsContact O-N 3.08Å; A296-Q298 PolarHBondContact O-N 3.48Å; Q298-K302 WeakPolarHBondContact O-CE 3.32Å
299	T	76.3	Confident	70.5	Confident	68 Å²	68	99.8 Å²	99.8	42%	0.417	50%	0.498	S	S	.	.	H	α-helix	trans	-92.6	-39.3	175.2	52.2	0	0	0	0	112.7	Q295 A296 P301 K302	Q295-T299 PolarHBondContact O-N 3.1Å; Q295-T299 PolarHBondContact O-OG1 2.88Å; A296-T299 WeakPolarHBondContact CA-OG1 3.34Å; A296-T299 PolarHBondContact O-N 3.35Å; A296-T299 PolarHBondContact O-OG1 3.46Å; A296-T299 VanDerWaalsContact O-OG1 3.1Å; T299-P301 VanDerWaalsContact C-CD 3.43Å; T299-P301 VanDerWaalsContact C-N 3.31Å; T299-K302 WeakPolarHBondContact O-CB 3.43Å; T299-K302 PolarHBondContact O-N 3.36Å
300	V	61	Low	68.2	Low	25 Å²	25	106 Å²	106	15%	0.152	52%	0.519	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-37.6	177.1	168.8	0	0	0	0	114.1	F89 L95 A296 K302	F89-V300 HydrophobicContact CD1-CG1 4.47Å; L95-V300 HydrophobicContact CD1-CG2 4.43Å; A296-V300 WeakPolarHBondContact O-CG2 3.34Å; A296-V300 PolarHBondContact O-N 2.82Å; A296-V300 VanDerWaalsContact O-N 3.08Å; V300-K302 VanDerWaalsContact C-N 3.31Å; V300-K302 PolarHBondContact O-N 2.93Å
301	P	56.8	Low	66	Low	75 Å²	75	107.8 Å²	107.8	49%	0.487	54%	0.539	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-25	174.3	-22.6	35	0	0	0	114.4	T297 T299 K304	T297-P301 WeakPolarHBondContact O-CD 3.48Å; T297-P301 VanDerWaalsContact O-CG 3.32Å; T297-P301 WeakPolarHBondContact O-CG 3.45Å; T299-P301 VanDerWaalsContact C-CD 3.43Å; T299-P301 VanDerWaalsContact C-N 3.31Å; P301-K304 PolarHBondContact O-N 3.36Å
302	K	53.8	Low	63.8	Low	161 Å²	161	107.3 Å²	107.3	70%	0.7	55%	0.548	S	S	*	.	G	3₁₀ helix	trans	-77.8	-27.6	-174.3	-62.5	-178.1	-178.4	179.9	0	112.9	Q298 T299 V300 K304	Q298-K302 WeakPolarHBondContact O-CE 3.32Å; T299-K302 WeakPolarHBondContact O-CB 3.43Å; T299-K302 PolarHBondContact O-N 3.36Å; V300-K302 VanDerWaalsContact C-N 3.31Å; V300-K302 PolarHBondContact O-N 2.93Å; K302-K304 PolarHBondContact O-N 3.44Å
303	E	50.4	Low	61.4	Low	117 Å²	117	110.4 Å²	110.4	55%	0.547	57%	0.566	S	S	.	*	G	3₁₀ helix	trans	-72.2	-7.4	171.1	-66.6	-170.9	-154.1	0	0	113	R87	R87-E303 IonicContact CZ-OE2 2.72Å; R87-E303 IonicContact NH1-OE1 3.7Å; R87-E303 IonicContact NH1-OE2 2.78Å; R87-E303 PolarHBondContact NH1-OE2 3.09Å
304	K	49.4	Very low	58.7	Low	160 Å²	160	114.4 Å²	114.4	70%	0.696	59%	0.592	S	S	*	*	G	3₁₀ helix	trans	-101	27	179.4	-66	-165.1	175	-169.9	0	114.6	P301 K302 P306	P301-K304 PolarHBondContact O-N 3.36Å; K302-K304 PolarHBondContact O-N 3.44Å; K304-P306 WeakPolarHBondContact O-CD 3.31Å
305	K	44.2	Very low	56.2	Low	189 Å²	189	118 Å²	118	82%	0.822	62%	0.617	S	S	*	*			trans	-84.9	108.7	156.5	-87.1	-167.9	170.5	-168	0	108.6
306	P	46.5	Very low	53.7	Low	108 Å²	108	117.4 Å²	117.4	70%	0.701	63%	0.627	S	S	*	*			trans	-67.1	149.8	174.9	29.2	-34.6	0	0	0	111.1	K304 T308	K304-P306 WeakPolarHBondContact O-CD 3.31Å; P306-T308 PolarHBondContact O-N 2.9Å
307	L	47.6	Very low	51.3	Low	146 Å²	146	120.1 Å²	120.1	76%	0.764	65%	0.65	S	S	*	*			trans	-70.4	89	175.5	179.6	66.9	0	0	0	110.3	D309	L307-D309 VanDerWaalsContact C-N 3.32Å; L307-D309 HydrophobicContact CD1-CB 4.03Å; L307-D309 HydrophobicContact CG-CB 4.3Å; L307-D309 PolarHBondContact O-N 3.15Å; L307-D309 VanDerWaalsContact O-N 3.17Å
308	T	47.4	Very low	50.1	Low	133 Å²	133	124.8 Å²	124.8	82%	0.816	68%	0.68	S	S	*	*			trans	-82.8	77.5	168.3	52.1	0	0	0	0	109.9	P306	P306-T308 PolarHBondContact O-N 2.9Å
309	D	45.9	Very low	47.7	Very low	102 Å²	102	125.2 Å²	125.2	55%	0.545	70%	0.695	S	S	.	*			trans	-141.5	74.5	175.3	-160.6	3	0	0	0	110.5	L307	L307-D309 VanDerWaalsContact C-N 3.32Å; L307-D309 HydrophobicContact CD1-CB 4.03Å; L307-D309 HydrophobicContact CG-CB 4.3Å; L307-D309 PolarHBondContact O-N 3.15Å; L307-D309 VanDerWaalsContact O-N 3.17Å
310	W	45.2	Very low	45.9	Very low	235 Å²	235	129.1 Å²	129.1	89%	0.89	71%	0.711	S	S	*	*			trans	-143.5	26.2	-179.9	-87.7	113.3	0	0	0	112.6
311	S	49.6	Very low	44.6	Very low	101 Å²	101	135.1 Å²	135.1	71%	0.706	74%	0.739	S	S	*	*			trans	-113.9	50.9	-176.2	59.8	0	0	0	0	112.6
312	N	47.6	Very low	43.7	Very low	141 Å²	141	135.8 Å²	135.8	75%	0.754	75%	0.745	S	S	*	*			trans	-144.1	52	-177.9	-85.8	-53.4	0	0	0	113.3
313	I	44	Very low	42.8	Very low	150 Å²	150	136.2 Å²	136.2	77%	0.769	75%	0.754	S	S	*	*			trans	-137	144.4	163.8	-54.1	-178.2	0	0	0	109
314	T	33	Very low	42.3	Very low	119 Å²	119	135.9 Å²	135.9	73%	0.73	77%	0.765	S	S	*	*			trans	84.7	68.8	174.7	-39.2	0	0	0	0	117.1
315	T	39.2	Very low	42.9	Very low	139 Å²	139	133.5 Å²	133.5	85%	0.853	77%	0.766	S	S	*	*				24	99	119.3	-44.5	0	0	0	0	118.3
316	S	37	Very low	42.4	Very low	118 Å²	118	132.2 Å²	132.2	83%	0.825	77%	0.767	S	S	*	*			trans	-170.5	148.9	133.3	51.6	0	0	0	0	112.5
317	A	37.7	Very low	42.1	Very low	93 Å²	93	133 Å²	133	77%	0.769	77%	0.77	S	S	*	*			trans	-156.3	173.8	170.6	0	0	0	0	0	107
318	P	57.2	Low	42.2	Very low	120 Å²	120	131.2 Å²	131.2	78%	0.779	77%	0.767	S	S	*	*			cis	-126.6	176.9	-6.5	41.1	-27.6	0	0	0	113.2
319	C	32.8	Very low	41.6	Very low	130 Å²	130	131.9 Å²	131.9	88%	0.878	76%	0.761	S	S	*	*			trans	-161.6	111.9	148	-124.5	0	0	0	0	115.9
320	M	37	Very low	41.2	Very low	150 Å²	150	134.4 Å²	134.4	74%	0.739	77%	0.767	S	S	*	*			trans	-4.3	145.1	149.7	-70.7	-70	-86.3	0	0	123.1
321	M	35	Very low	40.6	Very low	150 Å²	150	127.5 Å²	127.5	74%	0.739	75%	0.754	S	S	*	*			trans	71.7	155.1	149.6	-67.6	-58.4	100.4	0	0	118.3
322	S	36.9	Very low	40.7	Very low	90 Å²	90	128.3 Å²	128.3	63%	0.629	76%	0.757	S	S	*	*			cis	-166.3	152.5	-3.8	36.2	0	0	0	0	113.6
323	L	34.3	Very low	40.2	Very low	170 Å²	170	129.2 Å²	129.2	89%	0.89	76%	0.757	S	S	*	*			trans	65	132.9	146.9	-66.4	166.9	0	0	0	123.1
324	S	40.1	Very low	39.5	Very low	109 Å²	109	128.1 Å²	128.1	76%	0.762	75%	0.748	S	S	*	*			trans	-88.2	-168.8	157.1	-34.4	0	0	0	0	109.8
325	P	61.6	Low	39.5	Very low	111 Å²	111	129.3 Å²	129.3	72%	0.721	75%	0.75	S	S	*	*			cis	-143.6	-178.1	10.3	38.2	-15.1	0	0	0	117.2
326	L	34.3	Very low	39.1	Very low	162 Å²	162	127.3 Å²	127.3	85%	0.848	74%	0.741	S	S	*	*				172	169.9	118.5	-88.7	173	0	0	0	113.4
327	T	39.7	Very low	39.1	Very low	124 Å²	124	130.6 Å²	130.6	76%	0.761	74%	0.741	S	S	*	*			trans	-134	-164.5	-168.7	63.4	0	0	0	0	109.8
328	P	51.4	Low	38.7	Very low	108 Å²	108	135.1 Å²	135.1	70%	0.701	75%	0.746	S	S	*	*			cis	-126.1	-177.5	-10.2	31.3	-8	0	0	0	113.6
329	H	34.6	Very low	37.7	Very low	148 Å²	148	133.3 Å²	133.3	69%	0.685	74%	0.741	S	S	*	*				147.7	144.5	88.1	-170.4	-107.7	0	0	0	106.8
330	K	36.3	Very low	37.9	Very low	155 Å²	155	134.1 Å²	134.1	67%	0.674	74%	0.742	S	S	*	*			cis	-159.6	145.1	-11.3	-113.9	-171.6	-166.6	143.3	0	106.8
331	S	33.6	Very low	37.8	Very low	90 Å²	90	132 Å²	132	63%	0.629	74%	0.742	S	S	*	*				60.6	147.4	85.1	89.6	0	0	0	0	116.5
332	P	50.7	Low	38.2	Very low	117 Å²	117	132.8 Å²	132.8	76%	0.76	75%	0.748	S	S	*	*			cis	-113.6	158.2	21.7	9.4	16.1	0	0	0	114.8
333	Q	38.8	Very low	39	Very low	161 Å²	161	133.8 Å²	133.8	75%	0.752	75%	0.752	S	S	*	*			cis	79.6	139	46.8	-170.3	-176.7	-9.5	0	0	112.7
334	E	28.2	Very low	39	Very low	126 Å²	126	136.7 Å²	136.7	59%	0.589	75%	0.752	S	S	*	*			cis	-92.1	-168.1	9.1	-79.8	-73.2	89.7	0	0	114.4
335	L	33.3	Very low	39.1	Very low	145 Å²	145	143 Å²	143	76%	0.759	76%	0.759	S	S	*	*			cis	79	150.6	18.5	-96.7	72.7	0	0	0	116.7
336	S	31.6	Very low	37.7	Very low	97 Å²	97	149.7 Å²	149.7	68%	0.678	77%	0.77	S	S	*	*			cis	-156.4	160.8	-8.3	71.5	0	0	0	0	115
337	K	36.1	Very low	37.8	Very low	187 Å²	187	146.5 Å²	146.5	81%	0.813	76%	0.761	S	S	*	*			trans	1.2	144.8	161.8	-54.5	170.9	-175.2	171.3	0	122.7
338	E	30.1	Very low	37.6	Very low	187 Å²	187	147.4 Å²	147.4	87%	0.874	76%	0.76	S	S	*	*				-157.8	177.9	119	-142.3	59.5	-87.4	0	0	111.2
339	A	36.5	Very low	37	Very low	83 Å²	83	150.2 Å²	150.2	69%	0.686	76%	0.764	S	S	*	*			trans	-140	-174.8	-164.6	0	0	0	0	0	116.1
340	V	34.9	Very low	37	Very low	146 Å²	146	153.5 Å²	153.5	89%	0.885	77%	0.77	S	S	*	*			trans	79.9	137.6	173.9	-175.5	0	0	0	0	113.8
341	S	35.1	Very low	36.8	Very low	107 Å²	107	151.4 Å²	151.4	75%	0.748	77%	0.766	S	S	*	*			cis	-146.2	166.8	15.7	37.3	0	0	0	0	115.1
342	L	45	Very low	36.6	Very low	165 Å²	165	153.5 Å²	153.5	86%	0.864	77%	0.77	S	S	*	*			trans	-106.4	168.8	153.9	-73	175.1	0	0	0	108.2
343	P	53.9	Low	36	Very low	111 Å²	111	157.8 Å²	157.8	72%	0.721	77%	0.771	S	S	*	*			cis	-130.1	-154.6	19.3	36.3	-11.5	0	0	0	111.9
344	R	33	Very low	36.5	Very low	232 Å²	232	155.9 Å²	155.9	88%	0.875	77%	0.773	S	S	*	*			cis	-171.3	150.7	37.5	-159.3	176.2	-171.3	134.8	1.5	113.2
345	R	42	Very low	36.8	Very low	241 Å²	241	154.8 Å²	154.8	91%	0.909	78%	0.779	S	S	*	*			trans	-86.9	147.7	166.8	-86.1	-176.6	166.1	-138.2	2.1	112.3
346	R	32.9	Very low	37.1	Very low	252 Å²	252	155.2 Å²	155.2	95%	0.951	78%	0.782	S	S	*	*			trans	-155.8	169.7	145	-137.2	175.6	-178.3	174.8	0.1	110.9
347	S	36.1	Very low	37.2	Very low	94 Å²	94	161.9 Å²	161.9	66%	0.657	79%	0.792	S	S	*	*			trans	-163.7	150.8	-159.4	56.1	0	0	0	0	114.6
348	L	35.9	Very low	38	Very low	143 Å²	143	157.9 Å²	157.9	75%	0.749	79%	0.786	S	S	*	*			trans	65.3	163.5	160.6	-60.6	165.2	0	0	0	116.7
349	H	38	Very low	38.2	Very low	168 Å²	168	156.7 Å²	156.7	78%	0.778	78%	0.784	S	S	*	*			cis	-114.3	-158.5	-13.1	-79.7	-80.3	0	0	0	108.6
350	R	34.7	Very low	38	Very low	216 Å²	216	157.9 Å²	157.9	82%	0.815	79%	0.787	S	S	*	*			cis	-156.1	172	0.9	-143.6	-169.4	164.3	149.8	-0.1	105.9
351	N	32.5	Very low	38	Very low	112 Å²	112	156.1 Å²	156.1	60%	0.599	78%	0.776	S	S	*	*			cis	-141.5	-147.1	2.3	-157.2	30.1	0	0	0	106.1
352	N	29	Very low	37.9	Very low	134 Å²	134	160.1 Å²	160.1	72%	0.717	78%	0.783	S	S	*	*			cis	-154.4	-169.5	-6.4	-161.9	11.5	0	0	0	108.9
353	R	39.3	Very low	37.1	Very low	207 Å²	207	156 Å²	156	78%	0.781	78%	0.78	S	S	*	*			trans	-152.4	178.2	168.8	-120.1	-177.5	-177.2	-166	-0.6	110.8
354	P	47.7	Very low	36	Very low	121 Å²	121	159 Å²	159	79%	0.786	79%	0.789	S	S	*	*			cis	-128.3	-130.1	40.6	27.3	-1.3	0	0	0	114
355	S	35.6	Very low	35.8	Very low	102 Å²	102	153.5 Å²	153.5	71%	0.713	78%	0.781	S	S	*	*				-153.5	179	-94.4	-68.5	0	0	0	0	112.4
356	D	39.6	Very low	35.4	Very low	155 Å²	155	152.3 Å²	152.3	83%	0.829	78%	0.777	S	S	*	*			trans	-101.6	144.4	-171.5	-79.2	-73.5	0	0	0	117.4
357	R	33.8	Very low	35.7	Very low	236 Å²	236	145.1 Å²	145.1	89%	0.891	76%	0.761	S	S	*	*			trans	59.7	169.6	154.1	-81.3	-172.9	169.5	-165.4	-3	119.8
358	P	53.4	Low	35.8	Very low	104 Å²	104	146.4 Å²	146.4	68%	0.675	77%	0.767	S	S	*	*			cis	-138.1	171.2	-41.9	40.3	-23.6	0	0	0	116.3
359	I	33.6	Very low	36.4	Very low	162 Å²	162	144.7 Å²	144.7	83%	0.831	77%	0.765	S	S	*	*			trans	54.6	120.1	153	-65.4	168.9	0	0	0	122.7
360	S	32.2	Very low	36	Very low	107 Å²	107	144 Å²	144	75%	0.748	77%	0.766	S	S	*	*			trans	-172.6	135.1	143.4	-177	0	0	0	0	106.7
361	V	34.7	Very low	36	Very low	110 Å²	110	139 Å²	139	67%	0.667	77%	0.765	S	S	*	*			cis	82	126.5	47.1	173.8	0	0	0	0	113.7
362	Q	33.5	Very low	35.9	Very low	191 Å²	191	142.1 Å²	142.1	89%	0.893	78%	0.776	S	S	*	*			trans	69.6	141.3	-175.5	-61.6	157.6	15.8	0	0	116.2
363	G	28.8	Very low	35.9	Very low	77 Å²	77	141.8 Å²	141.8	79%	0.794	78%	0.779	S	S	*	*			cis	144.5	105.6	-18.7	0	0	0	0	0	115.4
364	L	29.6	Very low	35.5	Very low	175 Å²	175	137.4 Å²	137.4	92%	0.916	78%	0.775	S	S	*	*			trans	-154.6	147.3	166.1	-162.4	59	0	0	0	115.8
365	V	29.4	Very low	34.5	Very low	117 Å²	117	139.3 Å²	139.3	71%	0.709	77%	0.774	S	S	*	*			trans	-58.7	143.8	-176.2	170.4	0	0	0	0	117.4
366	R	32.3	Very low	34.2	Very low	216 Å²	216	138 Å²	138	82%	0.815	77%	0.769	S	S	*	*				-169.4	111.8	129.3	-104	-72.1	175.4	160.4	-0	115.3
367	T	39.7	Very low	33.6	Very low	101 Å²	101	139.1 Å²	139.1	62%	0.62	77%	0.767	S	S	*	*			trans	24.1	130.6	145.7	55.1	0	0	0	0	122.7
368	P	38.6	Very low	33.3	Very low	120 Å²	120	133.9 Å²	133.9	78%	0.779	76%	0.761	S	S	*	*			trans	-109.4	156.3	131.1	37.4	-30.4	0	0	0	112
369	P	49.1	Very low	32.3	Very low	108 Å²	108	134 Å²	134	70%	0.701	76%	0.764	S	S	*	*			trans	-96.6	153.2	169.6	37.4	-32.7	0	0	0	113.3
370	D	29.2	Very low	33.4	Very low	152 Å²	152	131.4 Å²	131.4	81%	0.813	76%	0.758	S	S	*	*			trans	47.4	142.4	132.5	-53.4	-10.8	0	0	0	121.6
371	S	33.8	Very low	33.2	Very low	113 Å²	113	133 Å²	133	79%	0.79	76%	0.757	S	S	*	*			cis	-161.1	175.5	-9	-114.9	0	0	0	0	112
372	Q	31.3	Very low	32.8	Very low	176 Å²	176	132.9 Å²	132.9	82%	0.822	76%	0.756	S	S	*	*			trans	-85.3	154.6	179.7	-57.6	168	8.3	0	0	113.3
373	T	28.7	Very low	32.6	Very low	128 Å²	128	128.8 Å²	128.8	79%	0.785	75%	0.749	S	S	*	*				-169.9	121.7	126.8	32.5	0	0	0	0	107.8
374	T	30.5	Very low	32.6	Very low	115 Å²	115	133.5 Å²	133.5	71%	0.706	75%	0.75	S	S	*	*				57.1	133.5	80.4	52.4	0	0	0	0	113.8
375	E	27.5	Very low	32.5	Very low	161 Å²	161	134.5 Å²	134.5	75%	0.752	74%	0.741	S	S	*	*			cis	-133.1	153.6	9.9	-75.7	-155.4	171.9	0	0	110.9
376	A	28.2	Very low	32.5	Very low	74 Å²	74	136 Å²	136	61%	0.612	74%	0.744	S	S	*	*			cis	95.3	144	46.1	0	0	0	0	0	114.5
377	F	28.6	Very low	32.2	Very low	179 Å²	179	130.4 Å²	130.4	79%	0.785	74%	0.739	S	S	*	*			trans	69	146.7	177.3	-50	-69.8	0	0	0	116.9
378	T	26.6	Very low	31.7	Very low	126 Å²	126	132.6 Å²	132.6	77%	0.773	75%	0.747	S	S	*	*			cis	-146.6	153.4	-1.8	-9.4	0	0	0	0	111
379	S	33.6	Very low	31.1	Very low	106 Å²	106	130 Å²	130	74%	0.741	74%	0.741	S	S	*	*			trans	-108.3	-175	151.9	-56.8	0	0	0	0	107.4
380	P	55	Low	30.2	Very low	108 Å²	108	133.2 Å²	133.2	70%	0.701	75%	0.747	S	S	*	*			cis	-141.8	-144.4	4.9	28.4	0	0	0	0	112.7
381	I	29.5	Very low	30.5	Very low	140 Å²	140	137.3 Å²	137.3	72%	0.718	75%	0.751	S	S	*	*			trans	103.1	123.6	141.2	-84.3	163.8	0	0	0	120.7
382	T	26	Very low	31.8	Very low	107 Å²	107	137.6 Å²	137.6	66%	0.656	75%	0.75	S	S	*	*			trans	48.4	128.5	159.7	53.9	0	0	0	0	120.3
383	S	29.6	Very low	31.7	Very low	105 Å²	105	132.8 Å²	132.8	73%	0.734	75%	0.748	S	S	*	*			cis	72.4	108.3	41	-55.3	0	0	0	0	115
384	H	27.8	Very low	32	Very low	176 Å²	176	132 Å²	132	82%	0.815	75%	0.748	S	S	*	*			trans	169	156.1	149.8	-90.1	-41.2	0	0	0	108.6
385	R	27.4	Very low	32.2	Very low	196 Å²	196	131.5 Å²	131.5	74%	0.74	75%	0.749	S	S	*	*			cis	-170.9	161.9	-26.7	-155.7	-171.8	-175.7	-164.1	3.2	106.5
386	L	29.7	Very low	32.6	Very low	148 Å²	148	131.5 Å²	131.5	78%	0.775	75%	0.754	S	S	*	*			trans	69.3	156.7	162.8	-57.3	-174.4	0	0	0	116.3
387	S	26.5	Very low	32.8	Very low	100 Å²	100	131.4 Å²	131.4	70%	0.699	76%	0.761	S	S	*	*			cis	-159.2	167.3	-14.9	164	0	0	0	0	111.4
388	N	28.6	Very low	32.9	Very low	146 Å²	146	127.1 Å²	127.1	78%	0.781	77%	0.766	S	S	*	*			trans	-33.6	160.4	161.1	-51.9	-12.2	0	0	0	115.7
389	G	26.6	Very low	33.1	Very low	65 Å²	65	124.8 Å²	124.8	67%	0.67	77%	0.767	S	S	*	*			cis	154.8	-157	0.6	0	0	0	0	0	113.1
390	H	29.8	Very low	33.2	Very low	177 Å²	177	128 Å²	128	82%	0.819	78%	0.775	S	S	*	*			trans	71.4	126.8	177.6	-53	-93.8	0	0	0	116
391	R	34.3	Very low	32.3	Very low	237 Å²	237	130.1 Å²	130.1	89%	0.894	78%	0.78	S	S	*	*			cis	85.9	151.7	46.4	-99.2	-151	-157.4	-115.8	7.7	114.3
392	P	62.5	Low	32.7	Very low	119 Å²	119	129.5 Å²	129.5	77%	0.773	78%	0.783	S	S	*	*				-138.1	-177.1	-113.8	44.2	-26.4	0	0	0	116.5
393	G	29.3	Very low	33.4	Very low	75 Å²	75	129.3 Å²	129.3	77%	0.773	78%	0.783	S	S	*	*			trans	144.1	166.9	164.7	0	0	0	0	0	113
394	S	33.7	Very low	33.5	Very low	112 Å²	112	130.2 Å²	130.2	78%	0.783	79%	0.788	S	S	*	*			cis	-169	150.5	-18.7	-168.8	0	0	0	0	110.6
395	S	34.6	Very low	33.8	Very low	104 Å²	104	129.3 Å²	129.3	73%	0.727	79%	0.79	S	S	*	*			trans	68.4	162.3	164.2	86.1	0	0	0	0	117.3
396	N	36.6	Very low	34.6	Very low	161 Å²	161	124.9 Å²	124.9	86%	0.861	79%	0.789	S	S	*	*			cis	-155.4	157.3	2.2	-141.9	-5.2	0	0	0	113.7
397	G	31.7	Very low	34.8	Very low	73 Å²	73	127.1 Å²	127.1	75%	0.753	80%	0.795	S	S	*	*			trans	78	140.2	170	0	0	0	0	0	116.5
398	G	31.4	Very low	35.1	Very low	88 Å²	88	127.5 Å²	127.5	91%	0.907	80%	0.804	S	S	*	*			cis	109.4	121.2	-3.6	0	0	0	0	0	113.7
399	G	30.7	Very low	35.6	Very low	77 Å²	77	127.9 Å²	127.9	79%	0.794	81%	0.806	S	S	*	*			cis	162.6	154.7	-9.4	0	0	0	0	0	112.7
400	L	35.5	Very low	36.1	Very low	174 Å²	174	129.1 Å²	129.1	91%	0.911	80%	0.804	S	S	*	*			trans	-154.4	144.1	161.6	-161.9	63.9	0	0	0	110.2
401	L	37.3	Very low	36.6	Very low	153 Å²	153	132.3 Å²	132.3	80%	0.801	81%	0.809	S	S	*	*			trans	-96.7	160.3	-179.3	-55	175.7	0	0	0	109.3
402	T	36.7	Very low	36.9	Very low	127 Å²	127	126.1 Å²	126.1	78%	0.779	81%	0.809	S	S	*	*				171	155.1	70.5	-49.5	0	0	0	0	107.8
403	P	40.2	Very low	36.3	Very low	102 Å²	102	124.9 Å²	124.9	66%	0.662	81%	0.808	S	S	*	*			cis	-119.3	162.2	-42	37.2	-23.3	0	0	0	112.2
404	C	31.7	Very low	37.7	Very low	124 Å²	124	126.7 Å²	126.7	84%	0.838	81%	0.809	S	S	*	*			trans	-94.3	125.4	160.2	-65.7	0	0	0	0	109.8
405	N	35.8	Very low	38.7	Very low	158 Å²	158	125.2 Å²	125.2	85%	0.845	80%	0.797	S	S	*	*			trans	-100	115.5	161.5	-76.4	-1.1	0	0	0	108.4
406	S	42.6	Very low	40.2	Very low	102 Å²	102	123.5 Å²	123.5	71%	0.713	79%	0.785	S	S	*	*			trans	-103.3	155.9	174.6	-63.1	0	0	0	0	110.8
407	E	35	Very low	41.4	Very low	196 Å²	196	122.7 Å²	122.7	92%	0.916	78%	0.78	S	S	*	*			trans	63.8	91.5	162.9	-62.9	-178.7	-173.4	0	0	118.3
408	A	31.9	Very low	43.2	Very low	107 Å²	107	126.2 Å²	126.2	88%	0.884	78%	0.781	S	S	*	*			trans	-131.4	126.4	141.7	0	0	0	0	0	108.4
409	N	39.6	Very low	45.1	Very low	155 Å²	155	125.6 Å²	125.6	83%	0.829	76%	0.757	S	S	*	*			trans	-92.1	151.6	-171.5	-164.1	10.9	0	0	0	112.3
410	S	37.6	Very low	47.4	Very low	90 Å²	90	125.9 Å²	125.9	63%	0.629	74%	0.74	S	S	*	*			trans	63.3	96.4	161.3	-61.6	0	0	0	0	119.3
411	R	39.9	Very low	49.9	Very low	245 Å²	245	122 Å²	122	93%	0.925	72%	0.723	S	S	*	*				176.1	131.7	116.7	-93.7	154.6	-175.7	166.9	2.6	110.9	A413	R411-A413 PolarHBondContact O-N 3.02Å
412	A	41.4	Very low	52.3	Low	106 Å²	106	117.7 Å²	117.7	88%	0.876	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-74.1	121.8	165.2	0	0	0	0	0	108.8
413	A	49.7	Very low	54.7	Low	93 Å²	93	115.7 Å²	115.7	77%	0.769	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-74.7	135.2	169.5	0	0	0	0	0	109.4	R411	R411-A413 PolarHBondContact O-N 3.02Å
414	S	58.2	Low	56.9	Low	113 Å²	113	115.6 Å²	115.6	79%	0.79	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-63.2	131.3	170.9	-54.7	0	0	0	0	109.5
415	P	54.8	Low	59.9	Low	82 Å²	82	114.3 Å²	114.3	53%	0.532	65%	0.65	S	S	.	*	P	Polyproline II helix	trans	-61	141.4	176.9	25.7	-33.8	0	0	0	110.2	D419	P415-D419 HydrophobicContact CB-CB 4.19Å; P415-D419 WeakPolarHBondContact CB-OD2 3.46Å
416	S	66.1	Low	62.6	Low	67 Å²	67	111.8 Å²	111.8	47%	0.469	63%	0.632	S	S	.	*	P	Polyproline II helix	trans	-70.3	162.5	179.9	77.6	0	0	0	0	111.5	L418 D419 L420	S416-L418 PolarHBondContact O-N 2.91Å; S416-D419 WeakPolarHBondContact O-CB 3.38Å; S416-D419 PolarHBondContact O-N 2.83Å; S416-D419 PolarHBondContact OG-N 3.33Å; S416-L420 PolarHBondContact O-N 2.99Å
417	L	61.7	Low	64.9	Low	144 Å²	144	111.4 Å²	111.4	75%	0.754	62%	0.621	S	S	*	*	H	α-helix	trans	-58.1	-32.3	177.6	-108	171	0	0	0	113.1	V421	L417-V421 WeakPolarHBondContact O-CG2 3.35Å; L417-V421 PolarHBondContact O-N 3.36Å
418	L	68.8	Low	67.6	Low	148 Å²	148	109.4 Å²	109.4	78%	0.775	61%	0.605	S	S	*	*	H	α-helix	trans	-69.3	-39.3	174.9	-69.5	166.5	0	0	0	111.9	S416 V421 E422	S416-L418 PolarHBondContact O-N 2.91Å; L418-V421 PolarHBondContact O-N 2.74Å; L418-E422 WeakPolarHBondContact O-CB 3.44Å; L418-E422 PolarHBondContact O-N 2.97Å
419	D	72.6	Confident	70.5	Confident	75 Å²	75	108.8 Å²	108.8	40%	0.401	58%	0.584	S	S	.	*	H	α-helix	trans	-68.3	-38.3	179.3	-163.9	28.2	0	0	0	111.1	P415 S416 E422 I423	P415-D419 HydrophobicContact CB-CB 4.19Å; P415-D419 WeakPolarHBondContact CB-OD2 3.46Å; S416-D419 WeakPolarHBondContact O-CB 3.38Å; S416-D419 PolarHBondContact O-N 2.83Å; S416-D419 PolarHBondContact OG-N 3.33Å; D419-E422 PolarHBondContact O-N 2.89Å; D419-I423 WeakPolarHBondContact O-CB 3.38Å; D419-I423 WeakPolarHBondContact O-CD1 3.29Å; D419-I423 VanDerWaalsContact O-CG1 3.23Å; D419-I423 WeakPolarHBondContact O-CG1 3.5Å; D419-I423 PolarHBondContact O-N 3.01Å
420	L	78.4	Confident	72.8	Confident	83 Å²	83	104.3 Å²	104.3	44%	0.435	57%	0.569	S	S	.	*	H	α-helix	trans	-62.8	-43	172.3	-177.4	60.9	0	0	0	112.5	S416 I423 E424	S416-L420 PolarHBondContact O-N 2.99Å; L420-I423 PolarHBondContact O-N 3.39Å; L420-E424 PolarHBondContact O-N 2.85Å
421	V	88.1	Confident	74.9	Confident	91 Å²	91	106.4 Å²	106.4	55%	0.552	57%	0.567	S	S	*	*	H	α-helix	trans	-65.7	-39.2	176.5	170.6	0	0	0	0	111.5	L417 L418 E424 R425	L417-V421 WeakPolarHBondContact O-CG2 3.35Å; L417-V421 PolarHBondContact O-N 3.36Å; L418-V421 PolarHBondContact O-N 2.74Å; V421-E424 PolarHBondContact O-N 3.32Å; V421-R425 WeakPolarHBondContact O-CB 3.46Å; V421-R425 PolarHBondContact O-N 2.97Å
422	E	88.5	Confident	77.5	Confident	63 Å²	63	97.6 Å²	97.6	29%	0.294	55%	0.546	S	S	.	.	H	α-helix	trans	-64.6	-38.1	174.7	178.4	67.3	178.2	0	0	112	L418 D419 R425 K426	L418-E422 WeakPolarHBondContact O-CB 3.44Å; L418-E422 PolarHBondContact O-N 2.97Å; D419-E422 PolarHBondContact O-N 2.89Å; E422-R425 IonicContact OE1-CZ 2.76Å; E422-R425 IonicContact OE1-NH2 3.2Å; E422-R425 PolarHBondContact OE1-NH2 3.36Å; E422-R425 IonicContact OE2-CZ 2.77Å; E422-R425 VanDerWaalsContact OE2-CZ 3.26Å; E422-R425 IonicContact OE2-NE 3.9Å; E422-R425 PolarHBondContact OE2-NE 3.35Å; E422-R425 IonicContact OE2-NH2 3.76Å; E422-R425 PolarHBondContact OE2-NH2 3.07Å; E422-K426 HydrophobicContact CG-CD 4.44Å; E422-K426 VanDerWaalsContact CG-NZ 3.35Å; E422-K426 WeakPolarHBondContact O-CG 3.27Å; E422-K426 PolarHBondContact O-N 3.37Å; E422-K426 WeakPolarHBondContact OE1-CE 3.45Å; E422-K426 IonicContact OE1-NZ 3.15Å; E422-K426 PolarHBondContact OE1-NZ 3.06Å
423	I	85.5	Confident	79.8	Confident	86 Å²	86	96.5 Å²	96.5	44%	0.441	52%	0.523	S	S	.	.	H	α-helix	trans	-68.6	-44.2	173.2	-70.9	163.3	0	0	0	111.4	D419 L420 R425 K426 L427	D419-I423 WeakPolarHBondContact O-CB 3.38Å; D419-I423 WeakPolarHBondContact O-CD1 3.29Å; D419-I423 VanDerWaalsContact O-CG1 3.23Å; D419-I423 WeakPolarHBondContact O-CG1 3.5Å; D419-I423 PolarHBondContact O-N 3.01Å; L420-I423 PolarHBondContact O-N 3.39Å; I423-R425 VanDerWaalsContact C-N 3.32Å; I423-R425 PolarHBondContact O-N 2.87Å; I423-K426 PolarHBondContact O-N 2.9Å; I423-L427 WeakPolarHBondContact O-CB 3.4Å; I423-L427 PolarHBondContact O-N 3.44Å
424	E	88.1	Confident	81.7	Confident	99 Å²	99	100.8 Å²	100.8	46%	0.463	52%	0.519	S	S	.	.	H	α-helix	trans	-61.9	-39.4	175.2	-80.6	-163.6	-173.8	0	0	112.4	L420 V421 L427 R428	L420-E424 PolarHBondContact O-N 2.85Å; V421-E424 PolarHBondContact O-N 3.32Å; E424-L427 PolarHBondContact O-N 2.66Å; E424-R428 WeakPolarHBondContact O-CB 3.39Å; E424-R428 PolarHBondContact O-N 3.23Å; E424-R428 IonicContact OE2-NH2 2.77Å
425	R	94.3	Very high	83.1	Confident	97 Å²	97	100.1 Å²	100.1	37%	0.366	50%	0.504	S	S	.	.	H	α-helix	trans	-59.6	-52.9	174.5	-176.8	-179.5	70.8	80.8	-6.9	110.7	V421 E422 I423 L427 R428 E429	V421-R425 WeakPolarHBondContact O-CB 3.46Å; V421-R425 PolarHBondContact O-N 2.97Å; E422-R425 IonicContact OE1-CZ 2.76Å; E422-R425 IonicContact OE1-NH2 3.2Å; E422-R425 PolarHBondContact OE1-NH2 3.36Å; E422-R425 IonicContact OE2-CZ 2.77Å; E422-R425 VanDerWaalsContact OE2-CZ 3.26Å; E422-R425 IonicContact OE2-NE 3.9Å; E422-R425 PolarHBondContact OE2-NE 3.35Å; E422-R425 IonicContact OE2-NH2 3.76Å; E422-R425 PolarHBondContact OE2-NH2 3.07Å; I423-R425 VanDerWaalsContact C-N 3.32Å; I423-R425 PolarHBondContact O-N 2.87Å; R425-L427 VanDerWaalsContact C-N 3.31Å; R425-L427 PolarHBondContact O-N 3.18Å; R425-R428 WeakPolarHBondContact O-CB 3.17Å; R425-R428 PolarHBondContact O-N 2.87Å; R425-R428 VanDerWaalsContact O-N 3.09Å; R425-E429 WeakPolarHBondContact CG-OE1 3.34Å; R425-E429 IonicContact CZ-OE1 2.69Å; R425-E429 VanDerWaalsContact NH1-CD 3.27Å; R425-E429 IonicContact NH1-OE1 2.67Å; R425-E429 PolarHBondContact NH1-OE1 3.09Å; R425-E429 IonicContact NH1-OE2 3.04Å; R425-E429 PolarHBondContact NH1-OE2 3.4Å; R425-E429 WeakPolarHBondContact O-CG 3.47Å; R425-E429 PolarHBondContact O-N 3.34Å
426	K	92.6	Very high	85.1	Confident	105 Å²	105	102 Å²	102	46%	0.457	50%	0.5	S	S	.	.	H	α-helix	trans	-60.9	-36.7	176.7	-73.3	167	-176.7	160.4	0	112.8	E422 I423 R428 E429 A430	E422-K426 HydrophobicContact CG-CD 4.44Å; E422-K426 VanDerWaalsContact CG-NZ 3.35Å; E422-K426 WeakPolarHBondContact O-CG 3.27Å; E422-K426 PolarHBondContact O-N 3.37Å; E422-K426 WeakPolarHBondContact OE1-CE 3.45Å; E422-K426 IonicContact OE1-NZ 3.15Å; E422-K426 PolarHBondContact OE1-NZ 3.06Å; I423-K426 PolarHBondContact O-N 2.9Å; K426-R428 VanDerWaalsContact C-N 3.34Å; K426-E429 PolarHBondContact O-N 2.93Å; K426-A430 VanDerWaalsContact O-CB 3.25Å; K426-A430 WeakPolarHBondContact O-CB 3.41Å; K426-A430 PolarHBondContact O-N 3.43Å
427	L	91.3	Very high	86.3	Confident	94 Å²	94	102.9 Å²	102.9	49%	0.492	50%	0.499	S	S	.	.	H	α-helix	trans	-67.2	-34.4	175.5	-173.1	68.2	0	0	0	112.2	I423 E424 R425 K431	I423-L427 WeakPolarHBondContact O-CB 3.4Å; I423-L427 PolarHBondContact O-N 3.44Å; E424-L427 PolarHBondContact O-N 2.66Å; R425-L427 VanDerWaalsContact C-N 3.31Å; R425-L427 PolarHBondContact O-N 3.18Å; L427-K431 WeakPolarHBondContact O-CB 3.12Å; L427-K431 WeakPolarHBondContact O-CD 3.44Å; L427-K431 VanDerWaalsContact O-CG 3.23Å; L427-K431 WeakPolarHBondContact O-CG 3.44Å; L427-K431 PolarHBondContact O-N 3.21Å
428	R	91.6	Very high	87.5	Confident	154 Å²	154	100.9 Å²	100.9	58%	0.581	49%	0.489	S	S	*	.	H	α-helix	trans	-71.5	-44.5	175.6	-166.4	179	-64.4	101.5	2.5	111.1	E424 R425 K426 K431 A432	E424-R428 WeakPolarHBondContact O-CB 3.39Å; E424-R428 PolarHBondContact O-N 3.23Å; E424-R428 IonicContact OE2-NH2 2.77Å; R425-R428 WeakPolarHBondContact O-CB 3.17Å; R425-R428 PolarHBondContact O-N 2.87Å; R425-R428 VanDerWaalsContact O-N 3.09Å; K426-R428 VanDerWaalsContact C-N 3.34Å; R428-K431 PolarHBondContact O-N 3.46Å; R428-A432 PolarHBondContact O-N 3.05Å
429	E	92.3	Very high	88.6	Confident	95 Å²	95	101.7 Å²	101.7	44%	0.444	48%	0.481	S	S	.	.	H	α-helix	trans	-61.1	-49.1	174.6	-72.1	163	-171.7	0	0	111.6	R425 K426 K431 A432 E433	R425-E429 WeakPolarHBondContact CG-OE1 3.34Å; R425-E429 IonicContact CZ-OE1 2.69Å; R425-E429 VanDerWaalsContact NH1-CD 3.27Å; R425-E429 IonicContact NH1-OE1 2.67Å; R425-E429 PolarHBondContact NH1-OE1 3.09Å; R425-E429 IonicContact NH1-OE2 3.04Å; R425-E429 PolarHBondContact NH1-OE2 3.4Å; R425-E429 WeakPolarHBondContact O-CG 3.47Å; R425-E429 PolarHBondContact O-N 3.34Å; K426-E429 PolarHBondContact O-N 2.93Å; E429-K431 VanDerWaalsContact C-N 3.29Å; E429-K431 PolarHBondContact O-N 2.93Å; E429-A432 PolarHBondContact O-N 3.28Å; E429-A432 VanDerWaalsContact O-N 3.16Å; E429-E433 PolarHBondContact O-N 3.43Å
430	A	88.6	Confident	89.7	Confident	61 Å²	61	100.9 Å²	100.9	50%	0.504	48%	0.475	S	S	.	.	H	α-helix	trans	-63.4	-31.1	178.1	0	0	0	0	0	113.6	K426 R434	K426-A430 VanDerWaalsContact O-CB 3.25Å; K426-A430 WeakPolarHBondContact O-CB 3.41Å; K426-A430 PolarHBondContact O-N 3.43Å; A430-R434 WeakPolarHBondContact O-CB 3.36Å; A430-R434 PolarHBondContact O-N 3.49Å; A430-R434 VanDerWaalsContact O-N 3.09Å
431	K	81.1	Confident	89.8	Confident	134 Å²	134	105 Å²	105	58%	0.583	49%	0.485	S	S	*	.	H	α-helix	trans	-69.4	-45	172.5	-78.3	170.9	-179	177	0	111.6	L427 R428 E429 R434 E435	L427-K431 WeakPolarHBondContact O-CB 3.12Å; L427-K431 WeakPolarHBondContact O-CD 3.44Å; L427-K431 VanDerWaalsContact O-CG 3.23Å; L427-K431 WeakPolarHBondContact O-CG 3.44Å; L427-K431 PolarHBondContact O-N 3.21Å; R428-K431 PolarHBondContact O-N 3.46Å; E429-K431 VanDerWaalsContact C-N 3.29Å; E429-K431 PolarHBondContact O-N 2.93Å; K431-R434 PolarHBondContact O-N 3.17Å; K431-E435 PolarHBondContact O-N 2.91Å
432	A	93.4	Very high	89.9	Confident	59 Å²	59	103.2 Å²	103.2	49%	0.488	48%	0.48	S	S	.	.	H	α-helix	trans	-63.4	-42.5	176.9	0	0	0	0	0	112	R428 E429 E435 R436	R428-A432 PolarHBondContact O-N 3.05Å; E429-A432 PolarHBondContact O-N 3.28Å; E429-A432 VanDerWaalsContact O-N 3.16Å; A432-E435 PolarHBondContact O-N 3.12Å; A432-R436 PolarHBondContact O-N 2.92Å
433	E	91	Very high	90.1	Very high	83 Å²	83	104.7 Å²	104.7	39%	0.388	49%	0.487	S	S	.	.	H	α-helix	trans	-63.5	-45.2	176.9	-171.5	63.8	-166.4	0	0	111.7	E429 E435 R436 L437	E429-E433 PolarHBondContact O-N 3.43Å; E433-E435 VanDerWaalsContact C-N 3.28Å; E433-E435 PolarHBondContact O-N 3.49Å; E433-R436 PolarHBondContact O-N 3.4Å; E433-R436 IonicContact OE1-CZ 3.49Å; E433-R436 IonicContact OE1-NH1 3.74Å; E433-R436 PolarHBondContact OE1-NH1 3.27Å; E433-R436 IonicContact OE1-NH2 3.21Å; E433-R436 PolarHBondContact OE1-NH2 2.96Å; E433-R436 IonicContact OE2-CZ 2.66Å; E433-R436 IonicContact OE2-NH1 3.42Å; E433-R436 PolarHBondContact OE2-NH1 3Å; E433-R436 IonicContact OE2-NH2 3.18Å; E433-L437 HydrophobicContact CG-CD1 4.19Å; E433-L437 WeakPolarHBondContact O-CG 3.19Å; E433-L437 PolarHBondContact O-N 2.94Å
434	R	89.8	Confident	90.4	Very high	184 Å²	184	107.4 Å²	107.4	69%	0.694	49%	0.492	S	S	*	.	H	α-helix	trans	-58.8	-40.3	173.6	176.8	176.8	171.9	171.8	-1.8	111.8	A430 K431 L438	A430-R434 WeakPolarHBondContact O-CB 3.36Å; A430-R434 PolarHBondContact O-N 3.49Å; A430-R434 VanDerWaalsContact O-N 3.09Å; K431-R434 PolarHBondContact O-N 3.17Å; R434-L438 HydrophobicContact CG-CD1 4.17Å; R434-L438 VanDerWaalsContact O-CG 3.31Å; R434-L438 WeakPolarHBondContact O-CG 3.29Å; R434-L438 PolarHBondContact O-N 3.41Å
435	E	87.3	Confident	90.1	Very high	99 Å²	99	108.2 Å²	108.2	46%	0.463	50%	0.495	S	S	.	.	H	α-helix	trans	-68.2	-42.1	177.3	-162.5	-175.3	159.1	0	0	111.8	K431 A432 E433 L437 L438 R439	K431-E435 PolarHBondContact O-N 2.91Å; A432-E435 PolarHBondContact O-N 3.12Å; E433-E435 VanDerWaalsContact C-N 3.28Å; E433-E435 PolarHBondContact O-N 3.49Å; E435-L437 PolarHBondContact O-N 3.28Å; E435-L438 PolarHBondContact O-N 3.03Å; E435-R439 WeakPolarHBondContact O-CG 3.38Å; E435-R439 PolarHBondContact O-N 3Å; E435-R439 IonicContact OE1-CZ 3.39Å; E435-R439 VanDerWaalsContact OE1-CZ 3.32Å; E435-R439 IonicContact OE1-NE 3.79Å; E435-R439 PolarHBondContact OE1-NE 3.26Å; E435-R439 IonicContact OE1-NH2 2.82Å; E435-R439 PolarHBondContact OE1-NH2 2.96Å
436	R	96.9	Very high	89.9	Confident	121 Å²	121	110.3 Å²	110.3	46%	0.457	50%	0.503	S	S	.	.	H	α-helix	trans	-58	-49.6	174.3	-161.9	-163.7	76.9	-122.9	-12.4	110.8	A432 E433 L438 R439 E440	A432-R436 PolarHBondContact O-N 2.92Å; E433-R436 PolarHBondContact O-N 3.4Å; E433-R436 IonicContact OE1-CZ 3.49Å; E433-R436 IonicContact OE1-NH1 3.74Å; E433-R436 PolarHBondContact OE1-NH1 3.27Å; E433-R436 IonicContact OE1-NH2 3.21Å; E433-R436 PolarHBondContact OE1-NH2 2.96Å; E433-R436 IonicContact OE2-CZ 2.66Å; E433-R436 IonicContact OE2-NH1 3.42Å; E433-R436 PolarHBondContact OE2-NH1 3Å; E433-R436 IonicContact OE2-NH2 3.18Å; R436-L438 VanDerWaalsContact C-N 3.29Å; R436-L438 PolarHBondContact O-N 3.31Å; R436-R439 PolarHBondContact O-N 3.12Å; R436-R439 VanDerWaalsContact O-N 3.17Å; R436-E440 IonicContact NE-OE2 2.67Å; R436-E440 IonicContact NH2-OE2 3.55Å; R436-E440 VanDerWaalsContact O-CB 3.27Å; R436-E440 WeakPolarHBondContact O-CB 3.32Å; R436-E440 PolarHBondContact O-N 2.97Å
437	L	91.6	Very high	90	Very high	86 Å²	86	110.1 Å²	110.1	45%	0.45	51%	0.506	S	S	.	.	H	α-helix	trans	-62.8	-32.7	179.8	-69.4	169.3	0	0	0	112.9	E433 E435 R441	E433-L437 HydrophobicContact CG-CD1 4.19Å; E433-L437 WeakPolarHBondContact O-CG 3.19Å; E433-L437 PolarHBondContact O-N 2.94Å; E435-L437 PolarHBondContact O-N 3.28Å; L437-R441 VanDerWaalsContact O-CB 3.29Å; L437-R441 WeakPolarHBondContact O-CB 3.08Å; L437-R441 PolarHBondContact O-N 3.2Å
438	L	86.9	Confident	89.9	Confident	102 Å²	102	110.9 Å²	110.9	53%	0.534	51%	0.511	S	S	.	.	H	α-helix	trans	-69.8	-43.3	173	-75.9	169.5	0	0	0	112.1	R434 E435 R436 R441 A442	R434-L438 HydrophobicContact CG-CD1 4.17Å; R434-L438 VanDerWaalsContact O-CG 3.31Å; R434-L438 WeakPolarHBondContact O-CG 3.29Å; R434-L438 PolarHBondContact O-N 3.41Å; E435-L438 PolarHBondContact O-N 3.03Å; R436-L438 VanDerWaalsContact C-N 3.29Å; R436-L438 PolarHBondContact O-N 3.31Å; L438-R441 PolarHBondContact O-N 2.98Å; L438-A442 WeakPolarHBondContact O-CB 3.43Å; L438-A442 PolarHBondContact O-N 3.49Å
439	R	91.8	Very high	89.7	Confident	165 Å²	165	109.3 Å²	109.3	62%	0.623	51%	0.513	S	S	*	.	H	α-helix	trans	-62.3	-45.6	174.1	-66.9	173.3	-177.1	-152.9	5.3	111.1	E435 R436 R441 A442 E443	E435-R439 WeakPolarHBondContact O-CG 3.38Å; E435-R439 PolarHBondContact O-N 3Å; E435-R439 IonicContact OE1-CZ 3.39Å; E435-R439 VanDerWaalsContact OE1-CZ 3.32Å; E435-R439 IonicContact OE1-NE 3.79Å; E435-R439 PolarHBondContact OE1-NE 3.26Å; E435-R439 IonicContact OE1-NH2 2.82Å; E435-R439 PolarHBondContact OE1-NH2 2.96Å; R436-R439 PolarHBondContact O-N 3.12Å; R436-R439 VanDerWaalsContact O-N 3.17Å; R439-R441 VanDerWaalsContact C-N 3.33Å; R439-R441 PolarHBondContact O-N 3.25Å; R439-A442 PolarHBondContact O-N 3.45Å; R439-E443 WeakPolarHBondContact O-CB 3.18Å; R439-E443 PolarHBondContact O-N 3.18Å
440	E	93.8	Very high	89.5	Confident	57 Å²	57	109.4 Å²	109.4	27%	0.266	51%	0.513	S	S	.	.	H	α-helix	trans	-62	-37.6	178	-162.9	-167.4	131.2	0	0	112	R436 R444	R436-E440 IonicContact NE-OE2 2.67Å; R436-E440 IonicContact NH2-OE2 3.55Å; R436-E440 VanDerWaalsContact O-CB 3.27Å; R436-E440 WeakPolarHBondContact O-CB 3.32Å; R436-E440 PolarHBondContact O-N 2.97Å; E440-R444 WeakPolarHBondContact O-CG 3.33Å; E440-R444 PolarHBondContact O-N 3.27Å; E440-R444 IonicContact OE1-CZ 2.66Å; E440-R444 IonicContact OE1-NH1 3.42Å; E440-R444 PolarHBondContact OE1-NH1 3.29Å; E440-R444 IonicContact OE1-NH2 2.63Å; E440-R444 PolarHBondContact OE1-NH2 2.94Å
441	R	81.6	Confident	89.4	Confident	169 Å²	169	110.4 Å²	110.4	64%	0.638	51%	0.508	S	S	*	.	H	α-helix	trans	-69.8	-42.3	173.6	-174.1	172.8	-176.5	152	2.5	112.3	L437 L438 R439 E443 R444 Q445	L437-R441 VanDerWaalsContact O-CB 3.29Å; L437-R441 WeakPolarHBondContact O-CB 3.08Å; L437-R441 PolarHBondContact O-N 3.2Å; L438-R441 PolarHBondContact O-N 2.98Å; R439-R441 VanDerWaalsContact C-N 3.33Å; R439-R441 PolarHBondContact O-N 3.25Å; R441-E443 VanDerWaalsContact C-N 3.33Å; R441-R444 PolarHBondContact O-N 3.11Å; R441-Q445 WeakPolarHBondContact O-CG 3.3Å; R441-Q445 PolarHBondContact O-N 3.15Å
442	A	90.1	Very high	89.4	Confident	55 Å²	55	111.4 Å²	111.4	46%	0.455	51%	0.508	S	S	.	.	H	α-helix	trans	-64.6	-37.9	175.6	0	0	0	0	0	111.7	L438 R439 Q445 R446	L438-A442 WeakPolarHBondContact O-CB 3.43Å; L438-A442 PolarHBondContact O-N 3.49Å; R439-A442 PolarHBondContact O-N 3.45Å; A442-Q445 PolarHBondContact O-N 3.41Å; A442-R446 PolarHBondContact O-N 3.45Å
443	E	91.8	Very high	88.7	Confident	93 Å²	93	111.1 Å²	111.1	44%	0.435	50%	0.502	S	S	.	.	H	α-helix	trans	-67.5	-43.4	175.4	-179.3	151.6	-124.4	0	0	112.4	R439 R441 Q445 R446 L447	R439-E443 WeakPolarHBondContact O-CB 3.18Å; R439-E443 PolarHBondContact O-N 3.18Å; R441-E443 VanDerWaalsContact C-N 3.33Å; E443-Q445 VanDerWaalsContact C-N 3.28Å; E443-Q445 PolarHBondContact O-N 3Å; E443-R446 PolarHBondContact O-N 3.02Å; E443-R446 VanDerWaalsContact O-N 3.16Å; E443-R446 IonicContact OE1-CZ 3.92Å; E443-R446 IonicContact OE1-NH2 2.69Å; E443-R446 PolarHBondContact OE1-NH2 3.07Å; E443-L447 HydrophobicContact CG-CD1 4.21Å; E443-L447 HydrophobicContact CG-CG 4.49Å; E443-L447 WeakPolarHBondContact O-CG 3.17Å; E443-L447 PolarHBondContact O-N 3.42Å
444	R	92	Very high	88.1	Confident	144 Å²	144	112.1 Å²	112.1	54%	0.543	51%	0.507	S	S	.	.	H	α-helix	trans	-58	-40	170.3	-75.2	-169.4	-174.8	94.1	3.5	112.2	E440 R441 L447 L448	E440-R444 WeakPolarHBondContact O-CG 3.33Å; E440-R444 PolarHBondContact O-N 3.27Å; E440-R444 IonicContact OE1-CZ 2.66Å; E440-R444 IonicContact OE1-NH1 3.42Å; E440-R444 PolarHBondContact OE1-NH1 3.29Å; E440-R444 IonicContact OE1-NH2 2.63Å; E440-R444 PolarHBondContact OE1-NH2 2.94Å; R441-R444 PolarHBondContact O-N 3.11Å; R444-L447 PolarHBondContact O-N 2.9Å; R444-L448 WeakPolarHBondContact O-CG 3.29Å; R444-L448 PolarHBondContact O-N 2.91Å
445	Q	81.4	Confident	87.5	Confident	115 Å²	115	110.9 Å²	110.9	54%	0.537	50%	0.502	S	S	.	.	H	α-helix	trans	-66.3	-38.7	175.6	-73.4	180	-60.2	0	0	112.3	R441 A442 E443 L449	R441-Q445 WeakPolarHBondContact O-CG 3.3Å; R441-Q445 PolarHBondContact O-N 3.15Å; A442-Q445 PolarHBondContact O-N 3.41Å; E443-Q445 VanDerWaalsContact C-N 3.28Å; E443-Q445 PolarHBondContact O-N 3Å; Q445-L449 WeakPolarHBondContact O-CG 3.47Å; Q445-L449 PolarHBondContact O-N 3.48Å
446	R	91.8	Very high	86.8	Confident	142 Å²	142	110.5 Å²	110.5	54%	0.536	50%	0.5	S	S	.	.	H	α-helix	trans	-62.2	-48	172.2	-176.4	-177.8	63.4	169.4	-3.1	111.3	A442 E443 L448 L449 E450	A442-R446 PolarHBondContact O-N 3.45Å; E443-R446 PolarHBondContact O-N 3.02Å; E443-R446 VanDerWaalsContact O-N 3.16Å; E443-R446 IonicContact OE1-CZ 3.92Å; E443-R446 IonicContact OE1-NH2 2.69Å; E443-R446 PolarHBondContact OE1-NH2 3.07Å; R446-L448 VanDerWaalsContact C-N 3.32Å; R446-L448 PolarHBondContact O-N 2.69Å; R446-L449 PolarHBondContact O-N 2.89Å; R446-L449 VanDerWaalsContact O-N 3.09Å; R446-E450 WeakPolarHBondContact O-CB 3.16Å; R446-E450 PolarHBondContact O-N 3.5Å
447	L	93.9	Very high	85.6	Confident	100 Å²	100	110.2 Å²	110.2	52%	0.524	51%	0.507	S	S	.	.	H	α-helix	trans	-61.2	-38.3	-179.5	-71.3	170.5	0	0	0	112.5	E443 R444 L449 E450 E451	E443-L447 HydrophobicContact CG-CD1 4.21Å; E443-L447 HydrophobicContact CG-CG 4.49Å; E443-L447 WeakPolarHBondContact O-CG 3.17Å; E443-L447 PolarHBondContact O-N 3.42Å; R444-L447 PolarHBondContact O-N 2.9Å; L447-L449 VanDerWaalsContact C-N 3.33Å; L447-L449 PolarHBondContact O-N 3.18Å; L447-E450 PolarHBondContact O-N 3.48Å; L447-E451 VanDerWaalsContact O-CB 3.27Å; L447-E451 WeakPolarHBondContact O-CB 3.35Å; L447-E451 PolarHBondContact O-N 2.97Å
448	L	88.8	Confident	84.5	Confident	111 Å²	111	111.1 Å²	111.1	58%	0.581	51%	0.513	S	S	*	.	H	α-helix	trans	-67.9	-30.6	174.6	-71.7	168.2	0	0	0	113.2	R444 R446 R452	R444-L448 WeakPolarHBondContact O-CG 3.29Å; R444-L448 PolarHBondContact O-N 2.91Å; R446-L448 VanDerWaalsContact C-N 3.32Å; R446-L448 PolarHBondContact O-N 2.69Å; L448-R452 VanDerWaalsContact O-CB 3.26Å; L448-R452 WeakPolarHBondContact O-CB 3.18Å; L448-R452 PolarHBondContact O-N 2.94Å; L448-R452 VanDerWaalsContact O-N 3.08Å
449	L	87.6	Confident	83.1	Confident	120 Å²	120	110.9 Å²	110.9	63%	0.628	52%	0.52	S	S	*	.	H	α-helix	trans	-76.2	-38.5	173.4	-69.5	169.5	0	0	0	111.7	Q445 R446 L447 R452 S453	Q445-L449 WeakPolarHBondContact O-CG 3.47Å; Q445-L449 PolarHBondContact O-N 3.48Å; R446-L449 PolarHBondContact O-N 2.89Å; R446-L449 VanDerWaalsContact O-N 3.09Å; L447-L449 VanDerWaalsContact C-N 3.33Å; L447-L449 PolarHBondContact O-N 3.18Å; L449-R452 PolarHBondContact O-N 3.27Å; L449-S453 WeakPolarHBondContact O-CB 3.42Å; L449-S453 PolarHBondContact O-N 3.38Å
450	E	87.4	Confident	81.1	Confident	98 Å²	98	110 Å²	110	46%	0.458	53%	0.527	S	S	.	.	H	α-helix	trans	-62.2	-48.7	173.6	-162.4	79.7	-128.5	0	0	110.7	R446 L447 R452 S453 Q454	R446-E450 WeakPolarHBondContact O-CB 3.16Å; R446-E450 PolarHBondContact O-N 3.5Å; L447-E450 PolarHBondContact O-N 3.48Å; E450-R452 PolarHBondContact O-N 2.97Å; E450-S453 PolarHBondContact O-N 3.1Å; E450-Q454 WeakPolarHBondContact O-CG 3.37Å; E450-Q454 PolarHBondContact O-N 3.22Å
451	E	86.9	Confident	79	Confident	82 Å²	82	117.5 Å²	117.5	38%	0.383	55%	0.553	S	S	.	*	H	α-helix	trans	-61.1	-43.3	175.7	-174.8	-173.5	-173	0	0	111.5	L447 Q454 R455	L447-E451 VanDerWaalsContact O-CB 3.27Å; L447-E451 WeakPolarHBondContact O-CB 3.35Å; L447-E451 PolarHBondContact O-N 2.97Å; E451-Q454 PolarHBondContact O-N 2.9Å; E451-R455 VanDerWaalsContact O-CG 3.26Å; E451-R455 WeakPolarHBondContact O-CG 3.16Å; E451-R455 PolarHBondContact O-N 3.42Å; E451-R455 IonicContact OE1-CZ 3.96Å; E451-R455 IonicContact OE1-NE 2.97Å; E451-R455 PolarHBondContact OE1-NE 2.76Å; E451-R455 IonicContact OE1-NH2 3.03Å; E451-R455 PolarHBondContact OE1-NH2 2.75Å
452	R	81.3	Confident	77.3	Confident	155 Å²	155	118 Å²	118	59%	0.585	56%	0.562	S	S	*	*	H	α-helix	trans	-60.5	-46.6	174.5	178.8	178.7	170.1	157.7	7	111.5	L448 L449 E450 Q454 R455 E456	L448-R452 VanDerWaalsContact O-CB 3.26Å; L448-R452 WeakPolarHBondContact O-CB 3.18Å; L448-R452 PolarHBondContact O-N 2.94Å; L448-R452 VanDerWaalsContact O-N 3.08Å; L449-R452 PolarHBondContact O-N 3.27Å; E450-R452 PolarHBondContact O-N 2.97Å; R452-Q454 VanDerWaalsContact C-N 3.33Å; R452-Q454 PolarHBondContact O-N 3.41Å; R452-R455 PolarHBondContact O-N 3.4Å; R452-E456 IonicContact CZ-OE1 2.71Å; R452-E456 VanDerWaalsContact CZ-OE1 3.24Å; R452-E456 IonicContact NE-OE1 2.74Å; R452-E456 PolarHBondContact NE-OE1 2.93Å; R452-E456 IonicContact NH2-OE1 3.36Å; R452-E456 PolarHBondContact NH2-OE1 3.03Å; R452-E456 WeakPolarHBondContact O-CG 3.3Å; R452-E456 PolarHBondContact O-N 3.1Å
453	S	79.4	Confident	75.1	Confident	53 Å²	53	123.4 Å²	123.4	37%	0.371	58%	0.578	S	S	.	*	H	α-helix	trans	-61.9	-40.3	177.6	-173.7	0	0	0	0	111.8	L449 E450 E456 L457	L449-S453 WeakPolarHBondContact O-CB 3.42Å; L449-S453 PolarHBondContact O-N 3.38Å; E450-S453 PolarHBondContact O-N 3.1Å; S453-E456 PolarHBondContact O-N 2.96Å; S453-L457 WeakPolarHBondContact O-CB 3.45Å; S453-L457 VanDerWaalsContact O-CG 3.31Å; S453-L457 WeakPolarHBondContact O-CG 3.43Å; S453-L457 PolarHBondContact O-N 2.99Å
454	Q	78.6	Confident	72.8	Confident	104 Å²	104	124.8 Å²	124.8	49%	0.486	60%	0.596	S	S	.	*	H	α-helix	trans	-67	-37.8	174.8	-71.1	176.7	22.4	0	0	112.6	E450 E451 R452 L457 N458	E450-Q454 WeakPolarHBondContact O-CG 3.37Å; E450-Q454 PolarHBondContact O-N 3.22Å; E451-Q454 PolarHBondContact O-N 2.9Å; R452-Q454 VanDerWaalsContact C-N 3.33Å; R452-Q454 PolarHBondContact O-N 3.41Å; Q454-L457 PolarHBondContact O-N 2.94Å; Q454-N458 WeakPolarHBondContact O-CB 3.48Å; Q454-N458 PolarHBondContact O-N 3.29Å; Q454-N458 PolarHBondContact O-ND2 3.03Å
455	R	76.4	Confident	70.3	Confident	158 Å²	158	124.4 Å²	124.4	60%	0.596	60%	0.603	S	S	*	*	H	α-helix	trans	-63.8	-43	171.9	-70.2	166.6	180	-139.7	7.5	111.4	E451 R452 N458 S459	E451-R455 VanDerWaalsContact O-CG 3.26Å; E451-R455 WeakPolarHBondContact O-CG 3.16Å; E451-R455 PolarHBondContact O-N 3.42Å; E451-R455 IonicContact OE1-CZ 3.96Å; E451-R455 IonicContact OE1-NE 2.97Å; E451-R455 PolarHBondContact OE1-NE 2.76Å; E451-R455 IonicContact OE1-NH2 3.03Å; E451-R455 PolarHBondContact OE1-NH2 2.75Å; R452-R455 PolarHBondContact O-N 3.4Å; R455-N458 PolarHBondContact O-N 2.77Å; R455-S459 VanDerWaalsContact O-CB 3.25Å; R455-S459 WeakPolarHBondContact O-CB 3.44Å; R455-S459 PolarHBondContact O-N 2.92Å
456	E	73.1	Confident	68	Low	90 Å²	90	126.5 Å²	126.5	42%	0.421	61%	0.613	S	S	.	*	H	α-helix	trans	-65.2	-37.8	175.7	-72.8	170.4	176.1	0	0	111.6	R452 S453 N460	R452-E456 IonicContact CZ-OE1 2.71Å; R452-E456 VanDerWaalsContact CZ-OE1 3.24Å; R452-E456 IonicContact NE-OE1 2.74Å; R452-E456 PolarHBondContact NE-OE1 2.93Å; R452-E456 IonicContact NH2-OE1 3.36Å; R452-E456 PolarHBondContact NH2-OE1 3.03Å; R452-E456 WeakPolarHBondContact O-CG 3.3Å; R452-E456 PolarHBondContact O-N 3.1Å; S453-E456 PolarHBondContact O-N 2.96Å; E456-N460 PolarHBondContact O-N 2.77Å; E456-N460 PolarHBondContact O-ND2 3.41Å
457	L	70.9	Confident	65.7	Low	115 Å²	115	125 Å²	125	60%	0.602	62%	0.622	S	S	*	*	H	α-helix	trans	-69.1	-42.1	174.2	-75.2	166.3	0	0	0	113.1	S453 Q454 N460	S453-L457 WeakPolarHBondContact O-CB 3.45Å; S453-L457 VanDerWaalsContact O-CG 3.31Å; S453-L457 WeakPolarHBondContact O-CG 3.43Å; S453-L457 PolarHBondContact O-N 2.99Å; Q454-L457 PolarHBondContact O-N 2.94Å; L457-N460 PolarHBondContact O-N 3.27Å
458	N	69.1	Low	62.9	Low	106 Å²	106	128.9 Å²	128.9	57%	0.567	64%	0.637	S	S	*	*	H	α-helix	trans	-68.5	-38.6	177.9	-69.1	-16.5	0	0	0	111.5	Q454 R455 N460 R461	Q454-N458 WeakPolarHBondContact O-CB 3.48Å; Q454-N458 PolarHBondContact O-N 3.29Å; Q454-N458 PolarHBondContact O-ND2 3.03Å; R455-N458 PolarHBondContact O-N 2.77Å; N458-N460 PolarHBondContact O-N 3.38Å; N458-N460 VanDerWaalsContact O-N 3.15Å; N458-R461 PolarHBondContact O-N 3.21Å
459	S	56.6	Low	60	Low	97 Å²	97	129.5 Å²	129.5	68%	0.678	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.6	-15.5	174.8	-172.2	0	0	0	0	114.1	R455	R455-S459 VanDerWaalsContact O-CB 3.25Å; R455-S459 WeakPolarHBondContact O-CB 3.44Å; R455-S459 PolarHBondContact O-N 2.92Å
460	N	51.4	Low	57.4	Low	145 Å²	145	131.4 Å²	131.4	78%	0.775	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.8	11.6	173.7	-77.7	-71.9	0	0	0	112.8	E456 L457 N458	E456-N460 PolarHBondContact O-N 2.77Å; E456-N460 PolarHBondContact O-ND2 3.41Å; L457-N460 PolarHBondContact O-N 3.27Å; N458-N460 PolarHBondContact O-N 3.38Å; N458-N460 VanDerWaalsContact O-N 3.15Å
461	R	49.1	Very low	54.6	Low	216 Å²	216	135.1 Å²	135.1	82%	0.815	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.3	-14.6	-174.9	-169.4	168.8	177.3	178.3	-1.1	115	N458 E463	N458-R461 PolarHBondContact O-N 3.21Å; R461-E463 PolarHBondContact O-N 3.18Å
462	E	46.2	Very low	51.9	Low	179 Å²	179	142.5 Å²	142.5	84%	0.836	69%	0.693	S	S	*	*			trans	-98.3	74.9	174.6	-67.4	-171	142.3	0	0	111.5
463	E	43.3	Very low	49.9	Very low	168 Å²	168	140.7 Å²	140.7	79%	0.785	70%	0.702	S	S	*	*			trans	-117.7	109.5	161.1	-174.2	-179.9	-118.2	0	0	109.4	R461	R461-E463 PolarHBondContact O-N 3.18Å
464	P	43.3	Very low	47.3	Very low	123 Å²	123	141.5 Å²	141.5	80%	0.799	72%	0.718	S	S	*	*			trans	-86.7	135.7	169.2	-10.3	28.8	0	0	0	111.8
465	L	40.2	Very low	45.6	Very low	135 Å²	135	143.1 Å²	143.1	71%	0.707	74%	0.738	S	S	*	*			trans	-90.6	172.4	178.3	-71.1	165.8	0	0	0	113.2
466	E	33	Very low	43.1	Very low	160 Å²	160	139 Å²	139	75%	0.748	74%	0.744	S	S	*	*			trans	75.7	151.7	165.1	-51.5	-54.3	100.4	0	0	118.9
467	P	42.9	Very low	40.9	Very low	110 Å²	110	139.7 Å²	139.7	71%	0.714	77%	0.765	S	S	*	*			cis	-137.7	-179.5	-38.5	38	-21.4	0	0	0	113.7
468	E	34.5	Very low	39	Very low	182 Å²	182	141.9 Å²	141.9	85%	0.85	78%	0.778	S	S	*	*			trans	-73.7	142.1	174.6	-65.7	-174.7	87.3	0	0	114.5
469	T	29.2	Very low	37.2	Very low	124 Å²	124	146.2 Å²	146.2	76%	0.761	80%	0.795	S	S	*	*				-173.9	123.6	117.1	15.8	0	0	0	0	116
470	Q	33.2	Very low	36.2	Very low	159 Å²	159	146.9 Å²	146.9	74%	0.743	80%	0.799	S	S	*	*			trans	53.3	133	134.3	-70.1	-174.5	21.8	0	0	125.2
471	Q	27.8	Very low	35.3	Very low	176 Å²	176	147.8 Å²	147.8	82%	0.822	80%	0.802	S	S	*	*			trans	89.2	150.1	145.8	-70.6	175.7	58.9	0	0	122
472	R	31.2	Very low	34.5	Very low	237 Å²	237	146.1 Å²	146.1	89%	0.894	80%	0.804	S	S	*	*			trans	-118.6	171.8	178.9	-116.5	-160.2	-179.7	-175	3.2	107.9
473	P	38.5	Very low	33.7	Very low	118 Å²	118	143.7 Å²	143.7	77%	0.766	80%	0.801	S	S	*	*			cis	-127.2	-177.6	17.8	35.7	-15.5	0	0	0	115.5
474	G	25.7	Very low	33.1	Very low	69 Å²	69	144 Å²	144	71%	0.711	81%	0.807	S	S	*	*			trans	-86.5	-149.7	177.2	0	0	0	0	0	113.9
475	P	41.3	Very low	32.5	Very low	138 Å²	138	142.9 Å²	142.9	90%	0.896	80%	0.802	S	S	*	*			cis	-130.5	179.1	12.6	43.2	-28.6	0	0	0	115.3
476	G	24.5	Very low	32.1	Very low	71 Å²	71	141.3 Å²	141.3	73%	0.732	80%	0.803	S	S	*	*			trans	157.1	136.3	155.4	0	0	0	0	0	118.2
477	A	27.6	Very low	32.5	Very low	105 Å²	105	139.6 Å²	139.6	87%	0.868	81%	0.805	S	S	*	*			trans	63.6	142	156.6	0	0	0	0	0	121.1
478	N	31.4	Very low	32.1	Very low	161 Å²	161	140.6 Å²	140.6	86%	0.861	81%	0.809	S	S	*	*			trans	-70.6	148.7	174.1	-49.9	-39.6	0	0	0	111.8
479	E	31.1	Very low	31.9	Very low	198 Å²	198	135.5 Å²	135.5	93%	0.925	80%	0.798	S	S	*	*				-155.8	156.2	124.1	-118.3	168.1	-159.1	0	0	111.8
480	S	35	Very low	32.4	Very low	111 Å²	111	138.9 Å²	138.9	78%	0.776	81%	0.805	S	S	*	*			trans	-94.8	127.5	-164.6	58.3	0	0	0	0	113.5
481	I	32.5	Very low	32.5	Very low	164 Å²	164	140.2 Å²	140.2	84%	0.841	81%	0.809	S	S	*	*			trans	-114	132.1	166.2	-61.6	-178.7	0	0	0	109.3
482	Q	31.3	Very low	33.1	Very low	180 Å²	180	140.9 Å²	140.9	84%	0.841	80%	0.804	S	S	*	*			trans	-82	126.7	-174.6	-62.4	174.1	7.9	0	0	110.9	L484	Q482-L484 PolarHBondContact O-N 3.07Å
483	V	30.2	Very low	33.8	Very low	128 Å²	128	134.8 Å²	134.8	78%	0.776	80%	0.798	S	S	*	*			trans	-78.8	102	175.9	-175.1	0	0	0	0	109.6	S485	V483-S485 VanDerWaalsContact C-N 3.34Å; V483-S485 PolarHBondContact O-N 3.11Å; V483-S485 VanDerWaalsContact O-N 3.12Å
484	L	31.5	Very low	34.2	Very low	175 Å²	175	134.7 Å²	134.7	92%	0.916	79%	0.79	S	S	*	*			trans	-84.1	76.4	173.2	-162	78.2	0	0	0	110.5	Q482 S486	Q482-L484 PolarHBondContact O-N 3.07Å; L484-S486 PolarHBondContact O-N 3.06Å
485	S	30.8	Very low	35.8	Very low	99 Å²	99	134.5 Å²	134.5	69%	0.692	78%	0.776	S	S	*	*			trans	-60.7	114	-176.8	-59.6	0	0	0	0	113	V483 P487	V483-S485 VanDerWaalsContact C-N 3.34Å; V483-S485 PolarHBondContact O-N 3.11Å; V483-S485 VanDerWaalsContact O-N 3.12Å; S485-P487 WeakPolarHBondContact O-CD 3.5Å
486	S	30.8	Very low	36.9	Very low	103 Å²	103	133.5 Å²	133.5	72%	0.72	76%	0.763	S	S	*	*			trans	-73	121.6	172.1	-176.6	0	0	0	0	111.2	L484 V488	L484-S486 PolarHBondContact O-N 3.06Å; S486-V488 PolarHBondContact O-N 2.89Å
487	P	41.3	Very low	38.7	Very low	124 Å²	124	133 Å²	133	81%	0.805	74%	0.741	S	S	*	*			trans	-94.4	80	-174.8	36.3	-33.6	0	0	0	112.4	S485	S485-P487 WeakPolarHBondContact O-CD 3.5Å
488	V	33.8	Very low	40.3	Very low	130 Å²	130	130.6 Å²	130.6	79%	0.788	71%	0.713	S	S	*	*			trans	-113.1	82.7	164.9	-175.4	0	0	0	0	109.4	S486	S486-V488 PolarHBondContact O-N 2.89Å
489	A	31.3	Very low	42.1	Very low	76 Å²	76	125.5 Å²	125.5	63%	0.628	69%	0.688	S	S	*	*			trans	-129.2	106.2	170.5	0	0	0	0	0	108.7	K491	A489-K491 PolarHBondContact O-N 3.27Å
490	E	39.3	Very low	43.8	Very low	195 Å²	195	120.5 Å²	120.5	91%	0.911	67%	0.672	S	S	*	*			trans	-72.4	67.4	-179.5	-69.1	-164.8	117.4	0	0	112.3	R492	E490-R492 PolarHBondContact O-N 3.12Å; E490-R492 VanDerWaalsContact O-N 3.13Å
491	K	35.3	Very low	45.6	Very low	186 Å²	186	122.6 Å²	122.6	81%	0.809	68%	0.675	S	S	*	*			trans	-62.5	114.7	163	-70.7	-179.1	178.6	178.5	0	107.7	A489 S493	A489-K491 PolarHBondContact O-N 3.27Å; K491-S493 PolarHBondContact O-N 3.16Å
492	R	41.7	Very low	47.9	Very low	190 Å²	190	116.1 Å²	116.1	72%	0.717	64%	0.64	S	S	*	*			trans	-41.4	105.7	179.4	-71.7	-177.1	171.6	103.3	2.7	110.4	E246 E490 L494	E246-R492 VanDerWaalsContact CD-NH1 3.27Å; E246-R492 VanDerWaalsContact CD-NH2 3.33Å; E246-R492 IonicContact OE1-CZ 3.93Å; E246-R492 IonicContact OE1-NH1 3.28Å; E246-R492 PolarHBondContact OE1-NH1 3.43Å; E246-R492 IonicContact OE1-NH2 3.25Å; E246-R492 IonicContact OE2-CZ 2.84Å; E246-R492 IonicContact OE2-NH1 3.27Å; E246-R492 PolarHBondContact OE2-NH1 2.8Å; E246-R492 VanDerWaalsContact OE2-NH1 3.15Å; E246-R492 IonicContact OE2-NH2 3.58Å; E246-R492 PolarHBondContact OE2-NH2 2.93Å; E490-R492 PolarHBondContact O-N 3.12Å; E490-R492 VanDerWaalsContact O-N 3.13Å; R492-L494 PolarHBondContact O-N 3.33Å; R492-L494 VanDerWaalsContact O-N 3.13Å
493	S	45.4	Very low	50.3	Low	110 Å²	110	110.4 Å²	110.4	77%	0.769	62%	0.616	S	S	*	*			trans	-71.7	112.4	-166.3	38.6	0	0	0	0	110.6	K491	K491-S493 PolarHBondContact O-N 3.16Å
494	L	46.8	Very low	52.7	Low	116 Å²	116	104.3 Å²	104.3	61%	0.607	58%	0.579	S	S	*	*			trans	-54.3	135.2	163.8	-70.5	173.5	0	0	0	108	R492 L496	R492-L494 PolarHBondContact O-N 3.33Å; R492-L494 VanDerWaalsContact O-N 3.13Å; L494-L496 PolarHBondContact O-N 2.92Å
495	P	59.2	Low	55.1	Low	65 Å²	65	100.2 Å²	100.2	42%	0.422	55%	0.551	S	S	.	*			trans	-49.4	126.8	173.9	-27.3	33.1	0	0	0	109.8	F497 L498	P495-F497 HydrophobicContact CB-CD1 3.97Å; P495-F497 HydrophobicContact CB-CE1 3.42Å; P495-F497 VanDerWaalsContact CB-CE1 3.42Å; P495-F497 HydrophobicContact CB-CE2 4.41Å; P495-F497 HydrophobicContact CB-CZ 3.67Å; P495-F497 HydrophobicContact CG-CZ 4.47Å; P495-F497 PolarHBondContact O-N 3.2Å; P495-L498 HydrophobicContact CG-CD1 4.38Å; P495-L498 WeakPolarHBondContact O-CB 3.12Å; P495-L498 PolarHBondContact O-N 2.76Å
496	L	64.3	Low	57.5	Low	117 Å²	117	97.8 Å²	97.8	61%	0.613	54%	0.537	S	S	*	.	G	3₁₀ helix	trans	-51	-35.5	-161.9	-65.2	174.1	0	0	0	113.6	L494 L498 T499 F502	L494-L496 PolarHBondContact O-N 2.92Å; L496-L498 PolarHBondContact O-N 2.89Å; L496-L498 VanDerWaalsContact O-N 3.11Å; L496-T499 VanDerWaalsContact O-CB 3.32Å; L496-T499 WeakPolarHBondContact O-CB 3.18Å; L496-T499 PolarHBondContact O-N 2.91Å; L496-T499 PolarHBondContact O-OG1 3.39Å; L496-T499 VanDerWaalsContact O-OG1 3.11Å; L496-F502 VanDerWaalsContact C-CD2 3.45Å; L496-F502 HydrophobicContact CB-CD2 4Å; L496-F502 HydrophobicContact CB-CE2 4Å; L496-F502 VanDerWaalsContact O-CB 3.29Å; L496-F502 WeakPolarHBondContact O-CB 3.44Å; L496-F502 WeakPolarHBondContact O-CD2 3.28Å; L496-F502 WeakPolarHBondContact O-CG 3.15Å
497	F	62.3	Low	59.9	Low	61 Å²	61	95.1 Å²	95.1	27%	0.268	51%	0.513	S	S	.	.	G	3₁₀ helix	trans	-65.7	-4.2	177	64.8	-96.8	0	0	0	116.1	P495 F502 T551 L574	P495-F497 HydrophobicContact CB-CD1 3.97Å; P495-F497 HydrophobicContact CB-CE1 3.42Å; P495-F497 VanDerWaalsContact CB-CE1 3.42Å; P495-F497 HydrophobicContact CB-CE2 4.41Å; P495-F497 HydrophobicContact CB-CZ 3.67Å; P495-F497 HydrophobicContact CG-CZ 4.47Å; P495-F497 PolarHBondContact O-N 3.2Å; F497-F502 HydrophobicContact CB-CD1 4.11Å; F497-F502 HydrophobicContact CB-CE1 3.78Å; F497-F502 HydrophobicContact CB-CE2 4.4Å; F497-F502 HydrophobicContact CB-CZ 3.94Å; F497-T551 HydrophobicContact CB-CG2 4.4Å; F497-L574 HydrophobicContact CB-CD2 4.02Å
498	L	60.8	Low	61.7	Low	54 Å²	54	89.2 Å²	89.2	28%	0.283	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-103.1	-6.4	173.1	-58.8	-176.6	0	0	0	113	P495 L496 K554	P495-L498 HydrophobicContact CG-CD1 4.38Å; P495-L498 WeakPolarHBondContact O-CB 3.12Å; P495-L498 PolarHBondContact O-N 2.76Å; L496-L498 PolarHBondContact O-N 2.89Å; L496-L498 VanDerWaalsContact O-N 3.11Å; L498-K554 HydrophobicContact CD2-CD 3.81Å; L498-K554 HydrophobicContact CD2-CG 3.92Å
499	T	69.4	Low	64	Low	54 Å²	54	86.6 Å²	86.6	33%	0.331	45%	0.454	S	S	.	.	S	Bend	trans	-70.5	135.7	175.7	-52.3	0	0	0	0	109.8	L496 N501 F502	L496-T499 VanDerWaalsContact O-CB 3.32Å; L496-T499 WeakPolarHBondContact O-CB 3.18Å; L496-T499 PolarHBondContact O-N 2.91Å; L496-T499 PolarHBondContact O-OG1 3.39Å; L496-T499 VanDerWaalsContact O-OG1 3.11Å; T499-N501 PolarHBondContact O-N 3Å; T499-N501 VanDerWaalsContact O-N 3.08Å; T499-F502 WeakPolarHBondContact O-CB 3.24Å; T499-F502 PolarHBondContact O-N 3.12Å
500	P	66.8	Low	66.2	Low	93 Å²	93	87.2 Å²	87.2	60%	0.604	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-30.9	179.1	-28.8	36.1	0	0	0	114.4	R526	P500-R526 PolarHBondContact O-NH2 2.98Å
501	N	73.3	Confident	68	Low	154 Å²	154	82.1 Å²	82.1	82%	0.824	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	13.4	-177.2	-58.2	-4.2	0	0	0	113.3	T499 D503	T499-N501 PolarHBondContact O-N 3Å; T499-N501 VanDerWaalsContact O-N 3.08Å; N501-D503 PolarHBondContact O-N 2.91Å
502	F	80.5	Confident	69.7	Low	28 Å²	28	76.6 Å²	76.6	12%	0.123	43%	0.428	C	S	.	.			trans	-76.7	122.7	178.1	-177.5	-96.4	0	0	0	111.8	L496 F497 T499 L504 H507 L574	L496-F502 VanDerWaalsContact C-CD2 3.45Å; L496-F502 HydrophobicContact CB-CD2 4Å; L496-F502 HydrophobicContact CB-CE2 4Å; L496-F502 VanDerWaalsContact O-CB 3.29Å; L496-F502 WeakPolarHBondContact O-CB 3.44Å; L496-F502 WeakPolarHBondContact O-CD2 3.28Å; L496-F502 WeakPolarHBondContact O-CG 3.15Å; F497-F502 HydrophobicContact CB-CD1 4.11Å; F497-F502 HydrophobicContact CB-CE1 3.78Å; F497-F502 HydrophobicContact CB-CE2 4.4Å; F497-F502 HydrophobicContact CB-CZ 3.94Å; T499-F502 WeakPolarHBondContact O-CB 3.24Å; T499-F502 PolarHBondContact O-N 3.12Å; F502-L504 HydrophobicContact CD1-CB 4.45Å; F502-L504 HydrophobicContact CE1-CB 3.89Å; F502-L504 HydrophobicContact CE1-CD1 4.27Å; F502-H507 HydrophobicContact CE2-CB 4.01Å; F502-H507 AromaticContact CE2-CG 3.96Å; F502-H507 HydrophobicContact CZ-CB 3.79Å; F502-H507 AromaticContact CZ-CD2 3.63Å; F502-H507 AromaticContact CZ-CG 3.82Å; F502-L574 HydrophobicContact CE1-CD2 4.15Å; F502-L574 HydrophobicContact CZ-CD2 3.87Å
503	D	81	Confident	71.3	Confident	60 Å²	60	69.4 Å²	69.4	32%	0.321	40%	0.403	S	S	.	.			trans	-103.3	108.2	168.4	-176.6	-11.9	0	0	0	110	N501 R505 A506 H507 P525	N501-D503 PolarHBondContact O-N 2.91Å; D503-R505 VanDerWaalsContact C-N 3.27Å; D503-R505 PolarHBondContact O-N 3.42Å; D503-R505 WeakPolarHBondContact OD1-CA 3.5Å; D503-R505 WeakPolarHBondContact OD1-CB 3.38Å; D503-R505 PolarHBondContact OD1-N 3.27Å; D503-A506 HydrophobicContact CB-CB 3.94Å; D503-A506 PolarHBondContact O-N 2.89Å; D503-A506 PolarHBondContact OD1-N 3.12Å; D503-H507 WeakPolarHBondContact O-CB 3.25Å; D503-H507 PolarHBondContact O-N 3.18Å; D503-P525 HydrophobicContact CB-CB 4.3Å; D503-P525 VanDerWaalsContact OD1-CA 3.23Å; D503-P525 WeakPolarHBondContact OD1-CA 3.35Å; D503-P525 WeakPolarHBondContact OD1-CB 3.44Å
504	L	81.8	Confident	72.6	Confident	1 Å²	1	66.1 Å²	66.1	1%	0.005	39%	0.386	C	S	.	.	H	α-helix	trans	-59.2	-35	174.7	175.3	59.6	0	0	0	112.9	F502 V508 P525 C528 F549 L574	F502-L504 HydrophobicContact CD1-CB 4.45Å; F502-L504 HydrophobicContact CE1-CB 3.89Å; F502-L504 HydrophobicContact CE1-CD1 4.27Å; L504-V508 HydrophobicContact CD1-CG2 4.2Å; L504-V508 VanDerWaalsContact O-CG2 3.25Å; L504-V508 WeakPolarHBondContact O-CG2 3.4Å; L504-V508 PolarHBondContact O-N 3.29Å; L504-P525 VanDerWaalsContact CB-O 3.29Å; L504-P525 WeakPolarHBondContact CB-O 3.47Å; L504-P525 PolarHBondContact N-O 3.37Å; L504-C528 HydrophobicContact CD2-CB 3.94Å; L504-F549 HydrophobicContact CD2-CD1 4.13Å; L504-F549 HydrophobicContact CD2-CE1 4.4Å; L504-L574 HydrophobicContact CD1-CD1 3.78Å; L504-L574 HydrophobicContact CD1-CD2 3.75Å; L504-L574 HydrophobicContact CD1-CG 4.29Å
505	R	81.3	Confident	73.8	Confident	89 Å²	89	61.3 Å²	61.3	34%	0.336	36%	0.361	S	S	.	.	H	α-helix	trans	-70	-51.3	-179	-167.9	-173.6	171.3	-65.2	-20.5	109.7	D503 H507 V508 E509 V515	D503-R505 VanDerWaalsContact C-N 3.27Å; D503-R505 PolarHBondContact O-N 3.42Å; D503-R505 WeakPolarHBondContact OD1-CA 3.5Å; D503-R505 WeakPolarHBondContact OD1-CB 3.38Å; D503-R505 PolarHBondContact OD1-N 3.27Å; R505-H507 VanDerWaalsContact C-N 3.3Å; R505-H507 PolarHBondContact O-N 2.54Å; R505-V508 PolarHBondContact O-N 3.46Å; R505-E509 IonicContact CZ-OE1 3.69Å; R505-E509 IonicContact CZ-OE2 3.64Å; R505-E509 IonicContact NH1-OE1 2.72Å; R505-E509 PolarHBondContact NH1-OE1 2.68Å; R505-E509 IonicContact NH1-OE2 3.89Å; R505-E509 PolarHBondContact NH1-OE2 2.78Å; R505-E509 IonicContact NH2-OE1 3.04Å; R505-E509 PolarHBondContact NH2-OE1 2.68Å; R505-E509 IonicContact NH2-OE2 3.18Å; R505-E509 WeakPolarHBondContact O-CG 3.42Å; R505-E509 PolarHBondContact O-N 2.94Å; R505-V515 HydrophobicContact CG-CG1 4.09Å
506	A	81.4	Confident	74.2	Confident	47 Å²	47	62.8 Å²	62.8	39%	0.388	38%	0.379	S	S	.	.	H	α-helix	trans	-61.7	-36.8	175.2	0	0	0	0	0	112.3	D503 E509 S510	D503-A506 HydrophobicContact CB-CB 3.94Å; D503-A506 PolarHBondContact O-N 2.89Å; D503-A506 PolarHBondContact OD1-N 3.12Å; A506-E509 PolarHBondContact O-N 3.25Å; A506-S510 WeakPolarHBondContact O-CB 3.5Å; A506-S510 PolarHBondContact O-N 3.17Å
507	H	81.6	Confident	74.2	Confident	47 Å²	47	61.5 Å²	61.5	22%	0.218	38%	0.38	C	S	.	.	H	α-helix	trans	-63.1	-46	175.2	-177.4	49.1	0	0	0	112.4	F502 D503 R505 E509 S510 L511	F502-H507 HydrophobicContact CE2-CB 4.01Å; F502-H507 AromaticContact CE2-CG 3.96Å; F502-H507 HydrophobicContact CZ-CB 3.79Å; F502-H507 AromaticContact CZ-CD2 3.63Å; F502-H507 AromaticContact CZ-CG 3.82Å; D503-H507 WeakPolarHBondContact O-CB 3.25Å; D503-H507 PolarHBondContact O-N 3.18Å; R505-H507 VanDerWaalsContact C-N 3.3Å; R505-H507 PolarHBondContact O-N 2.54Å; H507-E509 VanDerWaalsContact C-N 3.34Å; H507-E509 PolarHBondContact O-N 2.84Å; H507-S510 WeakPolarHBondContact CA-OG 3.5Å; H507-S510 PolarHBondContact O-N 2.91Å; H507-S510 PolarHBondContact O-OG 3.31Å; H507-L511 WeakPolarHBondContact O-CG 3.18Å; H507-L511 PolarHBondContact O-N 3.18Å
508	V	78.1	Confident	74.4	Confident	1 Å²	1	60.1 Å²	60.1	1%	0.006	38%	0.377	C	S	.	.	H	α-helix	trans	-63.5	-40	176.7	171.4	0	0	0	0	111.6	L504 R505 L511 H513 V515 I578 F582	L504-V508 HydrophobicContact CD1-CG2 4.2Å; L504-V508 VanDerWaalsContact O-CG2 3.25Å; L504-V508 WeakPolarHBondContact O-CG2 3.4Å; L504-V508 PolarHBondContact O-N 3.29Å; R505-V508 PolarHBondContact O-N 3.46Å; V508-L511 PolarHBondContact O-N 2.87Å; V508-H513 HydrophobicContact CG1-CB 3.78Å; V508-H513 PolarHBondContact O-N 3.29Å; V508-V515 HydrophobicContact CB-CG2 4.07Å; V508-V515 HydrophobicContact CG1-CG2 3.51Å; V508-I578 HydrophobicContact CG1-CG2 4.29Å; V508-I578 HydrophobicContact CG2-CD1 3.67Å; V508-I578 HydrophobicContact CG2-CG1 3.98Å; V508-I578 HydrophobicContact CG2-CG2 4.26Å; V508-F582 HydrophobicContact CG1-CD1 4.42Å; V508-F582 HydrophobicContact CG1-CE1 3.8Å; V508-F582 HydrophobicContact CG1-CE2 3.94Å; V508-F582 HydrophobicContact CG1-CZ 3.52Å
509	E	81.9	Confident	74.7	Confident	75 Å²	75	64.2 Å²	64.2	35%	0.35	40%	0.404	S	S	.	.	H	α-helix	trans	-65.7	-37	174.4	-69.6	175.7	146.5	0	0	111.8	R505 A506 H507 L511 G512 V515	R505-E509 IonicContact CZ-OE1 3.69Å; R505-E509 IonicContact CZ-OE2 3.64Å; R505-E509 IonicContact NH1-OE1 2.72Å; R505-E509 PolarHBondContact NH1-OE1 2.68Å; R505-E509 IonicContact NH1-OE2 3.89Å; R505-E509 PolarHBondContact NH1-OE2 2.78Å; R505-E509 IonicContact NH2-OE1 3.04Å; R505-E509 PolarHBondContact NH2-OE1 2.68Å; R505-E509 IonicContact NH2-OE2 3.18Å; R505-E509 WeakPolarHBondContact O-CG 3.42Å; R505-E509 PolarHBondContact O-N 2.94Å; A506-E509 PolarHBondContact O-N 3.25Å; H507-E509 VanDerWaalsContact C-N 3.34Å; H507-E509 PolarHBondContact O-N 2.84Å; E509-L511 PolarHBondContact O-N 3.43Å; E509-G512 PolarHBondContact O-N 3.39Å; E509-V515 HydrophobicContact CG-CB 3.89Å; E509-V515 HydrophobicContact CG-CG2 3.59Å
510	S	78.2	Confident	74.7	Confident	89 Å²	89	66.2 Å²	66.2	62%	0.622	41%	0.413	S	S	*	.	H	α-helix	trans	-66.9	-21.9	176.1	76.3	0	0	0	0	114.2	A506 H507 G512	A506-S510 WeakPolarHBondContact O-CB 3.5Å; A506-S510 PolarHBondContact O-N 3.17Å; H507-S510 WeakPolarHBondContact CA-OG 3.5Å; H507-S510 PolarHBondContact O-N 2.91Å; H507-S510 PolarHBondContact O-OG 3.31Å; S510-G512 PolarHBondContact O-N 3.19Å
511	L	76.8	Confident	75.2	Confident	88 Å²	88	62.7 Å²	62.7	46%	0.461	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-0.3	171.5	-66.3	171	0	0	0	112.6	H507 V508 E509 I578	H507-L511 WeakPolarHBondContact O-CG 3.18Å; H507-L511 PolarHBondContact O-N 3.18Å; V508-L511 PolarHBondContact O-N 2.87Å; E509-L511 PolarHBondContact O-N 3.43Å; L511-I578 HydrophobicContact CD1-CD1 4.31Å
512	G	71.1	Confident	75.7	Confident	70 Å²	70	64.2 Å²	64.2	72%	0.722	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.1	5.9	178.2	0	0	0	0	0	115	E509 S510	E509-G512 PolarHBondContact O-N 3.39Å; S510-G512 PolarHBondContact O-N 3.19Å
513	H	75.9	Confident	75.8	Confident	39 Å²	39	64.3 Å²	64.3	18%	0.181	39%	0.385	C	S	.	.			trans	-81.7	128.1	178.5	-58.4	-73.6	0	0	0	111.8	V508 V515 I578 F582	V508-H513 HydrophobicContact CG1-CB 3.78Å; V508-H513 PolarHBondContact O-N 3.29Å; H513-V515 PolarHBondContact O-N 3.37Å; H513-I578 WeakPolarHBondContact NE2-CG2 3.41Å; H513-F582 HydrophobicContact CB-CB 4.22Å; H513-F582 HydrophobicContact CB-CD1 3.73Å; H513-F582 HydrophobicContact CB-CE1 4.27Å; H513-F582 HydrophobicContact CB-CG 4.06Å; H513-F582 WeakPolarHBondContact ND1-CB 3.41Å
514	G	72.7	Confident	75.8	Confident	40 Å²	40	64.7 Å²	64.7	41%	0.412	39%	0.39	S	S	.	.			trans	-71	82.1	175.7	0	0	0	0	0	112.7	A516 S517	G514-A516 PolarHBondContact O-N 3.01Å; G514-A516 VanDerWaalsContact O-N 3.16Å; G514-S517 PolarHBondContact O-N 3.02Å; G514-S517 PolarHBondContact O-OG 3.43Å
515	V	71	Confident	75.9	Confident	15 Å²	15	67.7 Å²	67.7	9%	0.091	41%	0.409	C	S	.	.	G	3₁₀ helix	trans	-54.5	-34.7	178.2	166.8	0	0	0	0	112.6	R505 V508 E509 H513 S517 C518 L523 F582	R505-V515 HydrophobicContact CG-CG1 4.09Å; V508-V515 HydrophobicContact CB-CG2 4.07Å; V508-V515 HydrophobicContact CG1-CG2 3.51Å; E509-V515 HydrophobicContact CG-CB 3.89Å; E509-V515 HydrophobicContact CG-CG2 3.59Å; H513-V515 PolarHBondContact O-N 3.37Å; V515-S517 VanDerWaalsContact C-N 3.29Å; V515-S517 PolarHBondContact O-N 2.98Å; V515-C518 PolarHBondContact O-N 3.08Å; V515-L523 HydrophobicContact CG1-CB 4.45Å; V515-L523 HydrophobicContact CG1-CD1 4.01Å; V515-L523 HydrophobicContact CG2-CD1 4.48Å; V515-F582 HydrophobicContact CG2-CE1 4.17Å; V515-F582 HydrophobicContact CG2-CZ 4.49Å
516	A	67.9	Low	75.9	Confident	96 Å²	96	67.9 Å²	67.9	79%	0.793	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-67.8	-22.6	178.3	0	0	0	0	0	114.4	G514	G514-A516 PolarHBondContact O-N 3.01Å; G514-A516 VanDerWaalsContact O-N 3.16Å
517	S	64.8	Low	76.2	Confident	91 Å²	91	70.1 Å²	70.1	64%	0.636	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-88.2	-11.5	179.5	29.6	0	0	0	0	114.5	G514 V515 T519	G514-S517 PolarHBondContact O-N 3.02Å; G514-S517 PolarHBondContact O-OG 3.43Å; V515-S517 VanDerWaalsContact C-N 3.29Å; V515-S517 PolarHBondContact O-N 2.98Å; S517-T519 PolarHBondContact O-N 3.19Å
518	C	66.6	Low	76.4	Confident	32 Å²	32	68.4 Å²	68.4	22%	0.216	40%	0.402	C	S	.	.			trans	-92.1	73.3	-172.1	-64.9	0	0	0	0	112.8	V515 D520 L521 F582	V515-C518 PolarHBondContact O-N 3.08Å; C518-D520 VanDerWaalsContact C-N 3.27Å; C518-D520 PolarHBondContact O-N 3.11Å; C518-L521 HydrophobicContact CB-CB 4.14Å; C518-L521 HydrophobicContact CB-CD1 4Å; C518-L521 HydrophobicContact CB-CG 4.16Å; C518-L521 PolarHBondContact O-N 3.26Å; C518-F582 HydrophobicContact CB-CD1 4.39Å; C518-F582 HydrophobicContact CB-CE1 4.13Å; C518-F582 WeakPolarHBondContact SG-CD1 3.48Å
519	T	65.8	Low	76.8	Confident	139 Å²	139	69 Å²	69	85%	0.853	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-28.3	-177.6	51.4	0	0	0	0	115	S517 L521	S517-T519 PolarHBondContact O-N 3.19Å; T519-L521 VanDerWaalsContact C-N 3.27Å; T519-L521 PolarHBondContact O-N 2.99Å
520	D	70.1	Confident	77	Confident	97 Å²	97	65.4 Å²	65.4	52%	0.519	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-2.9	177	-108	-2.7	0	0	0	113.3	C518 K544	C518-D520 VanDerWaalsContact C-N 3.27Å; C518-D520 PolarHBondContact O-N 3.11Å; D520-K544 IonicContact OD2-NZ 3.63Å
521	L	78.5	Confident	77.2	Confident	19 Å²	19	64.9 Å²	64.9	10%	0.099	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	132.7	-179.4	-59.3	-175.2	0	0	0	112.6	C518 T519 L523 F547 A581 F582	C518-L521 HydrophobicContact CB-CB 4.14Å; C518-L521 HydrophobicContact CB-CD1 4Å; C518-L521 HydrophobicContact CB-CG 4.16Å; C518-L521 PolarHBondContact O-N 3.26Å; T519-L521 VanDerWaalsContact C-N 3.27Å; T519-L521 PolarHBondContact O-N 2.99Å; L521-L523 HydrophobicContact CB-CD1 3.78Å; L521-L523 HydrophobicContact CB-CG 4.42Å; L521-L523 HydrophobicContact CD1-CD1 4.28Å; L521-F547 HydrophobicContact CD2-CE1 4.14Å; L521-F547 HydrophobicContact CD2-CZ 4.21Å; L521-A581 HydrophobicContact CD1-CB 4.05Å; L521-A581 HydrophobicContact CD2-CB 4.34Å; L521-F582 HydrophobicContact CD1-CD1 4.25Å; L521-F582 HydrophobicContact CD1-CD2 3.98Å; L521-F582 HydrophobicContact CD1-CE1 3.87Å; L521-F582 HydrophobicContact CD1-CE2 3.58Å; L521-F582 HydrophobicContact CD1-CG 4.32Å; L521-F582 HydrophobicContact CD1-CZ 3.52Å
522	R	82.1	Confident	77.4	Confident	185 Å²	185	61.4 Å²	61.4	70%	0.698	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.1	101.5	172.6	-62.3	-175.5	66.7	-172.8	0.2	109.1	A529	R522-A529 PolarHBondContact N-O 3.3Å; R522-A529 PolarHBondContact O-N 3.32Å
523	L	83.3	Confident	77.7	Confident	30 Å²	30	61.6 Å²	61.6	16%	0.157	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	133.6	-178.5	-68.5	131.7	0	0	0	110.9	V515 L521 C528 F582	V515-L523 HydrophobicContact CG1-CB 4.45Å; V515-L523 HydrophobicContact CG1-CD1 4.01Å; V515-L523 HydrophobicContact CG2-CD1 4.48Å; L521-L523 HydrophobicContact CB-CD1 3.78Å; L521-L523 HydrophobicContact CB-CG 4.42Å; L521-L523 HydrophobicContact CD1-CD1 4.28Å; L523-C528 HydrophobicContact CD2-CB 3.91Å; L523-C528 VanDerWaalsContact CD2-SG 3.58Å; L523-F582 HydrophobicContact CD1-CE1 4.03Å; L523-F582 HydrophobicContact CD1-CZ 3.54Å; L523-F582 HydrophobicContact CD2-CE2 4.43Å; L523-F582 HydrophobicContact CD2-CZ 3.86Å; L523-F582 HydrophobicContact CG-CZ 4.32Å
524	T	81.4	Confident	77.7	Confident	68 Å²	68	63.3 Å²	63.3	42%	0.417	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	167	169.5	74.8	0	0	0	0	108.8	R526 R527	T524-R526 PolarHBondContact O-N 3.18Å; T524-R527 PolarHBondContact N-O 2.96Å; T524-R527 PolarHBondContact O-N 3.49Å; T524-R527 PolarHBondContact OG1-N 3.43Å; T524-R527 VanDerWaalsContact OG1-N 3.15Å; T524-R527 PolarHBondContact OG1-O 2.98Å
525	P	83.1	Confident	77.8	Confident	65 Å²	65	67.5 Å²	67.5	42%	0.422	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-13.8	-178.8	-30.7	38.3	0	0	0	116.4	D503 L504	D503-P525 HydrophobicContact CB-CB 4.3Å; D503-P525 VanDerWaalsContact OD1-CA 3.23Å; D503-P525 WeakPolarHBondContact OD1-CA 3.35Å; D503-P525 WeakPolarHBondContact OD1-CB 3.44Å; L504-P525 VanDerWaalsContact CB-O 3.29Å; L504-P525 WeakPolarHBondContact CB-O 3.47Å; L504-P525 PolarHBondContact N-O 3.37Å
526	R	82.7	Confident	77.7	Confident	93 Å²	93	68 Å²	68	35%	0.351	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.2	-4.9	178.5	-69.7	-159.7	176.3	-174.2	1.3	115.7	P500 T524 T551 D552	P500-R526 PolarHBondContact O-NH2 2.98Å; T524-R526 PolarHBondContact O-N 3.18Å; R526-T551 WeakPolarHBondContact CA-OG1 3.47Å; R526-T551 VanDerWaalsContact CB-OG1 3.3Å; R526-T551 WeakPolarHBondContact CB-OG1 3.43Å; R526-T551 PolarHBondContact O-N 2.7Å; R526-T551 PolarHBondContact O-OG1 2.93Å; R526-T551 VanDerWaalsContact O-OG1 3.04Å; R526-D552 WeakPolarHBondContact CD-OD1 3.07Å; R526-D552 IonicContact CZ-OD1 3.87Å; R526-D552 IonicContact NE-OD1 2.66Å; R526-D552 IonicContact NH1-OD1 3.95Å; R526-D552 PolarHBondContact NH1-OD1 3.41Å
527	R	85.9	Confident	77.7	Confident	93 Å²	93	66.1 Å²	66.1	35%	0.351	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	140.6	-176.2	-50.6	-169	-173.4	-178.6	12.2	111.7	T524 F549 D550 D552	T524-R527 PolarHBondContact N-O 2.96Å; T524-R527 PolarHBondContact O-N 3.49Å; T524-R527 PolarHBondContact OG1-N 3.43Å; T524-R527 VanDerWaalsContact OG1-N 3.15Å; T524-R527 PolarHBondContact OG1-O 2.98Å; R527-F549 CarbonylContact C-O 3.54Å; R527-F549 VanDerWaalsContact CA-O 3.26Å; R527-F549 WeakPolarHBondContact CA-O 3.31Å; R527-D550 WeakPolarHBondContact CD-OD2 3.47Å; R527-D550 HydrophobicContact CG-CB 4.42Å; R527-D550 IonicContact CZ-OD1 3.91Å; R527-D550 IonicContact CZ-OD2 3.57Å; R527-D550 VanDerWaalsContact CZ-OD2 3.25Å; R527-D550 IonicContact NE-OD1 3.15Å; R527-D550 PolarHBondContact NE-OD1 2.92Å; R527-D550 IonicContact NE-OD2 3.94Å; R527-D550 PolarHBondContact NE-OD2 3.42Å; R527-D550 IonicContact NH1-OD2 3.68Å; R527-D550 PolarHBondContact NH1-OD2 2.77Å; R527-D550 VanDerWaalsContact NH1-OD2 3.08Å; R527-D552 IonicContact CZ-OD2 2.68Å; R527-D552 VanDerWaalsContact CZ-OD2 3.28Å; R527-D552 IonicContact NE-OD2 2.69Å; R527-D552 PolarHBondContact NE-OD2 3.5Å; R527-D552 IonicContact NH2-OD2 2.96Å; R527-D552 PolarHBondContact NH2-OD2 3.37Å
528	C	87.1	Confident	77.5	Confident	11 Å²	11	74 Å²	74	7%	0.074	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	124.3	172.3	177.5	0	0	0	0	108.5	L504 L523 F547 F549	L504-C528 HydrophobicContact CD2-CB 3.94Å; L523-C528 HydrophobicContact CD2-CB 3.91Å; L523-C528 VanDerWaalsContact CD2-SG 3.58Å; C528-F547 HydrophobicContact CB-CE2 4.43Å; C528-F547 WeakPolarHBondContact O-CE2 3.25Å; C528-F549 HydrophobicContact CB-CB 4.39Å; C528-F549 PolarHBondContact N-O 3.47Å; C528-F549 PolarHBondContact O-N 2.92Å
529	A	86.4	Confident	77.2	Confident	13 Å²	13	76.9 Å²	76.9	11%	0.107	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	143.6	178.5	0	0	0	0	0	110.8	R522 W546 F547 L548	R522-A529 PolarHBondContact N-O 3.3Å; R522-A529 PolarHBondContact O-N 3.32Å; A529-W546 HydrophobicContact CB-CZ2 3.89Å; A529-F547 VanDerWaalsContact CA-O 3.23Å; A529-F547 WeakPolarHBondContact CA-O 3.35Å; A529-F547 WeakPolarHBondContact CB-O 3.34Å; A529-L548 HydrophobicContact CB-CD1 3.93Å
530	G	86.1	Confident	77.8	Confident	0 Å²	0	76.1 Å²	76.1	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.9	-171.1	-176.2	0	0	0	0	0	111.4	W546 F547	G530-W546 VanDerWaalsContact C-CE3 3.43Å; G530-W546 CarbonylContact O-C 3.56Å; G530-W546 WeakPolarHBondContact O-CA 3.45Å; G530-F547 PolarHBondContact N-O 3Å; G530-F547 WeakPolarHBondContact O-CD1 3.46Å; G530-F547 PolarHBondContact O-N 3.42Å
531	F	82.3	Confident	77.9	Confident	78 Å²	78	74.6 Å²	74.6	34%	0.342	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	131.1	169.5	-72.4	-73.9	0	0	0	111.9	K544 R545 W546	F531-K544 HydrophobicContact CB-CD 4.23Å; F531-K544 HydrophobicContact CB-CG 4.02Å; F531-K544 HydrophobicContact CD1-CD 4.39Å; F531-K544 HydrophobicContact CD1-CG 3.96Å; F531-K544 HydrophobicContact CG-CD 4.37Å; F531-K544 VanDerWaalsContact CG-CE 3.41Å; F531-K544 HydrophobicContact CG-CG 4.26Å; F531-R545 WeakPolarHBondContact CA-O 3.3Å; F531-W546 HydrophobicContact CD1-CB 4.23Å; F531-W546 AromaticContact CD1-CE3 3.91Å; F531-W546 HydrophobicContact CD1-CE3 3.91Å; F531-W546 AromaticContact CD2-CE3 3.63Å; F531-W546 HydrophobicContact CD2-CE3 3.63Å; F531-W546 AromaticContact CD2-CZ3 3.72Å; F531-W546 HydrophobicContact CD2-CZ3 3.72Å; F531-W546 HydrophobicContact CE1-CB 4.09Å; F531-W546 AromaticContact CE1-CE3 3.87Å; F531-W546 HydrophobicContact CE1-CE3 3.87Å; F531-W546 AromaticContact CE2-CE3 3.59Å; F531-W546 HydrophobicContact CE2-CE3 3.59Å; F531-W546 AromaticContact CE2-CZ3 3.73Å; F531-W546 HydrophobicContact CE2-CZ3 3.73Å; F531-W546 AromaticContact CG-CE3 3.79Å; F531-W546 HydrophobicContact CG-CE3 3.79Å; F531-W546 HydrophobicContact CG-CZ3 4.26Å; F531-W546 AromaticContact CZ-CE3 3.71Å; F531-W546 HydrophobicContact CZ-CE3 3.71Å; F531-W546 HydrophobicContact CZ-CZ3 4.29Å
532	L	80.6	Confident	77.8	Confident	15 Å²	15	81 Å²	81	8%	0.079	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	140.4	173.8	179.9	62.4	0	0	0	110.7	K534 R545 F547 L577 F580	L532-K534 PolarHBondContact O-N 2.87Å; L532-R545 PolarHBondContact N-O 2.78Å; L532-R545 PolarHBondContact O-N 2.72Å; L532-F547 HydrophobicContact CB-CD1 3.58Å; L532-F547 HydrophobicContact CB-CE1 4Å; L532-F547 HydrophobicContact CB-CG 4.48Å; L532-L577 HydrophobicContact CD2-CD1 4.13Å; L532-F580 HydrophobicContact CD1-CB 4.19Å; L532-F580 HydrophobicContact CD1-CD1 4.15Å; L532-F580 WeakPolarHBondContact CD1-O 3.43Å
533	T	77.6	Confident	77.4	Confident	75 Å²	75	77.4 Å²	77.4	46%	0.46	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	91.7	174.3	-64.7	0	0	0	0	109.7	W542	T533-W542 HydrophobicContact CG2-CB 3.94Å; T533-W542 HydrophobicContact CG2-CE3 4.27Å
534	K	76	Confident	77.3	Confident	74 Å²	74	81.6 Å²	81.6	32%	0.322	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	138.1	-174.2	-179.2	171.1	-172.4	-57.6	0	112.5	L532 K543 Y558	L532-K534 PolarHBondContact O-N 2.87Å; K534-K543 PolarHBondContact N-O 2.98Å; K534-K543 PolarHBondContact O-N 2.92Å; K534-Y558 HydrophobicContact CD-CD1 4.02Å; K534-Y558 HydrophobicContact CD-CE1 3.48Å; K534-Y558 VanDerWaalsContact CD-CE1 3.48Å; K534-Y558 HydrophobicContact CD-CE2 4.06Å; K534-Y558 HydrophobicContact CD-CG 4.49Å; K534-Y558 VanDerWaalsContact CD-CZ 3.49Å
535	R	74.8	Confident	77.3	Confident	129 Å²	129	81.7 Å²	81.7	49%	0.487	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	130	168.4	-163.6	167	69.1	149.2	-4.6	111.4	K540 W542	R535-K540 HydrophobicContact CG-CB 4.32Å; R535-W542 HydrophobicContact CB-CD2 4.13Å; R535-W542 HydrophobicContact CB-CE3 3.81Å; R535-W542 HydrophobicContact CB-CH2 4.08Å; R535-W542 HydrophobicContact CB-CZ2 4.37Å; R535-W542 HydrophobicContact CB-CZ3 3.79Å; R535-W542 HydrophobicContact CG-CD2 4.48Å
536	G	69.6	Low	77.3	Confident	25 Å²	25	81 Å²	81	26%	0.258	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-66.7	153.5	177.9	0	0	0	0	0	113.7	V539 T541	G536-V539 CarbonylContact C-O 3.59Å; G536-V539 WeakPolarHBondContact CA-O 3.45Å; G536-T541 PolarHBondContact N-O 3.3Å
537	G	66.9	Low	77.5	Confident	56 Å²	56	76.6 Å²	76.6	58%	0.577	36%	0.359	S	S	*	.	S	Bend	trans	-73.7	-71.6	-179.2	0	0	0	0	0	112.5	K540	G537-K540 PolarHBondContact O-NZ 2.92Å
538	R	60.5	Low	77.6	Confident	257 Å²	257	74 Å²	74	97%	0.97	35%	0.352	S	S	*	.	S	Bend	trans	-70.2	-33.9	-178.3	-169.1	177.4	-174.3	-176.3	2.5	113.5
539	V	60.8	Low	77.4	Confident	93 Å²	93	74 Å²	74	56%	0.564	35%	0.351	S	S	*	.	S	Bend	trans	-121.4	125.8	173.4	-176.3	0	0	0	0	107.3	G536 T541	G536-V539 CarbonylContact C-O 3.59Å; G536-V539 WeakPolarHBondContact CA-O 3.45Å; V539-T541 HydrophobicContact CG1-CG2 4.08Å; V539-T541 PolarHBondContact O-N 3.04Å
540	K	77.9	Confident	77.3	Confident	123 Å²	123	73.5 Å²	73.5	54%	0.535	35%	0.346	S	S	.	.			trans	-77.7	25.5	-173.9	-55.6	-52.8	-174.2	-164.6	0	114.3	R535 G537	R535-K540 HydrophobicContact CG-CB 4.32Å; G537-K540 PolarHBondContact O-NZ 2.92Å
541	T	72.3	Confident	76.9	Confident	64 Å²	64	74 Å²	74	39%	0.393	35%	0.35	S	S	.	.			trans	-71.4	140.2	172.2	37.2	0	0	0	0	110.7	G536 V539 K543	G536-T541 PolarHBondContact N-O 3.3Å; V539-T541 HydrophobicContact CG1-CG2 4.08Å; V539-T541 PolarHBondContact O-N 3.04Å; T541-K543 VanDerWaalsContact OG1-CE 3.31Å; T541-K543 WeakPolarHBondContact OG1-CE 3.48Å
542	W	77	Confident	76.6	Confident	154 Å²	154	73.3 Å²	73.3	58%	0.583	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.7	133.9	168.3	-62.1	100.4	0	0	0	109.4	T533 R535	T533-W542 HydrophobicContact CG2-CB 3.94Å; T533-W542 HydrophobicContact CG2-CE3 4.27Å; R535-W542 HydrophobicContact CB-CD2 4.13Å; R535-W542 HydrophobicContact CB-CE3 3.81Å; R535-W542 HydrophobicContact CB-CH2 4.08Å; R535-W542 HydrophobicContact CB-CZ2 4.37Å; R535-W542 HydrophobicContact CB-CZ3 3.79Å; R535-W542 HydrophobicContact CG-CD2 4.48Å
543	K	72.4	Confident	76.5	Confident	109 Å²	109	77.5 Å²	77.5	47%	0.474	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	129	178.8	-61.7	-166.8	178.2	-165.9	0	110.5	K534 T541 R545	K534-K543 PolarHBondContact N-O 2.98Å; K534-K543 PolarHBondContact O-N 2.92Å; T541-K543 VanDerWaalsContact OG1-CE 3.31Å; T541-K543 WeakPolarHBondContact OG1-CE 3.48Å; K543-R545 PolarHBondContact O-N 2.63Å
544	K	82.3	Confident	76.4	Confident	118 Å²	118	80.6 Å²	80.6	51%	0.513	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	129	168.5	-164	166.2	-175.8	170.1	0	108.2	D520 F531	D520-K544 IonicContact OD2-NZ 3.63Å; F531-K544 HydrophobicContact CB-CD 4.23Å; F531-K544 HydrophobicContact CB-CG 4.02Å; F531-K544 HydrophobicContact CD1-CD 4.39Å; F531-K544 HydrophobicContact CD1-CG 3.96Å; F531-K544 HydrophobicContact CG-CD 4.37Å; F531-K544 VanDerWaalsContact CG-CE 3.41Å; F531-K544 HydrophobicContact CG-CG 4.26Å
545	R	81.2	Confident	76.5	Confident	71 Å²	71	80.6 Å²	80.6	27%	0.268	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	141.6	-178.6	-76	-69.9	-179.6	-113.2	18.1	108.7	F531 L532 K543 Y558 Y559	F531-R545 WeakPolarHBondContact CA-O 3.3Å; L532-R545 PolarHBondContact N-O 2.78Å; L532-R545 PolarHBondContact O-N 2.72Å; K543-R545 PolarHBondContact O-N 2.63Å; R545-Y558 HydrophobicContact CB-CD1 4.43Å; R545-Y559 WeakPolarHBondContact CD-O 3.4Å
546	W	83.9	Confident	76.9	Confident	51 Å²	51	74.6 Å²	74.6	19%	0.193	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	127.9	167.3	-173.9	-94	0	0	0	107.9	A529 G530 F531 Y558 Y559	A529-W546 HydrophobicContact CB-CZ2 3.89Å; G530-W546 VanDerWaalsContact C-CE3 3.43Å; G530-W546 CarbonylContact O-C 3.56Å; G530-W546 WeakPolarHBondContact O-CA 3.45Å; F531-W546 HydrophobicContact CD1-CB 4.23Å; F531-W546 AromaticContact CD1-CE3 3.91Å; F531-W546 HydrophobicContact CD1-CE3 3.91Å; F531-W546 AromaticContact CD2-CE3 3.63Å; F531-W546 HydrophobicContact CD2-CE3 3.63Å; F531-W546 AromaticContact CD2-CZ3 3.72Å; F531-W546 HydrophobicContact CD2-CZ3 3.72Å; F531-W546 HydrophobicContact CE1-CB 4.09Å; F531-W546 AromaticContact CE1-CE3 3.87Å; F531-W546 HydrophobicContact CE1-CE3 3.87Å; F531-W546 AromaticContact CE2-CE3 3.59Å; F531-W546 HydrophobicContact CE2-CE3 3.59Å; F531-W546 AromaticContact CE2-CZ3 3.73Å; F531-W546 HydrophobicContact CE2-CZ3 3.73Å; F531-W546 AromaticContact CG-CE3 3.79Å; F531-W546 HydrophobicContact CG-CE3 3.79Å; F531-W546 HydrophobicContact CG-CZ3 4.26Å; F531-W546 AromaticContact CZ-CE3 3.71Å; F531-W546 HydrophobicContact CZ-CE3 3.71Å; F531-W546 HydrophobicContact CZ-CZ3 4.29Å; W546-Y558 WeakPolarHBondContact O-CA 3.22Å; W546-Y559 PolarHBondContact N-O 3.21Å; W546-Y559 PolarHBondContact O-N 3.45Å
547	F	87.1	Confident	77.4	Confident	0 Å²	0	73.4 Å²	73.4	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	155.5	176	78.6	-88.5	0	0	0	110.9	L521 C528 A529 G530 L532 L556 A557 Y558 L577	L521-F547 HydrophobicContact CD2-CE1 4.14Å; L521-F547 HydrophobicContact CD2-CZ 4.21Å; C528-F547 HydrophobicContact CB-CE2 4.43Å; C528-F547 WeakPolarHBondContact O-CE2 3.25Å; A529-F547 VanDerWaalsContact CA-O 3.23Å; A529-F547 WeakPolarHBondContact CA-O 3.35Å; A529-F547 WeakPolarHBondContact CB-O 3.34Å; G530-F547 PolarHBondContact N-O 3Å; G530-F547 WeakPolarHBondContact O-CD1 3.46Å; G530-F547 PolarHBondContact O-N 3.42Å; L532-F547 HydrophobicContact CB-CD1 3.58Å; L532-F547 HydrophobicContact CB-CE1 4Å; L532-F547 HydrophobicContact CB-CG 4.48Å; F547-L556 HydrophobicContact CB-CD1 4.42Å; F547-L556 HydrophobicContact CD2-CD1 4.1Å; F547-A557 CarbonylContact C-O 3.57Å; F547-A557 WeakPolarHBondContact CA-O 3.32Å; F547-Y558 HydrophobicContact CB-CD1 3.87Å; F547-Y558 HydrophobicContact CB-CE1 3.92Å; F547-L577 HydrophobicContact CD2-CD2 3.96Å; F547-L577 HydrophobicContact CE2-CD2 3.82Å; F547-L577 HydrophobicContact CE2-CG 4.41Å
548	L	86.3	Confident	78.1	Confident	37 Å²	37	71.4 Å²	71.4	19%	0.194	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	111.8	170.1	171.1	63.3	0	0	0	108.2	A529 D550 L556 A557 Y559	A529-L548 HydrophobicContact CB-CD1 3.93Å; L548-D550 HydrophobicContact CG-CB 4.44Å; L548-L556 WeakPolarHBondContact O-CA 3.49Å; L548-A557 HydrophobicContact CB-CB 4.49Å; L548-A557 PolarHBondContact N-O 3.02Å; L548-A557 PolarHBondContact O-N 2.8Å; L548-Y559 HydrophobicContact CB-CE2 4.15Å
549	F	84.7	Confident	78.9	Confident	13 Å²	13	61.8 Å²	61.8	6%	0.057	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	130.7	163.4	-177.4	-103	0	0	0	109.1	L504 R527 C528 T551 R555 L556 L574 L577	L504-F549 HydrophobicContact CD2-CD1 4.13Å; L504-F549 HydrophobicContact CD2-CE1 4.4Å; R527-F549 CarbonylContact C-O 3.54Å; R527-F549 VanDerWaalsContact CA-O 3.26Å; R527-F549 WeakPolarHBondContact CA-O 3.31Å; C528-F549 HydrophobicContact CB-CB 4.39Å; C528-F549 PolarHBondContact N-O 3.47Å; C528-F549 PolarHBondContact O-N 2.92Å; F549-T551 HydrophobicContact CD1-CG2 4.32Å; F549-T551 HydrophobicContact CE1-CG2 3.43Å; F549-T551 VanDerWaalsContact CE1-CG2 3.43Å; F549-T551 HydrophobicContact CZ-CG2 3.96Å; F549-R555 WeakPolarHBondContact CA-O 3.47Å; F549-L556 HydrophobicContact CB-CD1 4.05Å; F549-L556 HydrophobicContact CD2-CB 4.37Å; F549-L556 HydrophobicContact CD2-CD1 4.48Å; F549-L574 HydrophobicContact CD1-CD1 4Å; F549-L574 HydrophobicContact CE1-CD1 3.58Å; F549-L574 HydrophobicContact CE1-CD2 4.44Å; F549-L574 HydrophobicContact CZ-CB 4.44Å; F549-L574 HydrophobicContact CZ-CD1 3.88Å; F549-L577 HydrophobicContact CB-CD2 3.82Å; F549-L577 HydrophobicContact CD2-CD2 4.3Å; F549-L577 HydrophobicContact CG-CD2 4.22Å
550	D	82.8	Confident	79.2	Confident	1 Å²	1	60.9 Å²	60.9	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	108.5	-171.4	-172.7	-42.1	0	0	0	108.6	R527 L548 D552 H553 K554 R555	R527-D550 WeakPolarHBondContact CD-OD2 3.47Å; R527-D550 HydrophobicContact CG-CB 4.42Å; R527-D550 IonicContact CZ-OD1 3.91Å; R527-D550 IonicContact CZ-OD2 3.57Å; R527-D550 VanDerWaalsContact CZ-OD2 3.25Å; R527-D550 IonicContact NE-OD1 3.15Å; R527-D550 PolarHBondContact NE-OD1 2.92Å; R527-D550 IonicContact NE-OD2 3.94Å; R527-D550 PolarHBondContact NE-OD2 3.42Å; R527-D550 IonicContact NH1-OD2 3.68Å; R527-D550 PolarHBondContact NH1-OD2 2.77Å; R527-D550 VanDerWaalsContact NH1-OD2 3.08Å; L548-D550 HydrophobicContact CG-CB 4.44Å; D550-D552 WeakPolarHBondContact OD1-CB 3.43Å; D550-D552 PolarHBondContact OD1-N 3.43Å; D550-H553 HydrophobicContact CB-CB 4.48Å; D550-H553 IonicContact OD1-CE1 3.76Å; D550-H553 IonicContact OD1-CG 3.59Å; D550-H553 PolarHBondContact OD1-N 3.05Å; D550-H553 IonicContact OD1-ND1 2.7Å; D550-H553 PolarHBondContact OD1-ND1 2.96Å; D550-H553 IonicContact OD2-CE1 2.77Å; D550-H553 IonicContact OD2-CG 3.12Å; D550-H553 IonicContact OD2-ND1 2.75Å; D550-H553 PolarHBondContact OD2-ND1 2.97Å; D550-K554 WeakPolarHBondContact O-CA 3.42Å; D550-K554 PolarHBondContact O-N 3.45Å; D550-R555 PolarHBondContact N-O 2.84Å; D550-R555 PolarHBondContact O-N 2.83Å
551	T	77.4	Confident	78.6	Confident	11 Å²	11	55.9 Å²	55.9	7%	0.067	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-32.4	-177.4	61.9	0	0	0	0	112.3	F497 R526 F549 H553 K554	F497-T551 HydrophobicContact CB-CG2 4.4Å; R526-T551 WeakPolarHBondContact CA-OG1 3.47Å; R526-T551 VanDerWaalsContact CB-OG1 3.3Å; R526-T551 WeakPolarHBondContact CB-OG1 3.43Å; R526-T551 PolarHBondContact O-N 2.7Å; R526-T551 PolarHBondContact O-OG1 2.93Å; R526-T551 VanDerWaalsContact O-OG1 3.04Å; F549-T551 HydrophobicContact CD1-CG2 4.32Å; F549-T551 HydrophobicContact CE1-CG2 3.43Å; F549-T551 VanDerWaalsContact CE1-CG2 3.43Å; F549-T551 HydrophobicContact CZ-CG2 3.96Å; T551-H553 VanDerWaalsContact C-N 3.33Å; T551-H553 PolarHBondContact O-N 3Å; T551-K554 WeakPolarHBondContact O-CG 3.4Å; T551-K554 PolarHBondContact O-N 3.06Å; T551-K554 VanDerWaalsContact O-N 3.15Å
552	D	77	Confident	77.8	Confident	63 Å²	63	63.8 Å²	63.8	34%	0.337	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-48.1	176.5	-55.2	-55.6	0	0	0	110.4	R526 R527 D550	R526-D552 WeakPolarHBondContact CD-OD1 3.07Å; R526-D552 IonicContact CZ-OD1 3.87Å; R526-D552 IonicContact NE-OD1 2.66Å; R526-D552 IonicContact NH1-OD1 3.95Å; R526-D552 PolarHBondContact NH1-OD1 3.41Å; R527-D552 IonicContact CZ-OD2 2.68Å; R527-D552 VanDerWaalsContact CZ-OD2 3.28Å; R527-D552 IonicContact NE-OD2 2.69Å; R527-D552 PolarHBondContact NE-OD2 3.5Å; R527-D552 IonicContact NH2-OD2 2.96Å; R527-D552 PolarHBondContact NH2-OD2 3.37Å; D550-D552 WeakPolarHBondContact OD1-CB 3.43Å; D550-D552 PolarHBondContact OD1-N 3.43Å
553	H	77.3	Confident	76.6	Confident	104 Å²	104	63.1 Å²	63.1	48%	0.481	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	5.5	179.5	-57.2	88.6	0	0	0	113.4	D550 T551 R555	D550-H553 HydrophobicContact CB-CB 4.48Å; D550-H553 IonicContact OD1-CE1 3.76Å; D550-H553 IonicContact OD1-CG 3.59Å; D550-H553 PolarHBondContact OD1-N 3.05Å; D550-H553 IonicContact OD1-ND1 2.7Å; D550-H553 PolarHBondContact OD1-ND1 2.96Å; D550-H553 IonicContact OD2-CE1 2.77Å; D550-H553 IonicContact OD2-CG 3.12Å; D550-H553 IonicContact OD2-ND1 2.75Å; D550-H553 PolarHBondContact OD2-ND1 2.97Å; T551-H553 VanDerWaalsContact C-N 3.33Å; T551-H553 PolarHBondContact O-N 3Å; H553-R555 HydrophobicContact CB-CB 4.23Å; H553-R555 WeakPolarHBondContact O-CB 3.24Å; H553-R555 PolarHBondContact O-N 3.2Å; H553-R555 VanDerWaalsContact O-N 3.14Å
554	K	77.4	Confident	75.6	Confident	139 Å²	139	58.8 Å²	58.8	60%	0.604	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.9	39.6	-179.5	-52.9	-178	-171.5	-176.8	0	113.3	L498 D550 T551	L498-K554 HydrophobicContact CD2-CD 3.81Å; L498-K554 HydrophobicContact CD2-CG 3.92Å; D550-K554 WeakPolarHBondContact O-CA 3.42Å; D550-K554 PolarHBondContact O-N 3.45Å; T551-K554 WeakPolarHBondContact O-CG 3.4Å; T551-K554 PolarHBondContact O-N 3.06Å; T551-K554 VanDerWaalsContact O-N 3.15Å
555	R	77.8	Confident	73.9	Confident	75 Å²	75	61.8 Å²	61.8	28%	0.283	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	135.8	-163.4	168	168.5	66.8	-163.8	-3.9	112.8	F549 D550 H553 A557 H569	F549-R555 WeakPolarHBondContact CA-O 3.47Å; D550-R555 PolarHBondContact N-O 2.84Å; D550-R555 PolarHBondContact O-N 2.83Å; H553-R555 HydrophobicContact CB-CB 4.23Å; H553-R555 WeakPolarHBondContact O-CB 3.24Å; H553-R555 PolarHBondContact O-N 3.2Å; H553-R555 VanDerWaalsContact O-N 3.14Å; R555-A557 HydrophobicContact CG-CB 4.18Å; R555-H569 VanDerWaalsContact CD-CD2 3.48Å; R555-H569 WeakPolarHBondContact CD-CD2 3.48Å; R555-H569 WeakPolarHBondContact CD-NE2 3.5Å; R555-H569 VanDerWaalsContact CG-NE2 3.31Å; R555-H569 WeakPolarHBondContact CG-NE2 3.32Å
556	L	81.6	Confident	72.5	Confident	2 Å²	2	62.9 Å²	62.9	1%	0.01	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	122.9	156.1	-177.3	59.3	0	0	0	110.4	F547 L548 F549 Y558 A570 V572 L577	F547-L556 HydrophobicContact CB-CD1 4.42Å; F547-L556 HydrophobicContact CD2-CD1 4.1Å; L548-L556 WeakPolarHBondContact O-CA 3.49Å; F549-L556 HydrophobicContact CB-CD1 4.05Å; F549-L556 HydrophobicContact CD2-CB 4.37Å; F549-L556 HydrophobicContact CD2-CD1 4.48Å; L556-Y558 HydrophobicContact CD2-CE2 3.97Å; L556-Y558 WeakPolarHBondContact CD2-OH 3.3Å; L556-Y558 HydrophobicContact CG-CE2 3.89Å; L556-A570 WeakPolarHBondContact CB-O 3.29Å; L556-A570 PolarHBondContact N-O 3.31Å; L556-A570 PolarHBondContact O-N 2.8Å; L556-A570 VanDerWaalsContact O-N 3.12Å; L556-V572 HydrophobicContact CD2-CB 3.79Å; L556-V572 HydrophobicContact CD2-CG2 3.68Å; L556-L577 HydrophobicContact CD1-CD1 4.34Å; L556-L577 HydrophobicContact CD1-CD2 3.68Å; L556-L577 HydrophobicContact CD2-CD1 3.69Å; L556-L577 HydrophobicContact CD2-CD2 4.16Å
557	A	80.6	Confident	71.1	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	148.1	-178.9	0	0	0	0	0	111.5	F547 L548 R555 Y559 L566	F547-A557 CarbonylContact C-O 3.57Å; F547-A557 WeakPolarHBondContact CA-O 3.32Å; L548-A557 HydrophobicContact CB-CB 4.49Å; L548-A557 PolarHBondContact N-O 3.02Å; L548-A557 PolarHBondContact O-N 2.8Å; R555-A557 HydrophobicContact CG-CB 4.18Å; A557-Y559 HydrophobicContact CB-CE2 3.72Å; A557-L566 HydrophobicContact CB-CD1 3.64Å
558	Y	81.6	Confident	69.6	Low	15 Å²	15	67 Å²	67	6%	0.059	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	135	177.4	-63.2	-84.9	0	0	0	112	K534 R545 W546 F547 L556 C567 V568	K534-Y558 HydrophobicContact CD-CD1 4.02Å; K534-Y558 HydrophobicContact CD-CE1 3.48Å; K534-Y558 VanDerWaalsContact CD-CE1 3.48Å; K534-Y558 HydrophobicContact CD-CE2 4.06Å; K534-Y558 HydrophobicContact CD-CG 4.49Å; K534-Y558 VanDerWaalsContact CD-CZ 3.49Å; R545-Y558 HydrophobicContact CB-CD1 4.43Å; W546-Y558 WeakPolarHBondContact O-CA 3.22Å; F547-Y558 HydrophobicContact CB-CD1 3.87Å; F547-Y558 HydrophobicContact CB-CE1 3.92Å; L556-Y558 HydrophobicContact CD2-CE2 3.97Å; L556-Y558 WeakPolarHBondContact CD2-OH 3.3Å; L556-Y558 HydrophobicContact CG-CE2 3.89Å; Y558-C567 PolarHBondContact O-N 3.08Å; Y558-V568 HydrophobicContact CD2-CB 4.25Å; Y558-V568 PolarHBondContact N-O 2.78Å
559	Y	77.5	Confident	67.9	Low	55 Å²	55	70.8 Å²	70.8	22%	0.216	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	154.1	-175.5	-57.9	-91.1	0	0	0	111.1	R545 W546 L548 A557 G561 G564 L566	R545-Y559 WeakPolarHBondContact CD-O 3.4Å; W546-Y559 PolarHBondContact N-O 3.21Å; W546-Y559 PolarHBondContact O-N 3.45Å; L548-Y559 HydrophobicContact CB-CE2 4.15Å; A557-Y559 HydrophobicContact CB-CE2 3.72Å; Y559-G561 VanDerWaalsContact C-N 3.26Å; Y559-G561 WeakPolarHBondContact CB-O 3.43Å; Y559-G561 PolarHBondContact O-N 3.1Å; Y559-G564 WeakPolarHBondContact CB-O 3.09Å; Y559-L566 HydrophobicContact CD1-CB 4.37Å; Y559-L566 HydrophobicContact CE1-CB 4.02Å; Y559-L566 HydrophobicContact CE1-CD1 4.13Å
560	T	67.1	Low	66.3	Low	73 Å²	73	71.4 Å²	71.4	45%	0.448	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	-24.4	179.3	58.9	0	0	0	0	112.9	G564 C567	T560-G564 PolarHBondContact N-O 3.08Å; T560-G564 PolarHBondContact OG1-O 2.93Å; T560-C567 WeakPolarHBondContact CG2-SG 3.49Å
561	G	65.6	Low	64.4	Low	18 Å²	18	77 Å²	77	19%	0.186	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.6	-176.1	169.2	0	0	0	0	0	108.8	Y559 T563 G564	Y559-G561 VanDerWaalsContact C-N 3.26Å; Y559-G561 WeakPolarHBondContact CB-O 3.43Å; Y559-G561 PolarHBondContact O-N 3.1Å; G561-T563 PolarHBondContact O-N 3.2Å; G561-G564 PolarHBondContact O-N 3.26Å
562	W	54.8	Low	63.1	Low	231 Å²	231	79.2 Å²	79.2	88%	0.875	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.5	-46.4	175.6	165.9	6.2	0	0	0	112
563	T	52.6	Low	61.8	Low	139 Å²	139	79.8 Å²	79.8	85%	0.853	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	10.4	-170.8	51.8	0	0	0	0	115.2	G561	G561-T563 PolarHBondContact O-N 3.2Å
564	G	50.3	Low	60.6	Low	19 Å²	19	75.1 Å²	75.1	20%	0.196	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	121	-162	0	0	0	0	0	118.4	Y559 T560 G561	Y559-G564 WeakPolarHBondContact CB-O 3.09Å; T560-G564 PolarHBondContact N-O 3.08Å; T560-G564 PolarHBondContact OG1-O 2.93Å; G561-G564 PolarHBondContact O-N 3.26Å
565	K	47.3	Very low	59.2	Low	181 Å²	181	71.2 Å²	71.2	79%	0.787	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	35.1	111	156.9	-68	-175.2	176.9	-179.2	0	117.7	C567	K565-C567 PolarHBondContact O-N 3.4Å; K565-C567 PolarHBondContact O-SG 3.04Å; K565-C567 VanDerWaalsContact O-SG 3.4Å
566	L	52	Low	57.9	Low	93 Å²	93	73 Å²	73	49%	0.487	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.5	128.5	165.7	-178.9	67.8	0	0	0	110.6	A557 Y559	A557-L566 HydrophobicContact CB-CD1 3.64Å; Y559-L566 HydrophobicContact CD1-CB 4.37Å; Y559-L566 HydrophobicContact CE1-CB 4.02Å; Y559-L566 HydrophobicContact CE1-CD1 4.13Å
567	C	53.4	Low	56.7	Low	64 Å²	64	73.4 Å²	73.4	43%	0.432	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	-34.6	-175.2	-70.9	0	0	0	0	113.9	Y558 T560 K565	Y558-C567 PolarHBondContact O-N 3.08Å; T560-C567 WeakPolarHBondContact CG2-SG 3.49Å; K565-C567 PolarHBondContact O-N 3.4Å; K565-C567 PolarHBondContact O-SG 3.04Å; K565-C567 VanDerWaalsContact O-SG 3.4Å
568	V	56.5	Low	55.6	Low	73 Å²	73	73.8 Å²	73.8	44%	0.442	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	140.1	-176.9	-177.6	0	0	0	0	109	Y558	Y558-V568 HydrophobicContact CD2-CB 4.25Å; Y558-V568 PolarHBondContact N-O 2.78Å
569	H	51	Low	54.1	Low	117 Å²	117	77 Å²	77	54%	0.542	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	136.7	163.7	-165.2	-97	0	0	0	108.7	R555	R555-H569 VanDerWaalsContact CD-CD2 3.48Å; R555-H569 WeakPolarHBondContact CD-CD2 3.48Å; R555-H569 WeakPolarHBondContact CD-NE2 3.5Å; R555-H569 VanDerWaalsContact CG-NE2 3.31Å; R555-H569 WeakPolarHBondContact CG-NE2 3.32Å
570	A	51.3	Low	53	Low	27 Å²	27	80 Å²	80	22%	0.223	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	151.2	177.3	0	0	0	0	0	112.1	L556 V572	L556-A570 WeakPolarHBondContact CB-O 3.29Å; L556-A570 PolarHBondContact N-O 3.31Å; L556-A570 PolarHBondContact O-N 2.8Å; L556-A570 VanDerWaalsContact O-N 3.12Å; A570-V572 HydrophobicContact CB-CG2 4.06Å
571	C	42.8	Very low	52.3	Low	117 Å²	117	77.6 Å²	77.6	79%	0.791	42%	0.424	S	S	*	.			trans	-92.7	126.9	157.4	-63.7	0	0	0	0	107.8
572	V	50.3	Low	51.6	Low	58 Å²	58	78.2 Å²	78.2	35%	0.352	42%	0.422	S	S	.	.			trans	-137.8	141.1	177.5	-179.4	0	0	0	0	107.6	L556 A570	L556-V572 HydrophobicContact CD2-CB 3.79Å; L556-V572 HydrophobicContact CD2-CG2 3.68Å; A570-V572 HydrophobicContact CB-CG2 4.06Å
573	C	49.1	Very low	51	Low	75 Å²	75	75.6 Å²	75.6	51%	0.507	43%	0.431	S	S	.	.			trans	-64.2	135.4	177	-168.9	0	0	0	0	110.5	C575 L576	C573-C575 PolarHBondContact O-N 2.9Å; C573-L576 HydrophobicContact CB-CD1 4.46Å; C573-L576 PolarHBondContact O-N 3.33Å
574	L	51.1	Low	51	Low	7 Å²	7	72.5 Å²	72.5	4%	0.037	41%	0.41	C	S	.	.	S	Bend	trans	-56.9	-43.8	-170.8	176.7	53	0	0	0	113.3	F497 F502 L504 F549 L576 L577 I578	F497-L574 HydrophobicContact CB-CD2 4.02Å; F502-L574 HydrophobicContact CE1-CD2 4.15Å; F502-L574 HydrophobicContact CZ-CD2 3.87Å; L504-L574 HydrophobicContact CD1-CD1 3.78Å; L504-L574 HydrophobicContact CD1-CD2 3.75Å; L504-L574 HydrophobicContact CD1-CG 4.29Å; F549-L574 HydrophobicContact CD1-CD1 4Å; F549-L574 HydrophobicContact CE1-CD1 3.58Å; F549-L574 HydrophobicContact CE1-CD2 4.44Å; F549-L574 HydrophobicContact CZ-CB 4.44Å; F549-L574 HydrophobicContact CZ-CD1 3.88Å; L574-L576 PolarHBondContact O-N 3.03Å; L574-L577 WeakPolarHBondContact O-CB 3.48Å; L574-L577 PolarHBondContact O-N 2.78Å; L574-I578 HydrophobicContact CD1-CD1 3.85Å; L574-I578 HydrophobicContact CD1-CG1 4.17Å; L574-I578 HydrophobicContact CG-CD1 3.75Å; L574-I578 PolarHBondContact O-N 2.88Å
575	C	48.7	Very low	51	Low	57 Å²	57	75.3 Å²	75.3	39%	0.385	42%	0.422	S	S	.	.	H	α-helix	trans	-56.4	-48	-177.1	-40.2	0	0	0	0	112	C573 L577 I578 D579	C573-C575 PolarHBondContact O-N 2.9Å; C575-L577 PolarHBondContact O-N 3.43Å; C575-I578 PolarHBondContact O-N 2.65Å; C575-D579 VanDerWaalsContact O-CG 3.28Å; C575-D579 PolarHBondContact O-N 3.28Å
576	L	51.4	Low	51.2	Low	112 Å²	112	69.4 Å²	69.4	59%	0.586	40%	0.401	S	S	*	.	H	α-helix	trans	-62.4	-12	179.4	-65.6	175.1	0	0	0	114.4	C573 L574	C573-L576 HydrophobicContact CB-CD1 4.46Å; C573-L576 PolarHBondContact O-N 3.33Å; L574-L576 PolarHBondContact O-N 3.03Å
577	L	56.2	Low	51.2	Low	11 Å²	11	68 Å²	68	6%	0.058	40%	0.396	C	S	.	.	H	α-helix	trans	-96.1	-28.3	174.2	-153.1	76.2	0	0	0	112.3	L532 F547 F549 L556 L574 C575 A581	L532-L577 HydrophobicContact CD2-CD1 4.13Å; F547-L577 HydrophobicContact CD2-CD2 3.96Å; F547-L577 HydrophobicContact CE2-CD2 3.82Å; F547-L577 HydrophobicContact CE2-CG 4.41Å; F549-L577 HydrophobicContact CB-CD2 3.82Å; F549-L577 HydrophobicContact CD2-CD2 4.3Å; F549-L577 HydrophobicContact CG-CD2 4.22Å; L556-L577 HydrophobicContact CD1-CD1 4.34Å; L556-L577 HydrophobicContact CD1-CD2 3.68Å; L556-L577 HydrophobicContact CD2-CD1 3.69Å; L556-L577 HydrophobicContact CD2-CD2 4.16Å; L574-L577 WeakPolarHBondContact O-CB 3.48Å; L574-L577 PolarHBondContact O-N 2.78Å; C575-L577 PolarHBondContact O-N 3.43Å; L577-A581 VanDerWaalsContact O-CB 3.32Å; L577-A581 WeakPolarHBondContact O-CB 3.4Å
578	I	57.3	Low	51	Low	7 Å²	7	68.3 Å²	68.3	4%	0.036	39%	0.394	C	S	.	.	H	α-helix	trans	-76.2	-50.3	176.6	-62	162	0	0	0	109.1	V508 L511 H513 L574 C575 F580 A581 F582	V508-I578 HydrophobicContact CG1-CG2 4.29Å; V508-I578 HydrophobicContact CG2-CD1 3.67Å; V508-I578 HydrophobicContact CG2-CG1 3.98Å; V508-I578 HydrophobicContact CG2-CG2 4.26Å; L511-I578 HydrophobicContact CD1-CD1 4.31Å; H513-I578 WeakPolarHBondContact NE2-CG2 3.41Å; L574-I578 HydrophobicContact CD1-CD1 3.85Å; L574-I578 HydrophobicContact CD1-CG1 4.17Å; L574-I578 HydrophobicContact CG-CD1 3.75Å; L574-I578 PolarHBondContact O-N 2.88Å; C575-I578 PolarHBondContact O-N 2.65Å; I578-F580 PolarHBondContact O-N 3.32Å; I578-A581 PolarHBondContact O-N 3.17Å; I578-F582 HydrophobicContact CB-CD2 4.43Å; I578-F582 HydrophobicContact CG2-CD2 3.68Å; I578-F582 HydrophobicContact CG2-CE2 4Å; I578-F582 HydrophobicContact CG2-CG 4.45Å; I578-F582 WeakPolarHBondContact O-CD2 3.36Å; I578-F582 PolarHBondContact O-N 3.01Å; I578-F582 VanDerWaalsContact O-N 3.1Å
579	D	50.8	Low	50.7	Low	83 Å²	83	67.9 Å²	67.9	44%	0.444	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-23.7	177.8	-59.2	-35.4	0	0	0	113.3	C575 V583	C575-D579 VanDerWaalsContact O-CG 3.28Å; C575-D579 PolarHBondContact O-N 3.28Å; D579-V583 WeakPolarHBondContact O-CG2 3.33Å
580	F	52.5	Low	50.6	Low	119 Å²	119	64.4 Å²	64.4	52%	0.522	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-3.3	-178.1	-119.5	-74.2	0	0	0	114.5	L532 I578	L532-F580 HydrophobicContact CD1-CB 4.19Å; L532-F580 HydrophobicContact CD1-CD1 4.15Å; L532-F580 WeakPolarHBondContact CD1-O 3.43Å; I578-F580 PolarHBondContact O-N 3.32Å
581	A	52.6	Low	50.6	Low	21 Å²	21	67.3 Å²	67.3	17%	0.174	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.2	-18.2	-177.3	0	0	0	0	0	113.4	L521 L577 I578	L521-A581 HydrophobicContact CD1-CB 4.05Å; L521-A581 HydrophobicContact CD2-CB 4.34Å; L577-A581 VanDerWaalsContact O-CB 3.32Å; L577-A581 WeakPolarHBondContact O-CB 3.4Å; I578-A581 PolarHBondContact O-N 3.17Å
582	F	51.5	Low	51.2	Low	32 Å²	32	63.2 Å²	63.2	14%	0.14	36%	0.359	C	S	.	.			trans	-111.9	23.1	-179.9	-67.1	-98.7	0	0	0	112.8	V508 H513 V515 C518 L521 L523 I578	V508-F582 HydrophobicContact CG1-CD1 4.42Å; V508-F582 HydrophobicContact CG1-CE1 3.8Å; V508-F582 HydrophobicContact CG1-CE2 3.94Å; V508-F582 HydrophobicContact CG1-CZ 3.52Å; H513-F582 HydrophobicContact CB-CB 4.22Å; H513-F582 HydrophobicContact CB-CD1 3.73Å; H513-F582 HydrophobicContact CB-CE1 4.27Å; H513-F582 HydrophobicContact CB-CG 4.06Å; H513-F582 WeakPolarHBondContact ND1-CB 3.41Å; V515-F582 HydrophobicContact CG2-CE1 4.17Å; V515-F582 HydrophobicContact CG2-CZ 4.49Å; C518-F582 HydrophobicContact CB-CD1 4.39Å; C518-F582 HydrophobicContact CB-CE1 4.13Å; C518-F582 WeakPolarHBondContact SG-CD1 3.48Å; L521-F582 HydrophobicContact CD1-CD1 4.25Å; L521-F582 HydrophobicContact CD1-CD2 3.98Å; L521-F582 HydrophobicContact CD1-CE1 3.87Å; L521-F582 HydrophobicContact CD1-CE2 3.58Å; L521-F582 HydrophobicContact CD1-CG 4.32Å; L521-F582 HydrophobicContact CD1-CZ 3.52Å; L523-F582 HydrophobicContact CD1-CE1 4.03Å; L523-F582 HydrophobicContact CD1-CZ 3.54Å; L523-F582 HydrophobicContact CD2-CE2 4.43Å; L523-F582 HydrophobicContact CD2-CZ 3.86Å; L523-F582 HydrophobicContact CG-CZ 4.32Å; I578-F582 HydrophobicContact CB-CD2 4.43Å; I578-F582 HydrophobicContact CG2-CD2 3.68Å; I578-F582 HydrophobicContact CG2-CE2 4Å; I578-F582 HydrophobicContact CG2-CG 4.45Å; I578-F582 WeakPolarHBondContact O-CD2 3.36Å; I578-F582 PolarHBondContact O-N 3.01Å; I578-F582 VanDerWaalsContact O-N 3.1Å
583	V	43.3	Very low	51.3	Low	176 Å²	176	63.6 Å²	63.6	100%	1.067	36%	0.36	S	S	*	.			trans	-133.7	0	175	-179	0	0	0	0	108.8	D579	D579-V583 WeakPolarHBondContact O-CG2 3.33Å

Retrieved 583 of 583 residues in 213.1 ms (Link to these results)

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