A0A093HZE5_STRCA Loading...

non-specific serine/threonine protein kinase

AlphaFold DB , UniProt , Accession A0A093HZE5, Species STRCA (Struthio camelus australis), Gene n/a, Length 544 aa.

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Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.8	Very low	36.1	Very low	235 Å²	235	152.5 Å²	152.5	100%	1.158	85%	0.847	S	S	*	*				0	87.9	0	-62.1	178.3	-174.3	0	0	105.8
2	S	36.6	Very low	37.2	Very low	108 Å²	108	148.5 Å²	148.5	76%	0.755	83%	0.833	S	S	*	*			cis	112.7	134.7	19.3	-61.9	0	0	0	0	110
3	N	35.3	Very low	37.5	Very low	152 Å²	152	147 Å²	147	81%	0.813	83%	0.833	S	S	*	*			trans	68.8	159.3	175.6	-63.1	8.5	0	0	0	116.2
4	N	37.8	Very low	38	Very low	158 Å²	158	142.9 Å²	142.9	85%	0.845	83%	0.826	S	S	*	*			cis	-170.7	145.1	-47	-119.8	15	0	0	0	107.5
5	G	33.7	Very low	38.1	Very low	75 Å²	75	141.1 Å²	141.1	77%	0.773	82%	0.822	S	S	*	*			trans	-174.5	133	174	0	0	0	0	0	112.3
6	V	38.7	Very low	38.4	Very low	132 Å²	132	140.4 Å²	140.4	80%	0.8	82%	0.823	S	S	*	*			trans	-132.1	138.6	-177.5	-165.2	0	0	0	0	105.2
7	E	35	Very low	38.1	Very low	176 Å²	176	142.5 Å²	142.5	82%	0.822	83%	0.825	S	S	*	*				-172.9	134.2	91.2	-88.2	172.3	165.7	0	0	109.4
8	A	36.5	Very low	38	Very low	86 Å²	86	147.1 Å²	147.1	71%	0.711	83%	0.827	S	S	*	*				68.7	97.8	104.2	0	0	0	0	0	114.2
9	E	35.4	Very low	37.7	Very low	200 Å²	200	147.8 Å²	147.8	94%	0.935	83%	0.828	S	S	*	*				90.7	111.3	87.3	-86.2	-158	155.5	0	0	114.6
10	D	33.3	Very low	37.4	Very low	158 Å²	158	146.1 Å²	146.1	85%	0.845	82%	0.822	S	S	*	*				-161.1	148.6	122	-159.5	-6.2	0	0	0	110
11	K	40.2	Very low	37.2	Very low	197 Å²	197	144.8 Å²	144.8	86%	0.857	82%	0.823	S	S	*	*			trans	-158.8	160.7	174.9	-105.9	-151.1	170.9	174.9	0	112.6
12	P	48.6	Very low	37	Very low	105 Å²	105	139.6 Å²	139.6	68%	0.682	80%	0.804	S	S	*	*			trans	-107.1	178.3	-138	42.2	-40.3	0	0	0	114.7
13	P	41.8	Very low	36.8	Very low	129 Å²	129	142.6 Å²	142.6	84%	0.838	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-80.9	142.9	156	33.3	-32.5	0	0	0	112.3
14	A	43.9	Very low	36.6	Very low	89 Å²	89	143.7 Å²	143.7	74%	0.736	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-95.6	160.7	177.6	0	0	0	0	0	112.3
15	P	39.4	Very low	36.2	Very low	117 Å²	117	139.1 Å²	139.1	76%	0.76	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-71.6	145.3	178.4	29.5	-35.7	0	0	0	112.8
16	P	43.6	Very low	35.9	Very low	129 Å²	129	141.8 Å²	141.8	84%	0.838	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-74.7	142	179.1	30.5	-34.8	0	0	0	112.5
17	M	32.8	Very low	35.4	Very low	176 Å²	176	138.9 Å²	138.9	87%	0.867	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-85.3	162.1	-179.8	-64.6	-156.3	-54.1	0	0	114.2
18	R	36.2	Very low	35.1	Very low	226 Å²	226	136.2 Å²	136.2	85%	0.853	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-81.7	130.8	174.1	-178.9	-169.7	-163.1	172.4	5.6	110.9
19	N	32.1	Very low	34.9	Very low	160 Å²	160	140.7 Å²	140.7	86%	0.856	81%	0.81	S	S	*	*			trans	-108.6	143.8	169.1	-82.4	-4.7	0	0	0	111.9
20	T	32.7	Very low	34.6	Very low	113 Å²	113	137.1 Å²	137.1	69%	0.693	80%	0.798	S	S	*	*			trans	-132.4	133	178.3	49.8	0	0	0	0	111
21	S	32.8	Very low	34.3	Very low	120 Å²	120	134.9 Å²	134.9	84%	0.839	80%	0.801	S	S	*	*			trans	171.3	170.1	158.4	-90.5	0	0	0	0	110.8
22	T	31.5	Very low	33.8	Very low	126 Å²	126	129.5 Å²	129.5	77%	0.773	80%	0.801	S	S	*	*			cis	-166.9	155.6	-35.2	-80.9	0	0	0	0	106.4
23	M	32	Very low	33	Very low	170 Å²	170	131 Å²	131	84%	0.837	81%	0.809	S	S	*	*			trans	-58	154.4	-175.4	-60.2	-109.7	-90.7	0	0	116
24	I	31.6	Very low	32.5	Very low	175 Å²	175	133.1 Å²	133.1	90%	0.897	81%	0.812	S	S	*	*				164.2	143.8	122.1	-85.5	160	0	0	0	113.1
25	G	27.8	Very low	31.9	Very low	62 Å²	62	135.7 Å²	135.7	64%	0.639	81%	0.814	S	S	*	*			trans	98	121.4	160.6	0	0	0	0	0	115.3
26	S	29.1	Very low	31.7	Very low	131 Å²	131	139.3 Å²	139.3	92%	0.916	82%	0.82	S	S	*	*			cis	87.2	106	35.3	81.8	0	0	0	0	115
27	G	27.6	Very low	31	Very low	72 Å²	72	136.2 Å²	136.2	74%	0.742	81%	0.811	S	S	*	*			trans	175.2	165.4	176.8	0	0	0	0	0	111.7
28	S	29.1	Very low	31.1	Very low	120 Å²	120	133.9 Å²	133.9	84%	0.839	81%	0.813	S	S	*	*			trans	-148.2	150.2	-173.2	-63.1	0	0	0	0	115
29	K	31.1	Very low	31.2	Very low	179 Å²	179	132.8 Å²	132.8	78%	0.778	81%	0.814	S	S	*	*			trans	75.5	130.1	150.6	-83.5	-174	154.9	-130.6	0	122.7
30	D	28.9	Very low	31.5	Very low	126 Å²	126	131.1 Å²	131.1	67%	0.674	81%	0.812	S	S	*	*			trans	74.1	122	133.4	-55.6	-21.5	0	0	0	122.5
31	A	28.7	Very low	31.5	Very low	111 Å²	111	133.6 Å²	133.6	92%	0.917	82%	0.82	S	S	*	*			trans	66	119.7	146.2	0	0	0	0	0	122.4
32	G	29.1	Very low	31.9	Very low	83 Å²	83	133.4 Å²	133.4	86%	0.856	82%	0.816	S	S	*	*			trans	170.5	131.9	161.6	0	0	0	0	0	112.9
33	T	30.5	Very low	32.4	Very low	136 Å²	136	133.3 Å²	133.3	83%	0.834	82%	0.818	S	S	*	*			trans	-106.9	144.4	-176.4	48.3	0	0	0	0	113.3
34	L	32.4	Very low	32.5	Very low	174 Å²	174	132.3 Å²	132.3	91%	0.911	82%	0.816	S	S	*	*			trans	-175.2	163.2	131.9	-100	162.6	0	0	0	111.9
35	N	30.7	Very low	32.9	Very low	143 Å²	143	129.4 Å²	129.4	77%	0.765	81%	0.808	S	S	*	*			trans	-96.4	156.3	-167.4	-74.1	-44.5	0	0	0	114.4
36	H	34.7	Very low	33.2	Very low	193 Å²	193	135.6 Å²	135.6	89%	0.894	82%	0.821	S	S	*	*				-164.3	169.3	112.4	-105.7	-77	0	0	0	111.8
37	G	30.1	Very low	33.5	Very low	64 Å²	64	136.8 Å²	136.8	66%	0.66	81%	0.812	S	S	*	*			trans	-64.8	170.2	-163.3	0	0	0	0	0	117
38	S	35.3	Very low	33.9	Very low	128 Å²	128	143.3 Å²	143.3	90%	0.895	82%	0.82	S	S	*	*			cis	-149.1	171.2	40.5	-62	0	0	0	0	114.8
39	K	37.8	Very low	34	Very low	202 Å²	202	145.8 Å²	145.8	88%	0.878	82%	0.815	S	S	*	*			trans	-77.6	144.2	-169.5	-65.7	176.5	178.4	176.5	0	114.5
40	P	37.7	Very low	34.1	Very low	126 Å²	126	146.6 Å²	146.6	82%	0.818	82%	0.819	S	S	*	*			trans	-82.8	176.4	168.1	35.5	-35.8	0	0	0	113.5
41	L	32.6	Very low	34.2	Very low	165 Å²	165	151.4 Å²	151.4	86%	0.864	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-71.6	155.4	-176.3	-69.3	160.9	0	0	0	114.1
42	P	42.5	Very low	34.6	Very low	115 Å²	115	153.2 Å²	153.2	75%	0.747	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-79.6	149.7	176.9	33	-35.3	0	0	0	113.3
43	P	41.5	Very low	34.8	Very low	125 Å²	125	159.4 Å²	159.4	81%	0.812	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-85.1	168.5	179.6	34.9	-36.4	0	0	0	114.4
44	N	33.2	Very low	35	Very low	149 Å²	149	161.9 Å²	161.9	80%	0.797	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-68	140.9	180	-165.1	48.9	0	0	0	112.6
45	P	41.5	Very low	35.3	Very low	114 Å²	114	163.7 Å²	163.7	74%	0.74	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-82.6	131.2	179.8	31.3	-34	0	0	0	113.6
46	E	33.5	Very low	35.4	Very low	192 Å²	192	167.4 Å²	167.4	90%	0.897	82%	0.818	S	S	*	*			trans	-85	175.9	175.5	-68.9	-171.2	136.8	0	0	114.4
47	E	34.9	Very low	35.2	Very low	155 Å²	155	162.4 Å²	162.4	72%	0.724	81%	0.805	S	S	*	*			trans	-52.8	155	-175.1	-51.7	-173.5	150.2	0	0	116.2	K49	E47-K49 IonicContact OE2-NZ 2.78Å
48	K	35.5	Very low	35.3	Very low	210 Å²	210	166.2 Å²	166.2	91%	0.913	81%	0.809	S	S	*	*			trans	-132.2	129.5	155.7	-76.8	-175.3	177.1	171.2	0	112.1
49	K	32.8	Very low	35.3	Very low	171 Å²	171	167.4 Å²	167.4	74%	0.743	81%	0.805	S	S	*	*			trans	-95.6	162.8	-179	-77.3	173.6	174.3	158.4	0	113.1	E47	E47-K49 IonicContact OE2-NZ 2.78Å
50	K	32.1	Very low	35.4	Very low	197 Å²	197	163.4 Å²	163.4	86%	0.857	80%	0.799	S	S	*	*			trans	78.6	150.6	172.1	-54.7	170.9	-179.8	172.3	0	113
51	R	31.6	Very low	35	Very low	226 Å²	226	161.3 Å²	161.3	85%	0.853	80%	0.801	S	S	*	*			cis	-159.8	152	23.5	-154	171.1	-168.9	164.4	0.1	112.1
52	D	35.8	Very low	34.9	Very low	150 Å²	150	159.8 Å²	159.8	80%	0.802	79%	0.793	S	S	*	*			trans	-67.1	148.3	172.8	-51.9	-89	0	0	0	114.2
53	R	34.5	Very low	34.6	Very low	213 Å²	213	162.2 Å²	162.2	80%	0.804	79%	0.792	S	S	*	*				-161	144.9	128.3	-128.2	177.2	-63	179.6	5.1	114.1
54	F	35.3	Very low	34.3	Very low	187 Å²	187	162.6 Å²	162.6	82%	0.82	79%	0.792	S	S	*	*			trans	-92.9	139.4	177.1	-137.5	-98	0	0	0	110.6
55	Y	37.1	Very low	34.2	Very low	212 Å²	212	161.6 Å²	161.6	83%	0.831	79%	0.787	S	S	*	*			trans	-150.2	166	159.1	-86.9	-64.2	0	0	0	110.9
56	R	33	Very low	34	Very low	221 Å²	221	165.3 Å²	165.3	83%	0.834	79%	0.791	S	S	*	*			trans	-133.2	122.6	-148.6	-156.3	-165.6	-173.7	173	1.5	113.6
57	S	30.1	Very low	34.1	Very low	89 Å²	89	165.3 Å²	165.3	62%	0.622	79%	0.788	S	S	*	*			trans	61	143.1	141.2	67.2	0	0	0	0	124.2
58	I	33.9	Very low	34.4	Very low	144 Å²	144	167.8 Å²	167.8	74%	0.738	80%	0.797	S	S	*	*			trans	105.9	101.1	138.3	-79.5	155.2	0	0	0	121.8
59	L	34.1	Very low	35	Very low	153 Å²	153	165.5 Å²	165.5	80%	0.801	79%	0.789	S	S	*	*			trans	67.3	173.3	138	-53.5	179.5	0	0	0	120.6
60	P	40	Very low	35.9	Very low	118 Å²	118	167.2 Å²	167.2	77%	0.766	80%	0.797	S	S	*	*				-139	166.1	-74.3	42.4	-26.1	0	0	0	117.2
61	G	29.1	Very low	37	Very low	82 Å²	82	166.6 Å²	166.6	85%	0.845	80%	0.797	S	S	*	*			trans	89	159	166.7	0	0	0	0	0	115.8
62	D	30.9	Very low	38.1	Very low	132 Å²	132	166.7 Å²	166.7	71%	0.706	80%	0.797	S	S	*	*			cis	-143.3	179.4	-13.6	-166	10.2	0	0	0	109.5
63	K	36.4	Very low	38.9	Very low	166 Å²	166	165.2 Å²	165.2	72%	0.722	80%	0.796	S	S	*	*			trans	-69.3	152.1	-163.7	-43.7	119.5	-168.6	126.9	0	115.7
64	T	34.1	Very low	40.1	Very low	133 Å²	133	164.2 Å²	164.2	82%	0.816	80%	0.8	S	S	*	*				-167.3	137.6	121.5	12.9	0	0	0	0	116.2
65	N	32.9	Very low	40.8	Very low	129 Å²	129	163 Å²	163	69%	0.69	80%	0.801	S	S	*	*			trans	34.4	116.8	152.8	-82.9	-47.7	0	0	0	124.6
66	K	36	Very low	42.2	Very low	191 Å²	191	157.3 Å²	157.3	83%	0.83	79%	0.792	S	S	*	*				52.7	103.6	125.5	-64.7	177.6	-179.7	177.5	0	120.3
67	K	36.6	Very low	43.3	Very low	192 Å²	192	154.4 Å²	154.4	84%	0.835	79%	0.792	S	S	*	*				-148.5	124.3	107.7	-121.5	-179.3	-178.9	-175.3	0	109.2
68	K	41.4	Very low	44.4	Very low	207 Å²	207	155.4 Å²	155.4	90%	0.9	80%	0.797	S	S	*	*			trans	-104.5	92.6	174.2	-153.5	-180	-169.2	-174.3	0	107.3
69	E	46.4	Very low	45.4	Very low	162 Å²	162	153.5 Å²	153.5	76%	0.757	80%	0.796	S	S	*	*			trans	-64.5	143.2	169.4	-63.2	-163.7	134	0	0	108.7	E71	E69-E71 PolarHBondContact O-N 3.49Å
70	K	51.8	Low	46	Very low	207 Å²	207	154.1 Å²	154.1	90%	0.9	80%	0.8	S	S	*	*			trans	-83.2	98	172.3	-72	-175.5	178.1	-177.8	0	107	R72	K70-R72 PolarHBondContact O-N 3.14Å
71	E	55.3	Low	46	Very low	184 Å²	184	155.5 Å²	155.5	86%	0.86	79%	0.794	S	S	*	*			trans	-49.4	133.6	162.5	-70.5	170.3	140.3	0	0	108.5	E69	E69-E71 PolarHBondContact O-N 3.49Å
72	R	54.6	Low	46.6	Very low	228 Å²	228	158.6 Å²	158.6	86%	0.86	79%	0.787	S	S	*	*			trans	-66	139.4	170.8	-67.4	177.9	176	-178.6	-2.2	106.8	K70 E74	K70-R72 PolarHBondContact O-N 3.14Å; R72-E74 PolarHBondContact O-N 2.98Å
73	P	54.4	Low	47.5	Very low	119 Å²	119	159.3 Å²	159.3	77%	0.773	79%	0.786	S	S	*	*			trans	-61.6	110.8	175.6	25.7	-33	0	0	0	108.9	I75	P73-I75 PolarHBondContact O-N 3.1Å; P73-I75 VanDerWaalsContact O-N 3.07Å
74	E	57.7	Low	48.1	Very low	192 Å²	192	155.8 Å²	155.8	90%	0.897	78%	0.778	S	S	*	*			trans	-68.4	105	170.4	-66.3	-165.5	148.5	0	0	107.9	R72 S76	R72-E74 PolarHBondContact O-N 2.98Å; E74-S76 PolarHBondContact O-N 3.1Å; E74-S76 VanDerWaalsContact O-N 3.09Å
75	I	50.9	Low	49.4	Very low	163 Å²	163	152.7 Å²	152.7	84%	0.836	76%	0.756	S	S	*	*			trans	-71.1	105.1	172.6	-57.5	175.4	0	0	0	106.2	P73	P73-I75 PolarHBondContact O-N 3.1Å; P73-I75 VanDerWaalsContact O-N 3.07Å
76	S	67.4	Low	51.1	Low	92 Å²	92	153.9 Å²	153.9	64%	0.643	76%	0.757	S	S	*	*			trans	-55.3	147.1	173.8	54.9	0	0	0	0	110.8	E74	E74-S76 PolarHBondContact O-N 3.1Å; E74-S76 VanDerWaalsContact O-N 3.09Å
77	L	56	Low	53.2	Low	159 Å²	159	146 Å²	146	83%	0.832	73%	0.725	S	S	*	*			trans	-52.4	142.5	168.5	-66.5	173.3	0	0	0	110	S79	L77-S79 PolarHBondContact O-N 3.32Å
78	P	52	Low	55.1	Low	111 Å²	111	138.2 Å²	138.2	72%	0.721	70%	0.699	S	S	*	*			trans	-58.1	109	-175.9	-27.1	36	0	0	0	113.4
79	S	55.1	Low	57.1	Low	103 Å²	103	130.7 Å²	130.7	72%	0.72	67%	0.666	S	S	*	*	S	Bend	trans	-78.6	147.8	162.3	55.5	0	0	0	0	110.2	L77	L77-S79 PolarHBondContact O-N 3.32Å
80	D	47.7	Very low	58.8	Low	166 Å²	166	125.4 Å²	125.4	89%	0.888	64%	0.643	S	S	*	*	S	Bend	trans	56.9	55.7	-172	-68.2	-21.4	0	0	0	113.5	E82	D80-E82 PolarHBondContact O-N 3.12Å
81	F	39.5	Very low	60	Low	148 Å²	148	118.9 Å²	118.9	65%	0.649	63%	0.628	S	S	*	*			trans	-71.6	109.5	166.5	-179.7	-96.3	0	0	0	110.9	H83	F81-H83 AromaticContact CE1-CD2 3.72Å; F81-H83 AromaticContact CE1-CE1 3.72Å; F81-H83 AromaticContact CE1-CG 3.7Å; F81-H83 AromaticContact CE1-ND1 3.71Å; F81-H83 AromaticContact CE1-NE2 3.73Å; F81-H83 AromaticContact CZ-CD2 3.6Å; F81-H83 AromaticContact CZ-NE2 3.56Å
82	E	42.5	Very low	61.1	Low	146 Å²	146	116 Å²	116	68%	0.682	62%	0.622	S	S	*	*			trans	-108.4	121.8	175.7	-170.8	163.4	-131.8	0	0	110.3	D80 T84	D80-E82 PolarHBondContact O-N 3.12Å; E82-T84 VanDerWaalsContact C-N 3.35Å; E82-T84 HydrophobicContact CG-CG2 4.24Å; E82-T84 PolarHBondContact O-N 3.11Å
83	H	47.9	Very low	62.2	Low	148 Å²	148	109.5 Å²	109.5	69%	0.685	61%	0.608	S	S	*	*			trans	-77.9	81.5	175.1	-102.3	150	0	0	0	110.2	F81 I85	F81-H83 AromaticContact CE1-CD2 3.72Å; F81-H83 AromaticContact CE1-CE1 3.72Å; F81-H83 AromaticContact CE1-CG 3.7Å; F81-H83 AromaticContact CE1-ND1 3.71Å; F81-H83 AromaticContact CE1-NE2 3.73Å; F81-H83 AromaticContact CZ-CD2 3.6Å; F81-H83 AromaticContact CZ-NE2 3.56Å; H83-I85 PolarHBondContact O-N 3.34Å
84	T	50.2	Low	63.2	Low	91 Å²	91	104.2 Å²	104.2	56%	0.558	58%	0.575	S	S	*	*			trans	-74.7	85.6	172	50.3	0	0	0	0	111	E82 H86	E82-T84 VanDerWaalsContact C-N 3.35Å; E82-T84 HydrophobicContact CG-CG2 4.24Å; E82-T84 PolarHBondContact O-N 3.11Å; T84-H86 PolarHBondContact O-CD2 3.2Å; T84-H86 PolarHBondContact O-N 2.89Å
85	I	61.7	Low	64.3	Low	68 Å²	68	99.6 Å²	99.6	35%	0.349	55%	0.554	S	S	.	*			trans	-77.2	102	174.6	-56	172.9	0	0	0	108.9	H83 V87 P100 W103	H83-I85 PolarHBondContact O-N 3.34Å; I85-V87 HydrophobicContact CG2-CG2 3.67Å; I85-V87 PolarHBondContact O-N 2.83Å; I85-P100 HydrophobicContact CD1-CG 4.06Å; I85-P100 HydrophobicContact CG2-CG 3.44Å; I85-P100 VanDerWaalsContact CG2-CG 3.44Å; I85-W103 HydrophobicContact CD1-CZ2 4.11Å
86	H	67.5	Low	65.9	Low	155 Å²	155	93.2 Å²	93.2	72%	0.718	52%	0.52	S	S	*	.			trans	-84.2	88.3	175.3	-66	-71.1	0	0	0	111	T84	T84-H86 PolarHBondContact O-CD2 3.2Å; T84-H86 PolarHBondContact O-N 2.89Å
87	V	80.5	Confident	66.6	Low	25 Å²	25	92.6 Å²	92.6	15%	0.152	51%	0.512	C	S	.	.			trans	-89.8	123.4	167.6	-167.5	0	0	0	0	109.4	I85 F96 T97 M99 W103 L125	I85-V87 HydrophobicContact CG2-CG2 3.67Å; I85-V87 PolarHBondContact O-N 2.83Å; V87-F96 HydrophobicContact CG1-CB 4.12Å; V87-F96 HydrophobicContact CG1-CD1 4.11Å; V87-T97 CarbonylContact C-O 3.5Å; V87-T97 WeakPolarHBondContact CA-O 3.33Å; V87-M99 HydrophobicContact CG1-CB 3.94Å; V87-M99 HydrophobicContact CG1-CE 4.02Å; V87-M99 HydrophobicContact CG1-CG 4.49Å; V87-W103 HydrophobicContact CB-CZ3 4.37Å; V87-W103 HydrophobicContact CG2-CE3 3.83Å; V87-W103 HydrophobicContact CG2-CH2 4.27Å; V87-W103 HydrophobicContact CG2-CZ3 3.53Å; V87-L125 HydrophobicContact CB-CD2 3.86Å; V87-L125 HydrophobicContact CG1-CD2 3.64Å
88	G	76.9	Confident	67.8	Low	28 Å²	28	87.8 Å²	87.8	29%	0.289	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	158.9	170.1	0	0	0	0	0	111.2	F96 T97	G88-F96 CarbonylContact O-C 3.5Å; G88-F96 VanDerWaalsContact O-CA 3.28Å; G88-F96 WeakPolarHBondContact O-CA 3.37Å; G88-T97 PolarHBondContact N-O 3.17Å; G88-T97 PolarHBondContact O-N 3.34Å
89	F	83.7	Confident	69.3	Low	49 Å²	49	84.2 Å²	84.2	22%	0.215	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	122.5	164.6	-179	-102.5	0	0	0	108.8	G94 F96 K118 P121	F89-G94 WeakPolarHBondContact CE2-O 3.45Å; F89-F96 HydrophobicContact CB-CD1 3.98Å; F89-F96 HydrophobicContact CB-CE1 3.89Å; F89-F96 AromaticContact CD2-CD1 3.79Å; F89-F96 HydrophobicContact CD2-CD1 3.79Å; F89-F96 HydrophobicContact CD2-CD2 4.31Å; F89-F96 AromaticContact CD2-CE1 3.6Å; F89-F96 HydrophobicContact CD2-CE1 3.6Å; F89-F96 HydrophobicContact CD2-CE2 4.15Å; F89-F96 HydrophobicContact CD2-CG 4.14Å; F89-F96 AromaticContact CD2-CZ 3.79Å; F89-F96 HydrophobicContact CD2-CZ 3.79Å; F89-F96 HydrophobicContact CE2-CE2 4.46Å; F89-F96 HydrophobicContact CE2-CZ 4.37Å; F89-F96 HydrophobicContact CG-CD1 4.39Å; F89-F96 HydrophobicContact CG-CE1 4.14Å; F89-K118 HydrophobicContact CZ-CB 4.05Å; F89-K118 HydrophobicContact CZ-CG 4.03Å; F89-P121 HydrophobicContact CB-CB 3.88Å; F89-P121 HydrophobicContact CD1-CB 3.63Å; F89-P121 HydrophobicContact CD1-CG 3.75Å; F89-P121 HydrophobicContact CD2-CB 3.78Å; F89-P121 HydrophobicContact CE1-CB 4.08Å; F89-P121 HydrophobicContact CE1-CG 4.06Å; F89-P121 HydrophobicContact CE2-CB 4.23Å; F89-P121 HydrophobicContact CG-CB 3.46Å; F89-P121 VanDerWaalsContact CG-CB 3.46Å; F89-P121 HydrophobicContact CG-CG 4.12Å; F89-P121 HydrophobicContact CZ-CB 4.37Å
90	D	82.6	Confident	70.7	Confident	51 Å²	51	80.9 Å²	80.9	27%	0.273	45%	0.452	S	S	.	.			trans	-86.9	113.1	172.7	173.1	21	0	0	0	109.8	V92 T93 G94 E95 T97	D90-V92 PolarHBondContact O-N 2.91Å; D90-V92 WeakPolarHBondContact OD1-CB 3.34Å; D90-V92 PolarHBondContact OD1-N 2.95Å; D90-T93 WeakPolarHBondContact CB-OG1 3.43Å; D90-T93 VanDerWaalsContact CG-OG1 3.28Å; D90-T93 VanDerWaalsContact OD2-CB 3.29Å; D90-T93 WeakPolarHBondContact OD2-CB 3.33Å; D90-T93 WeakPolarHBondContact OD2-CG2 3.26Å; D90-T93 PolarHBondContact OD2-N 3.11Å; D90-T93 VanDerWaalsContact OD2-N 3.09Å; D90-T93 PolarHBondContact OD2-OG1 3.21Å; D90-G94 WeakPolarHBondContact O-CA 3.34Å; D90-G94 PolarHBondContact O-N 2.88Å; D90-E95 PolarHBondContact N-O 2.86Å; D90-T97 HydrophobicContact CB-CG2 4.46Å
91	A	76.4	Confident	72.3	Confident	70 Å²	70	79 Å²	79	58%	0.579	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-24	179.1	0	0	0	0	0	113.5	K118	A91-K118 WeakPolarHBondContact O-CE 3.47Å; A91-K118 PolarHBondContact O-NZ 2.6Å
92	V	77.3	Confident	74.3	Confident	124 Å²	124	78.2 Å²	78.2	75%	0.752	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-67.5	180	-174.5	0	0	0	0	109.5	D90 G94 K118	D90-V92 PolarHBondContact O-N 2.91Å; D90-V92 WeakPolarHBondContact OD1-CB 3.34Å; D90-V92 PolarHBondContact OD1-N 2.95Å; V92-G94 VanDerWaalsContact C-N 3.27Å; V92-G94 PolarHBondContact O-N 3.46Å; V92-K118 PolarHBondContact O-NZ 2.82Å
93	T	78.6	Confident	76.3	Confident	91 Å²	91	71.9 Å²	71.9	56%	0.558	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-28.5	178	57.5	0	0	0	0	113	D90 E95	D90-T93 WeakPolarHBondContact CB-OG1 3.43Å; D90-T93 VanDerWaalsContact CG-OG1 3.28Å; D90-T93 VanDerWaalsContact OD2-CB 3.29Å; D90-T93 WeakPolarHBondContact OD2-CB 3.33Å; D90-T93 WeakPolarHBondContact OD2-CG2 3.26Å; D90-T93 PolarHBondContact OD2-N 3.11Å; D90-T93 VanDerWaalsContact OD2-N 3.09Å; D90-T93 PolarHBondContact OD2-OG1 3.21Å; T93-E95 PolarHBondContact OG1-N 3.48Å
94	G	74.8	Confident	78.1	Confident	8 Å²	8	66.3 Å²	66.3	8%	0.082	39%	0.385	C	S	.	.			trans	78.4	19.4	-172.6	0	0	0	0	0	113.7	F89 D90 V92	F89-G94 WeakPolarHBondContact CE2-O 3.45Å; D90-G94 WeakPolarHBondContact O-CA 3.34Å; D90-G94 PolarHBondContact O-N 2.88Å; V92-G94 VanDerWaalsContact C-N 3.27Å; V92-G94 PolarHBondContact O-N 3.46Å
95	E	80.8	Confident	79.6	Confident	96 Å²	96	68.8 Å²	68.8	45%	0.449	38%	0.384	S	S	.	.			trans	-115.2	156.2	-177.6	-54.4	-148	129	0	0	112.8	D90 T93 K114	D90-E95 PolarHBondContact N-O 2.86Å; T93-E95 PolarHBondContact OG1-N 3.48Å; E95-K114 IonicContact OE1-NZ 3.81Å; E95-K114 PolarHBondContact OE1-NZ 3.46Å
96	F	84.5	Confident	80.7	Confident	28 Å²	28	66.5 Å²	66.5	12%	0.123	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	122.8	175.8	-69.1	-80.1	0	0	0	111.3	V87 G88 F89 M99 L107 Q117 P121 V124 L125	V87-F96 HydrophobicContact CG1-CB 4.12Å; V87-F96 HydrophobicContact CG1-CD1 4.11Å; G88-F96 CarbonylContact O-C 3.5Å; G88-F96 VanDerWaalsContact O-CA 3.28Å; G88-F96 WeakPolarHBondContact O-CA 3.37Å; F89-F96 HydrophobicContact CB-CD1 3.98Å; F89-F96 HydrophobicContact CB-CE1 3.89Å; F89-F96 AromaticContact CD2-CD1 3.79Å; F89-F96 HydrophobicContact CD2-CD1 3.79Å; F89-F96 HydrophobicContact CD2-CD2 4.31Å; F89-F96 AromaticContact CD2-CE1 3.6Å; F89-F96 HydrophobicContact CD2-CE1 3.6Å; F89-F96 HydrophobicContact CD2-CE2 4.15Å; F89-F96 HydrophobicContact CD2-CG 4.14Å; F89-F96 AromaticContact CD2-CZ 3.79Å; F89-F96 HydrophobicContact CD2-CZ 3.79Å; F89-F96 HydrophobicContact CE2-CE2 4.46Å; F89-F96 HydrophobicContact CE2-CZ 4.37Å; F89-F96 HydrophobicContact CG-CD1 4.39Å; F89-F96 HydrophobicContact CG-CE1 4.14Å; F96-M99 HydrophobicContact CB-CB 4.15Å; F96-M99 HydrophobicContact CB-CE 3.54Å; F96-M99 HydrophobicContact CB-SD 4.25Å; F96-M99 HydrophobicContact CD1-CE 3.98Å; F96-M99 HydrophobicContact CD2-CE 3.69Å; F96-M99 HydrophobicContact CE2-CE 4.37Å; F96-M99 HydrophobicContact CG-CE 3.46Å; F96-M99 VanDerWaalsContact CG-CE 3.46Å; F96-L107 HydrophobicContact CD2-CD1 4.06Å; F96-L107 HydrophobicContact CE2-CD1 4.07Å; F96-Q117 HydrophobicContact CE2-CB 4.01Å; F96-Q117 HydrophobicContact CE2-CG 4.15Å; F96-P121 HydrophobicContact CE1-CB 4.23Å; F96-P121 HydrophobicContact CZ-CB 4.21Å; F96-V124 HydrophobicContact CE1-CG1 4.45Å; F96-V124 HydrophobicContact CE2-CB 4.49Å; F96-V124 HydrophobicContact CE2-CG1 3.77Å; F96-V124 HydrophobicContact CZ-CB 3.9Å; F96-V124 HydrophobicContact CZ-CG1 3.54Å; F96-L125 HydrophobicContact CD1-CD2 3.94Å; F96-L125 HydrophobicContact CD1-CG 4.41Å; F96-L125 HydrophobicContact CE1-CD1 4.27Å; F96-L125 HydrophobicContact CE1-CD2 3.81Å; F96-L125 HydrophobicContact CE1-CG 3.83Å
97	T	83.5	Confident	81.5	Confident	79 Å²	79	59.7 Å²	59.7	49%	0.485	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	144.7	177.1	54.1	0	0	0	0	110.5	V87 G88 D90 M99	V87-T97 CarbonylContact C-O 3.5Å; V87-T97 WeakPolarHBondContact CA-O 3.33Å; G88-T97 PolarHBondContact N-O 3.17Å; G88-T97 PolarHBondContact O-N 3.34Å; D90-T97 HydrophobicContact CB-CG2 4.46Å; T97-M99 PolarHBondContact O-N 2.88Å
98	G	80.3	Confident	81.6	Confident	59 Å²	59	65.8 Å²	65.8	61%	0.608	37%	0.369	S	S	*	.	S	Bend	trans	70	6.8	-177.6	0	0	0	0	0	115.4
99	M	83.8	Confident	81.9	Confident	35 Å²	35	68.6 Å²	68.6	17%	0.172	38%	0.38	C	S	.	.			trans	-65.1	128.7	-179.5	-175.5	168	-78.4	0	0	111.8	V87 F96 T97 W103 A104 L107 L128	V87-M99 HydrophobicContact CG1-CB 3.94Å; V87-M99 HydrophobicContact CG1-CE 4.02Å; V87-M99 HydrophobicContact CG1-CG 4.49Å; F96-M99 HydrophobicContact CB-CB 4.15Å; F96-M99 HydrophobicContact CB-CE 3.54Å; F96-M99 HydrophobicContact CB-SD 4.25Å; F96-M99 HydrophobicContact CD1-CE 3.98Å; F96-M99 HydrophobicContact CD2-CE 3.69Å; F96-M99 HydrophobicContact CE2-CE 4.37Å; F96-M99 HydrophobicContact CG-CE 3.46Å; F96-M99 VanDerWaalsContact CG-CE 3.46Å; T97-M99 PolarHBondContact O-N 2.88Å; M99-W103 HydrophobicContact CG-CB 3.65Å; M99-W103 HydrophobicContact SD-CB 3.99Å; M99-A104 HydrophobicContact CG-CB 4.45Å; M99-A104 HydrophobicContact SD-CB 4.2Å; M99-L107 HydrophobicContact CE-CD1 3.84Å; M99-L107 HydrophobicContact SD-CD1 3.86Å; M99-L128 HydrophobicContact CE-CD1 3.51Å; M99-L128 HydrophobicContact SD-CD1 4.42Å
100	P	83.4	Confident	81.8	Confident	34 Å²	34	66.3 Å²	66.3	22%	0.221	37%	0.37	C	S	.	.			trans	-59.9	144.1	172	-22.3	31.7	0	0	0	111.8	I85 Q102 W103 A104	I85-P100 HydrophobicContact CD1-CG 4.06Å; I85-P100 HydrophobicContact CG2-CG 3.44Å; I85-P100 VanDerWaalsContact CG2-CG 3.44Å; P100-Q102 PolarHBondContact O-N 3.21Å; P100-Q102 VanDerWaalsContact O-N 3.1Å; P100-W103 HydrophobicContact CB-CG 4.24Å; P100-W103 HydrophobicContact CG-CD2 4.13Å; P100-W103 HydrophobicContact CG-CG 4.09Å; P100-W103 WeakPolarHBondContact O-CA 3.46Å; P100-W103 WeakPolarHBondContact O-CB 3.36Å; P100-W103 PolarHBondContact O-N 2.87Å; P100-A104 PolarHBondContact O-N 3.04Å
101	E	82.4	Confident	81.9	Confident	126 Å²	126	69 Å²	69	59%	0.589	39%	0.385	S	S	*	.	H	α-helix	trans	-54.9	-35.2	177.3	-161.9	-163.6	179.7	0	0	112.4	W103 A104 R105	E101-W103 VanDerWaalsContact C-N 3.31Å; E101-W103 PolarHBondContact O-N 3.46Å; E101-A104 PolarHBondContact O-N 3.38Å; E101-R105 VanDerWaalsContact CD-NH2 3.26Å; E101-R105 WeakPolarHBondContact O-CB 3.31Å; E101-R105 VanDerWaalsContact O-CG 3.28Å; E101-R105 WeakPolarHBondContact O-CG 3.28Å; E101-R105 PolarHBondContact O-N 3.14Å; E101-R105 IonicContact OE1-CZ 2.63Å; E101-R105 VanDerWaalsContact OE1-CZ 3.28Å; E101-R105 IonicContact OE1-NE 2.68Å; E101-R105 PolarHBondContact OE1-NE 2.89Å; E101-R105 VanDerWaalsContact OE1-NE 3.13Å; E101-R105 IonicContact OE1-NH2 2.68Å; E101-R105 PolarHBondContact OE1-NH2 2.91Å; E101-R105 IonicContact OE2-CZ 3.92Å; E101-R105 IonicContact OE2-NH2 3.85Å; E101-R105 PolarHBondContact OE2-NH2 3.06Å
102	Q	81.5	Confident	82.4	Confident	132 Å²	132	66 Å²	66	62%	0.617	36%	0.359	S	S	*	.	H	α-helix	trans	-63	-34	175.6	-61.9	-175.1	3.6	0	0	113.1	P100 L106	P100-Q102 PolarHBondContact O-N 3.21Å; P100-Q102 VanDerWaalsContact O-N 3.1Å; Q102-L106 VanDerWaalsContact O-CG 3.28Å; Q102-L106 WeakPolarHBondContact O-CG 3.44Å; Q102-L106 PolarHBondContact O-N 3.13Å
103	W	84.6	Confident	82.9	Confident	12 Å²	12	63.6 Å²	63.6	5%	0.045	34%	0.344	C	S	.	.	H	α-helix	trans	-79.3	-38.6	177.5	-68	22.1	0	0	0	110.9	I85 V87 M99 P100 E101 R105 L106 L107 L125 L128 E129 N132	I85-W103 HydrophobicContact CD1-CZ2 4.11Å; V87-W103 HydrophobicContact CB-CZ3 4.37Å; V87-W103 HydrophobicContact CG2-CE3 3.83Å; V87-W103 HydrophobicContact CG2-CH2 4.27Å; V87-W103 HydrophobicContact CG2-CZ3 3.53Å; M99-W103 HydrophobicContact CG-CB 3.65Å; M99-W103 HydrophobicContact SD-CB 3.99Å; P100-W103 HydrophobicContact CB-CG 4.24Å; P100-W103 HydrophobicContact CG-CD2 4.13Å; P100-W103 HydrophobicContact CG-CG 4.09Å; P100-W103 WeakPolarHBondContact O-CA 3.46Å; P100-W103 WeakPolarHBondContact O-CB 3.36Å; P100-W103 PolarHBondContact O-N 2.87Å; E101-W103 VanDerWaalsContact C-N 3.31Å; E101-W103 PolarHBondContact O-N 3.46Å; W103-R105 PolarHBondContact O-N 3.07Å; W103-L106 WeakPolarHBondContact O-CB 3.45Å; W103-L106 PolarHBondContact O-N 3.08Å; W103-L106 VanDerWaalsContact O-N 3.15Å; W103-L107 PolarHBondContact O-N 3.24Å; W103-L125 HydrophobicContact CZ3-CD2 4.45Å; W103-L128 HydrophobicContact CB-CD2 4.29Å; W103-L128 HydrophobicContact CD2-CB 4.17Å; W103-L128 HydrophobicContact CE3-CB 3.86Å; W103-L128 HydrophobicContact CE3-CD1 4.25Å; W103-L128 HydrophobicContact CZ3-CB 4.32Å; W103-E129 HydrophobicContact CH2-CB 4.06Å; W103-E129 HydrophobicContact CH2-CG 3.88Å; W103-E129 HydrophobicContact CZ2-CB 4.45Å; W103-E129 HydrophobicContact CZ2-CG 4.1Å; W103-N132 HydrophobicContact CZ2-CB 4.36Å; W103-N132 PolarHBondContact NE1-ND2 3.33Å
104	A	84.4	Confident	83.2	Confident	31 Å²	31	65.6 Å²	65.6	26%	0.256	35%	0.345	S	S	.	.	H	α-helix	trans	-60.6	-44.6	174.1	0	0	0	0	0	111.7	M99 P100 E101 L106 L107 Q108	M99-A104 HydrophobicContact CG-CB 4.45Å; M99-A104 HydrophobicContact SD-CB 4.2Å; P100-A104 PolarHBondContact O-N 3.04Å; E101-A104 PolarHBondContact O-N 3.38Å; A104-L106 VanDerWaalsContact C-N 3.32Å; A104-L106 PolarHBondContact O-N 3.16Å; A104-L107 PolarHBondContact O-N 3.34Å; A104-Q108 VanDerWaalsContact O-CG 3.27Å; A104-Q108 WeakPolarHBondContact O-CG 3.36Å; A104-Q108 PolarHBondContact O-N 2.87Å
105	R	83.6	Confident	83.8	Confident	143 Å²	143	69.6 Å²	69.6	54%	0.54	37%	0.372	S	S	.	.	H	α-helix	trans	-63.7	-34.4	173.6	-68.3	175.4	-174.2	-163.5	6.8	112.6	E101 W103 T109	E101-R105 VanDerWaalsContact CD-NH2 3.26Å; E101-R105 WeakPolarHBondContact O-CB 3.31Å; E101-R105 VanDerWaalsContact O-CG 3.28Å; E101-R105 WeakPolarHBondContact O-CG 3.28Å; E101-R105 PolarHBondContact O-N 3.14Å; E101-R105 IonicContact OE1-CZ 2.63Å; E101-R105 VanDerWaalsContact OE1-CZ 3.28Å; E101-R105 IonicContact OE1-NE 2.68Å; E101-R105 PolarHBondContact OE1-NE 2.89Å; E101-R105 VanDerWaalsContact OE1-NE 3.13Å; E101-R105 IonicContact OE1-NH2 2.68Å; E101-R105 PolarHBondContact OE1-NH2 2.91Å; E101-R105 IonicContact OE2-CZ 3.92Å; E101-R105 IonicContact OE2-NH2 3.85Å; E101-R105 PolarHBondContact OE2-NH2 3.06Å; W103-R105 PolarHBondContact O-N 3.07Å; R105-T109 PolarHBondContact O-N 2.91Å; R105-T109 PolarHBondContact O-OG1 3.37Å
106	L	83.1	Confident	84.2	Confident	20 Å²	20	66.9 Å²	66.9	11%	0.105	36%	0.359	C	S	.	.	H	α-helix	trans	-67.2	-43.5	174	-79.2	170	0	0	0	111.9	Q102 W103 A104 Q108 T109 S110 L128 Y131 L469	Q102-L106 VanDerWaalsContact O-CG 3.28Å; Q102-L106 WeakPolarHBondContact O-CG 3.44Å; Q102-L106 PolarHBondContact O-N 3.13Å; W103-L106 WeakPolarHBondContact O-CB 3.45Å; W103-L106 PolarHBondContact O-N 3.08Å; W103-L106 VanDerWaalsContact O-N 3.15Å; A104-L106 VanDerWaalsContact C-N 3.32Å; A104-L106 PolarHBondContact O-N 3.16Å; L106-Q108 PolarHBondContact O-N 3.2Å; L106-T109 CarbonylContact O-C 3.33Å; L106-T109 PolarHBondContact O-N 3.02Å; L106-T109 VanDerWaalsContact O-N 3.17Å; L106-T109 PolarHBondContact O-OG1 3.07Å; L106-S110 VanDerWaalsContact O-CB 3.28Å; L106-S110 WeakPolarHBondContact O-CB 3.07Å; L106-S110 PolarHBondContact O-N 2.81Å; L106-S110 PolarHBondContact O-OG 3.4Å; L106-L128 HydrophobicContact CB-CD2 4.01Å; L106-Y131 HydrophobicContact CD1-CD1 3.87Å; L106-Y131 HydrophobicContact CD2-CD1 3.78Å; L106-Y131 HydrophobicContact CD2-CE1 3.67Å; L106-L469 HydrophobicContact CB-CD1 3.87Å; L106-L469 HydrophobicContact CD1-CD1 4.43Å; L106-L469 HydrophobicContact CD2-CD1 4.11Å; L106-L469 HydrophobicContact CG-CD1 4.36Å
107	L	84.7	Confident	84.3	Confident	13 Å²	13	66.7 Å²	66.7	7%	0.068	36%	0.359	C	S	.	.	H	α-helix	trans	-59.8	-43.1	172.9	-86.7	-177	0	0	0	113.1	F96 M99 W103 A104 T109 S110 I112 V124 L128	F96-L107 HydrophobicContact CD2-CD1 4.06Å; F96-L107 HydrophobicContact CE2-CD1 4.07Å; M99-L107 HydrophobicContact CE-CD1 3.84Å; M99-L107 HydrophobicContact SD-CD1 3.86Å; W103-L107 PolarHBondContact O-N 3.24Å; A104-L107 PolarHBondContact O-N 3.34Å; L107-T109 PolarHBondContact O-N 3.36Å; L107-S110 PolarHBondContact O-N 2.84Å; L107-S110 PolarHBondContact O-OG 2.87Å; L107-I112 HydrophobicContact CD2-CB 4.42Å; L107-I112 HydrophobicContact CD2-CD1 4.31Å; L107-V124 HydrophobicContact CD1-CG1 4.19Å; L107-V124 HydrophobicContact CD2-CG1 3.76Å; L107-V124 HydrophobicContact CG-CG1 4.45Å; L107-L128 HydrophobicContact CD1-CD1 3.98Å; L107-L128 HydrophobicContact CD2-CD1 4.19Å; L107-L128 HydrophobicContact CD2-CD2 4.35Å; L107-L128 HydrophobicContact CD2-CG 4.49Å; L107-L128 HydrophobicContact CG-CD1 3.84Å; L107-L128 HydrophobicContact CG-CD2 4.02Å; L107-L128 HydrophobicContact CG-CG 4.38Å
108	Q	83.5	Confident	84.4	Confident	153 Å²	153	67.9 Å²	67.9	72%	0.715	36%	0.357	S	S	*	.	H	α-helix	trans	-63.1	-19.8	178.1	-72.7	166.4	-5.4	0	0	113.2	A104 L106	A104-Q108 VanDerWaalsContact O-CG 3.27Å; A104-Q108 WeakPolarHBondContact O-CG 3.36Å; A104-Q108 PolarHBondContact O-N 2.87Å; L106-Q108 PolarHBondContact O-N 3.2Å
109	T	83.2	Confident	84.8	Confident	87 Å²	87	72.7 Å²	72.7	53%	0.534	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.2	5.8	-177.4	51.1	0	0	0	0	113.9	R105 L106 L107 N467	R105-T109 PolarHBondContact O-N 2.91Å; R105-T109 PolarHBondContact O-OG1 3.37Å; L106-T109 CarbonylContact O-C 3.33Å; L106-T109 PolarHBondContact O-N 3.02Å; L106-T109 VanDerWaalsContact O-N 3.17Å; L106-T109 PolarHBondContact O-OG1 3.07Å; L107-T109 PolarHBondContact O-N 3.36Å; T109-N467 PolarHBondContact O-ND2 2.64Å
110	S	80.3	Confident	85	Confident	0 Å²	0	73.2 Å²	73.2	0%	0	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.8	10.4	-179.2	72.8	0	0	0	0	114.2	L106 L107 I112 R470	L106-S110 VanDerWaalsContact O-CB 3.28Å; L106-S110 WeakPolarHBondContact O-CB 3.07Å; L106-S110 PolarHBondContact O-N 2.81Å; L106-S110 PolarHBondContact O-OG 3.4Å; L107-S110 PolarHBondContact O-N 2.84Å; L107-S110 PolarHBondContact O-OG 2.87Å; S110-I112 PolarHBondContact O-N 3.49Å; S110-R470 VanDerWaalsContact O-CB 3.3Å; S110-R470 WeakPolarHBondContact O-CB 3.49Å
111	N	85.6	Confident	85.2	Confident	109 Å²	109	73.3 Å²	73.3	58%	0.583	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.4	12.6	179.8	-59.1	-17.2	0	0	0	116.1	T113	N111-T113 PolarHBondContact O-N 3.43Å
112	I	86.5	Confident	85.4	Confident	7 Å²	7	73 Å²	73	4%	0.036	36%	0.364	C	S	.	.			trans	-81.7	110.8	177.7	-55.7	171.5	0	0	0	108.2	L107 S110 E116 Q117 V124 L469 Y473	L107-I112 HydrophobicContact CD2-CB 4.42Å; L107-I112 HydrophobicContact CD2-CD1 4.31Å; S110-I112 PolarHBondContact O-N 3.49Å; I112-E116 HydrophobicContact CG2-CB 3.88Å; I112-Q117 HydrophobicContact CG2-CG 3.99Å; I112-Q117 PolarHBondContact O-NE2 3.01Å; I112-V124 HydrophobicContact CG2-CG2 4.15Å; I112-L469 HydrophobicContact CD1-CD2 3.79Å; I112-Y473 HydrophobicContact CD1-CD1 4.48Å; I112-Y473 HydrophobicContact CD1-CD2 4.09Å; I112-Y473 HydrophobicContact CD1-CG 3.81Å; I112-Y473 HydrophobicContact CG1-CD1 4.39Å; I112-Y473 HydrophobicContact CG1-CG 4.2Å; I112-Y473 HydrophobicContact CG2-CD1 4.43Å; I112-Y473 HydrophobicContact CG2-CD2 4.26Å; I112-Y473 HydrophobicContact CG2-CE1 4.38Å; I112-Y473 HydrophobicContact CG2-CE2 4.21Å; I112-Y473 HydrophobicContact CG2-CG 4.39Å
113	T	87.6	Confident	85.6	Confident	72 Å²	72	67.2 Å²	67.2	44%	0.442	34%	0.339	S	S	.	.			trans	-67.4	157.7	-174.1	64.9	0	0	0	0	112.9	N111 S115 E116 Q117	N111-T113 PolarHBondContact O-N 3.43Å; T113-S115 PolarHBondContact O-N 2.95Å; T113-E116 WeakPolarHBondContact CB-OE2 3.47Å; T113-E116 WeakPolarHBondContact CG2-OE2 3.33Å; T113-E116 PolarHBondContact N-OE2 2.81Å; T113-E116 PolarHBondContact O-N 3.5Å; T113-E116 VanDerWaalsContact O-N 3.14Å; T113-E116 WeakPolarHBondContact OG1-CB 3.39Å; T113-E116 WeakPolarHBondContact OG1-CG 3.42Å; T113-E116 PolarHBondContact OG1-N 3.49Å; T113-E116 PolarHBondContact OG1-OE2 3.44Å; T113-Q117 WeakPolarHBondContact O-CG 3.35Å; T113-Q117 PolarHBondContact O-N 3.45Å
114	K	85.9	Confident	85.8	Confident	134 Å²	134	66.7 Å²	66.7	58%	0.583	34%	0.337	S	S	*	.	H	α-helix	trans	-58	-29.6	173.2	-76.2	-159.3	178	-169.1	0	113	E95 K118	E95-K114 IonicContact OE1-NZ 3.81Å; E95-K114 PolarHBondContact OE1-NZ 3.46Å; K114-K118 PolarHBondContact O-N 2.99Å
115	S	86.5	Confident	85.8	Confident	92 Å²	92	66.5 Å²	66.5	64%	0.643	33%	0.331	S	S	*	.	H	α-helix	trans	-67.4	-45.9	175.6	-170.1	0	0	0	0	111.6	T113 K118 K119	T113-S115 PolarHBondContact O-N 2.95Å; S115-K118 PolarHBondContact O-N 3.2Å; S115-K119 WeakPolarHBondContact O-CB 3.05Å; S115-K119 PolarHBondContact O-N 2.88Å
116	E	88.4	Confident	85.9	Confident	39 Å²	39	60.7 Å²	60.7	18%	0.182	31%	0.311	C	S	.	.	H	α-helix	trans	-63.7	-40.1	174.5	-76	166.6	120.7	0	0	112.7	I112 T113 K118 K119 N120 R470 Y473	I112-E116 HydrophobicContact CG2-CB 3.88Å; T113-E116 WeakPolarHBondContact CB-OE2 3.47Å; T113-E116 WeakPolarHBondContact CG2-OE2 3.33Å; T113-E116 PolarHBondContact N-OE2 2.81Å; T113-E116 PolarHBondContact O-N 3.5Å; T113-E116 VanDerWaalsContact O-N 3.14Å; T113-E116 WeakPolarHBondContact OG1-CB 3.39Å; T113-E116 WeakPolarHBondContact OG1-CG 3.42Å; T113-E116 PolarHBondContact OG1-N 3.49Å; T113-E116 PolarHBondContact OG1-OE2 3.44Å; E116-K118 VanDerWaalsContact C-N 3.35Å; E116-K118 PolarHBondContact O-N 2.86Å; E116-K119 PolarHBondContact O-N 2.89Å; E116-N120 PolarHBondContact O-N 3.15Å; E116-R470 VanDerWaalsContact CD-NH1 3.35Å; E116-R470 IonicContact OE1-CZ 3.5Å; E116-R470 VanDerWaalsContact OE1-CZ 3.26Å; E116-R470 IonicContact OE1-NH1 2.69Å; E116-R470 PolarHBondContact OE1-NH1 3.48Å; E116-R470 IonicContact OE1-NH2 3.32Å; E116-R470 PolarHBondContact OE1-NH2 3.12Å; E116-R470 IonicContact OE2-NH1 2.77Å; E116-R470 IonicContact OE2-NH2 3.89Å; E116-Y473 HydrophobicContact CB-CE1 4.19Å; E116-Y473 WeakPolarHBondContact CB-OH 3.37Å; E116-Y473 HydrophobicContact CG-CE1 4.33Å; E116-Y473 PolarHBondContact O-OH 2.86Å
117	Q	87.4	Confident	86	Confident	23 Å²	23	59.8 Å²	59.8	11%	0.107	31%	0.306	C	S	.	.	H	α-helix	trans	-59.1	-43.6	172.5	-68	172	41	0	0	111.8	F96 I112 T113 P121 V124	F96-Q117 HydrophobicContact CE2-CB 4.01Å; F96-Q117 HydrophobicContact CE2-CG 4.15Å; I112-Q117 HydrophobicContact CG2-CG 3.99Å; I112-Q117 PolarHBondContact O-NE2 3.01Å; T113-Q117 WeakPolarHBondContact O-CG 3.35Å; T113-Q117 PolarHBondContact O-N 3.45Å; Q117-P121 VanDerWaalsContact O-CA 3.27Å; Q117-P121 WeakPolarHBondContact O-CA 3.24Å; Q117-P121 WeakPolarHBondContact O-CB 3.35Å; Q117-P121 WeakPolarHBondContact O-CD 3.03Å; Q117-V124 HydrophobicContact CG-CG2 4.15Å
118	K	86.3	Confident	86	Confident	104 Å²	104	59.1 Å²	59.1	45%	0.452	30%	0.303	S	S	.	.	H	α-helix	trans	-72.8	-28.6	176.5	-172.4	159.6	-169.4	158.6	0	113.6	F89 A91 V92 K114 S115 E116	F89-K118 HydrophobicContact CZ-CB 4.05Å; F89-K118 HydrophobicContact CZ-CG 4.03Å; A91-K118 WeakPolarHBondContact O-CE 3.47Å; A91-K118 PolarHBondContact O-NZ 2.6Å; V92-K118 PolarHBondContact O-NZ 2.82Å; K114-K118 PolarHBondContact O-N 2.99Å; S115-K118 PolarHBondContact O-N 3.2Å; E116-K118 VanDerWaalsContact C-N 3.35Å; E116-K118 PolarHBondContact O-N 2.86Å
119	K	88.5	Confident	85.8	Confident	161 Å²	161	55.8 Å²	55.8	70%	0.7	29%	0.287	S	S	*	.	H	α-helix	trans	-73.1	-44.8	176.3	-171.6	-178.7	178.6	-175.3	0	112.3	S115 E116	S115-K119 WeakPolarHBondContact O-CB 3.05Å; S115-K119 PolarHBondContact O-N 2.88Å; E116-K119 PolarHBondContact O-N 2.89Å
120	N	87.9	Confident	85.4	Confident	46 Å²	46	51.9 Å²	51.9	25%	0.246	26%	0.263	C	S	.	.			trans	-131.8	58.9	-172.5	-60.8	-53.9	0	0	0	112.6	E116 Q122 A123 V124 Y473 T477	E116-N120 PolarHBondContact O-N 3.15Å; N120-Q122 VanDerWaalsContact C-N 3.31Å; N120-Q122 PolarHBondContact O-N 3.48Å; N120-A123 HydrophobicContact CB-CB 4.1Å; N120-A123 PolarHBondContact O-N 2.96Å; N120-A123 VanDerWaalsContact O-N 3.16Å; N120-V124 PolarHBondContact O-N 3.11Å; N120-Y473 HydrophobicContact CB-CE2 4.02Å; N120-Y473 PolarHBondContact ND2-OH 2.77Å; N120-T477 HydrophobicContact CB-CG2 3.71Å; N120-T477 WeakPolarHBondContact ND2-CG2 3.36Å
121	P	87.9	Confident	85.1	Confident	35 Å²	35	53.3 Å²	53.3	23%	0.227	27%	0.269	C	S	.	.	H	α-helix	trans	-62.5	-33.9	-171.8	23.6	-34	0	0	0	113.5	F89 F96 Q117 V124 L125	F89-P121 HydrophobicContact CB-CB 3.88Å; F89-P121 HydrophobicContact CD1-CB 3.63Å; F89-P121 HydrophobicContact CD1-CG 3.75Å; F89-P121 HydrophobicContact CD2-CB 3.78Å; F89-P121 HydrophobicContact CE1-CB 4.08Å; F89-P121 HydrophobicContact CE1-CG 4.06Å; F89-P121 HydrophobicContact CE2-CB 4.23Å; F89-P121 HydrophobicContact CG-CB 3.46Å; F89-P121 VanDerWaalsContact CG-CB 3.46Å; F89-P121 HydrophobicContact CG-CG 4.12Å; F89-P121 HydrophobicContact CZ-CB 4.37Å; F96-P121 HydrophobicContact CE1-CB 4.23Å; F96-P121 HydrophobicContact CZ-CB 4.21Å; Q117-P121 VanDerWaalsContact O-CA 3.27Å; Q117-P121 WeakPolarHBondContact O-CA 3.24Å; Q117-P121 WeakPolarHBondContact O-CB 3.35Å; Q117-P121 WeakPolarHBondContact O-CD 3.03Å; P121-V124 PolarHBondContact O-N 2.79Å; P121-L125 WeakPolarHBondContact O-CG 3.43Å; P121-L125 PolarHBondContact O-N 3.3Å; P121-L125 VanDerWaalsContact O-N 3.11Å
122	Q	86.5	Confident	84.5	Confident	119 Å²	119	48.9 Å²	48.9	56%	0.556	25%	0.245	S	C	*	.	H	α-helix	trans	-67.1	-41.7	176.5	-172.7	61.1	48.6	0	0	112.3	N120 V124 L125 D126	N120-Q122 VanDerWaalsContact C-N 3.31Å; N120-Q122 PolarHBondContact O-N 3.48Å; Q122-V124 VanDerWaalsContact C-N 3.25Å; Q122-V124 PolarHBondContact O-N 3.07Å; Q122-L125 PolarHBondContact O-N 2.94Å; Q122-L125 VanDerWaalsContact O-N 3.09Å; Q122-D126 PolarHBondContact NE2-OD1 2.68Å; Q122-D126 VanDerWaalsContact O-CG 3.29Å; Q122-D126 PolarHBondContact O-N 2.83Å
123	A	86.1	Confident	83.4	Confident	12 Å²	12	50.7 Å²	50.7	10%	0.099	26%	0.258	C	S	.	.	H	α-helix	trans	-63	-35.7	177.9	0	0	0	0	0	111.4	N120 V127 Y473 A476 T477	N120-A123 HydrophobicContact CB-CB 4.1Å; N120-A123 PolarHBondContact O-N 2.96Å; N120-A123 VanDerWaalsContact O-N 3.16Å; A123-V127 VanDerWaalsContact O-CB 3.31Å; A123-V127 WeakPolarHBondContact O-CB 3.42Å; A123-V127 WeakPolarHBondContact O-CG2 3.33Å; A123-V127 PolarHBondContact O-N 3.03Å; A123-V127 VanDerWaalsContact O-N 3.16Å; A123-Y473 HydrophobicContact CB-CD2 4.34Å; A123-Y473 HydrophobicContact CB-CE2 4.35Å; A123-A476 HydrophobicContact CB-CB 4.21Å; A123-T477 HydrophobicContact CB-CG2 3.67Å
124	V	87.3	Confident	82.1	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.006	25%	0.252	C	S	.	.	H	α-helix	trans	-62.4	-44.6	171.5	169.4	0	0	0	0	111.9	F96 L107 I112 Q117 N120 P121 Q122 V127 L128 Y473	F96-V124 HydrophobicContact CE1-CG1 4.45Å; F96-V124 HydrophobicContact CE2-CB 4.49Å; F96-V124 HydrophobicContact CE2-CG1 3.77Å; F96-V124 HydrophobicContact CZ-CB 3.9Å; F96-V124 HydrophobicContact CZ-CG1 3.54Å; L107-V124 HydrophobicContact CD1-CG1 4.19Å; L107-V124 HydrophobicContact CD2-CG1 3.76Å; L107-V124 HydrophobicContact CG-CG1 4.45Å; I112-V124 HydrophobicContact CG2-CG2 4.15Å; Q117-V124 HydrophobicContact CG-CG2 4.15Å; N120-V124 PolarHBondContact O-N 3.11Å; P121-V124 PolarHBondContact O-N 2.79Å; Q122-V124 VanDerWaalsContact C-N 3.25Å; Q122-V124 PolarHBondContact O-N 3.07Å; V124-V127 PolarHBondContact O-N 2.92Å; V124-L128 HydrophobicContact CG1-CD1 3.65Å; V124-L128 HydrophobicContact CG1-CG 4.32Å; V124-L128 WeakPolarHBondContact O-CB 3.15Å; V124-L128 VanDerWaalsContact O-CG 3.27Å; V124-L128 WeakPolarHBondContact O-CG 3.2Å; V124-L128 PolarHBondContact O-N 2.78Å; V124-Y473 HydrophobicContact CG2-CD2 3.76Å; V124-Y473 HydrophobicContact CG2-CE2 3.66Å
125	L	85.9	Confident	80.6	Confident	26 Å²	26	49.1 Å²	49.1	14%	0.136	25%	0.245	C	C	.	.	H	α-helix	trans	-64.7	-47.7	177.7	-68.4	173.4	0	0	0	112.1	V87 F96 W103 P121 Q122 V127 L128 E129	V87-L125 HydrophobicContact CB-CD2 3.86Å; V87-L125 HydrophobicContact CG1-CD2 3.64Å; F96-L125 HydrophobicContact CD1-CD2 3.94Å; F96-L125 HydrophobicContact CD1-CG 4.41Å; F96-L125 HydrophobicContact CE1-CD1 4.27Å; F96-L125 HydrophobicContact CE1-CD2 3.81Å; F96-L125 HydrophobicContact CE1-CG 3.83Å; W103-L125 HydrophobicContact CZ3-CD2 4.45Å; P121-L125 WeakPolarHBondContact O-CG 3.43Å; P121-L125 PolarHBondContact O-N 3.3Å; P121-L125 VanDerWaalsContact O-N 3.11Å; Q122-L125 PolarHBondContact O-N 2.94Å; Q122-L125 VanDerWaalsContact O-N 3.09Å; L125-V127 PolarHBondContact O-N 2.89Å; L125-L128 PolarHBondContact O-N 2.82Å; L125-E129 WeakPolarHBondContact O-CB 3.47Å; L125-E129 PolarHBondContact O-N 2.87Å
126	D	84.5	Confident	78.7	Confident	22 Å²	22	50.8 Å²	50.8	12%	0.118	25%	0.245	C	C	.	.	H	α-helix	trans	-55	-41.1	178.5	-67.7	-10.8	0	0	0	111.5	Q122 F130 R437	Q122-D126 PolarHBondContact NE2-OD1 2.68Å; Q122-D126 VanDerWaalsContact O-CG 3.29Å; Q122-D126 PolarHBondContact O-N 2.83Å; D126-F130 WeakPolarHBondContact O-CB 3.36Å; D126-F130 PolarHBondContact O-N 2.85Å; D126-R437 PolarHBondContact O-NE 3.32Å
127	V	84.7	Confident	76.6	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-82.7	-32.9	-176.5	173.7	0	0	0	0	113.2	A123 V124 L125 F130 Y131 V435 L469 L472	A123-V127 VanDerWaalsContact O-CB 3.31Å; A123-V127 WeakPolarHBondContact O-CB 3.42Å; A123-V127 WeakPolarHBondContact O-CG2 3.33Å; A123-V127 PolarHBondContact O-N 3.03Å; A123-V127 VanDerWaalsContact O-N 3.16Å; V124-V127 PolarHBondContact O-N 2.92Å; L125-V127 PolarHBondContact O-N 2.89Å; V127-F130 WeakPolarHBondContact O-CB 3.34Å; V127-F130 PolarHBondContact O-N 2.87Å; V127-Y131 PolarHBondContact O-N 2.96Å; V127-V435 HydrophobicContact CG2-CG1 3.74Å; V127-L469 HydrophobicContact CG1-CD2 3.68Å; V127-L469 HydrophobicContact CG1-CG 3.98Å; V127-L469 VanDerWaalsContact CG1-O 3.24Å; V127-L469 WeakPolarHBondContact CG1-O 3.31Å; V127-L472 HydrophobicContact CG1-CB 3.67Å; V127-L472 HydrophobicContact CG1-CD1 4.5Å; V127-L472 HydrophobicContact CG2-CB 4Å
128	L	84.8	Confident	74.3	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-66.2	-43.5	168.6	-75.9	166.4	0	0	0	111	M99 W103 L106 L107 V124 L125 F130 Y131 N132 L469	M99-L128 HydrophobicContact CE-CD1 3.51Å; M99-L128 HydrophobicContact SD-CD1 4.42Å; W103-L128 HydrophobicContact CB-CD2 4.29Å; W103-L128 HydrophobicContact CD2-CB 4.17Å; W103-L128 HydrophobicContact CE3-CB 3.86Å; W103-L128 HydrophobicContact CE3-CD1 4.25Å; W103-L128 HydrophobicContact CZ3-CB 4.32Å; L106-L128 HydrophobicContact CB-CD2 4.01Å; L107-L128 HydrophobicContact CD1-CD1 3.98Å; L107-L128 HydrophobicContact CD2-CD1 4.19Å; L107-L128 HydrophobicContact CD2-CD2 4.35Å; L107-L128 HydrophobicContact CD2-CG 4.49Å; L107-L128 HydrophobicContact CG-CD1 3.84Å; L107-L128 HydrophobicContact CG-CD2 4.02Å; L107-L128 HydrophobicContact CG-CG 4.38Å; V124-L128 HydrophobicContact CG1-CD1 3.65Å; V124-L128 HydrophobicContact CG1-CG 4.32Å; V124-L128 WeakPolarHBondContact O-CB 3.15Å; V124-L128 VanDerWaalsContact O-CG 3.27Å; V124-L128 WeakPolarHBondContact O-CG 3.2Å; V124-L128 PolarHBondContact O-N 2.78Å; L125-L128 PolarHBondContact O-N 2.82Å; L128-F130 VanDerWaalsContact C-N 3.3Å; L128-F130 PolarHBondContact O-N 2.66Å; L128-Y131 PolarHBondContact O-N 2.99Å; L128-N132 VanDerWaalsContact O-CB 3.29Å; L128-N132 WeakPolarHBondContact O-CB 3.16Å; L128-N132 PolarHBondContact O-N 2.63Å; L128-L469 HydrophobicContact CD2-CD1 4.2Å; L128-L469 HydrophobicContact CD2-CD2 4.46Å
129	E	80.4	Confident	71.7	Confident	82 Å²	82	52 Å²	52	38%	0.383	27%	0.272	S	S	.	.	H	α-helix	trans	-69.1	-30.5	175.8	-147.2	-146.6	128.8	0	0	111.1	W103 L125 S133 R437	W103-E129 HydrophobicContact CH2-CB 4.06Å; W103-E129 HydrophobicContact CH2-CG 3.88Å; W103-E129 HydrophobicContact CZ2-CB 4.45Å; W103-E129 HydrophobicContact CZ2-CG 4.1Å; L125-E129 WeakPolarHBondContact O-CB 3.47Å; L125-E129 PolarHBondContact O-N 2.87Å; E129-S133 VanDerWaalsContact O-CB 3.26Å; E129-S133 WeakPolarHBondContact O-CB 3.4Å; E129-S133 PolarHBondContact O-N 3.09Å; E129-S133 PolarHBondContact O-OG 3.2Å; E129-R437 PolarHBondContact O-NH2 2.69Å; E129-R437 IonicContact OE1-CZ 2.88Å; E129-R437 IonicContact OE1-NH1 3.81Å; E129-R437 PolarHBondContact OE1-NH1 3.1Å; E129-R437 IonicContact OE1-NH2 3.52Å; E129-R437 PolarHBondContact OE1-NH2 2.6Å; E129-R437 IonicContact OE2-CZ 3.09Å; E129-R437 IonicContact OE2-NE 3.67Å; E129-R437 IonicContact OE2-NH1 2.72Å; E129-R437 PolarHBondContact OE2-NH1 3.25Å; E129-R437 IonicContact OE2-NH2 2.84Å
130	F	75.3	Confident	69.2	Low	5 Å²	5	52.5 Å²	52.5	2%	0.022	28%	0.277	C	S	.	.	H	α-helix	trans	-55.4	-60	165.5	175.1	-70.3	0	0	0	110.3	D126 V127 L128 N132 S133 K134 M423 P427 M430 L472	D126-F130 WeakPolarHBondContact O-CB 3.36Å; D126-F130 PolarHBondContact O-N 2.85Å; V127-F130 WeakPolarHBondContact O-CB 3.34Å; V127-F130 PolarHBondContact O-N 2.87Å; L128-F130 VanDerWaalsContact C-N 3.3Å; L128-F130 PolarHBondContact O-N 2.66Å; F130-N132 VanDerWaalsContact C-N 3.29Å; F130-N132 PolarHBondContact O-N 3.2Å; F130-S133 PolarHBondContact O-N 3.33Å; F130-S133 VanDerWaalsContact O-N 3.16Å; F130-S133 PolarHBondContact O-OG 3Å; F130-K134 HydrophobicContact CE1-CB 4.38Å; F130-K134 HydrophobicContact CE1-CD 3.67Å; F130-K134 HydrophobicContact CZ-CD 4.06Å; F130-K134 PolarHBondContact O-N 3.13Å; F130-M423 WeakPolarHBondContact CA-SD 3.25Å; F130-M423 HydrophobicContact CB-CE 3.8Å; F130-M423 HydrophobicContact CB-SD 3.59Å; F130-M423 VanDerWaalsContact CB-SD 3.59Å; F130-M423 HydrophobicContact CD2-CE 3.55Å; F130-M423 HydrophobicContact CD2-CG 3.53Å; F130-M423 HydrophobicContact CD2-SD 3.13Å; F130-M423 WeakPolarHBondContact CD2-SD 3.35Å; F130-M423 HydrophobicContact CE2-CG 3.61Å; F130-M423 HydrophobicContact CE2-SD 3.83Å; F130-M423 HydrophobicContact CG-CE 4.08Å; F130-M423 HydrophobicContact CG-CG 4.39Å; F130-M423 HydrophobicContact CG-SD 3.49Å; F130-M423 WeakPolarHBondContact CG-SD 3.47Å; F130-P427 HydrophobicContact CZ-CG 4.4Å; F130-M430 HydrophobicContact CE2-CE 3.74Å; F130-M430 HydrophobicContact CE2-SD 3.53Å; F130-M430 VanDerWaalsContact CE2-SD 3.53Å; F130-M430 HydrophobicContact CZ-SD 3.81Å; F130-L472 HydrophobicContact CD1-CD1 3.29Å; F130-L472 HydrophobicContact CD2-CD1 4.1Å; F130-L472 HydrophobicContact CD2-CD2 4.37Å; F130-L472 HydrophobicContact CE1-CD1 3.26Å; F130-L472 HydrophobicContact CE2-CD1 4.07Å; F130-L472 HydrophobicContact CE2-CD2 4.08Å; F130-L472 HydrophobicContact CG-CD1 3.8Å; F130-L472 HydrophobicContact CZ-CD1 3.69Å; F130-L472 HydrophobicContact CZ-CD2 4.22Å
131	Y	73.4	Confident	66.9	Low	31 Å²	31	53.8 Å²	53.8	12%	0.122	28%	0.28	C	S	.	.	H	α-helix	trans	-66.9	-36.3	-169.3	-158.9	-78.5	0	0	0	111.1	L106 V127 L128 K134 K135 Y142 P468 L469	L106-Y131 HydrophobicContact CD1-CD1 3.87Å; L106-Y131 HydrophobicContact CD2-CD1 3.78Å; L106-Y131 HydrophobicContact CD2-CE1 3.67Å; V127-Y131 PolarHBondContact O-N 2.96Å; L128-Y131 PolarHBondContact O-N 2.99Å; Y131-K134 PolarHBondContact O-N 3.49Å; Y131-K135 VanDerWaalsContact O-CB 3.29Å; Y131-K135 WeakPolarHBondContact O-CB 3.4Å; Y131-K135 PolarHBondContact O-N 3.5Å; Y131-Y142 PolarHBondContact OH-OH 2.76Å; Y131-Y142 VanDerWaalsContact OH-OH 3.1Å; Y131-P468 HydrophobicContact CE2-CB 4.36Å; Y131-L469 HydrophobicContact CD1-CD1 4.31Å; Y131-L469 HydrophobicContact CD2-CB 3.7Å; Y131-L469 HydrophobicContact CD2-CD1 3.84Å; Y131-L469 HydrophobicContact CD2-CG 3.91Å; Y131-L469 HydrophobicContact CE2-CB 4.05Å; Y131-L469 HydrophobicContact CE2-CD1 4.48Å; Y131-L469 HydrophobicContact CG-CB 4.44Å; Y131-L469 HydrophobicContact CG-CD1 3.72Å; Y131-L469 HydrophobicContact CG-CG 4.19Å
132	N	72.6	Confident	64.2	Low	16 Å²	16	59.2 Å²	59.2	9%	0.086	30%	0.297	C	S	.	.	H	α-helix	trans	-66.3	-45.4	173.7	-168.7	42.6	0	0	0	112.4	W103 L128 F130 K134 K135 I136	W103-N132 HydrophobicContact CZ2-CB 4.36Å; W103-N132 PolarHBondContact NE1-ND2 3.33Å; L128-N132 VanDerWaalsContact O-CB 3.29Å; L128-N132 WeakPolarHBondContact O-CB 3.16Å; L128-N132 PolarHBondContact O-N 2.63Å; F130-N132 VanDerWaalsContact C-N 3.29Å; F130-N132 PolarHBondContact O-N 3.2Å; N132-K134 VanDerWaalsContact C-N 3.29Å; N132-K134 PolarHBondContact O-N 2.89Å; N132-K135 PolarHBondContact O-N 2.82Å; N132-K135 VanDerWaalsContact O-N 3.17Å; N132-I136 WeakPolarHBondContact O-CB 3.48Å; N132-I136 VanDerWaalsContact O-CG1 3.32Å; N132-I136 WeakPolarHBondContact O-CG1 3.44Å; N132-I136 PolarHBondContact O-N 2.9Å
133	S	64.5	Low	61.7	Low	45 Å²	45	59.9 Å²	59.9	32%	0.315	30%	0.302	S	S	.	.	H	α-helix	trans	-61.2	-39.3	176.4	75.2	0	0	0	0	111.9	E129 F130 S137	E129-S133 VanDerWaalsContact O-CB 3.26Å; E129-S133 WeakPolarHBondContact O-CB 3.4Å; E129-S133 PolarHBondContact O-N 3.09Å; E129-S133 PolarHBondContact O-OG 3.2Å; F130-S133 PolarHBondContact O-N 3.33Å; F130-S133 VanDerWaalsContact O-N 3.16Å; F130-S133 PolarHBondContact O-OG 3Å; S133-S137 WeakPolarHBondContact O-CB 3.42Å; S133-S137 PolarHBondContact O-N 2.8Å; S133-S137 VanDerWaalsContact O-N 3.11Å
134	K	59.5	Low	58.9	Low	71 Å²	71	64.6 Å²	64.6	31%	0.309	33%	0.334	S	S	.	.	H	α-helix	trans	-64.5	-45.2	173.6	-167.3	163.5	-175.2	167.1	0	110.8	F130 Y131 N132 S137 N138	F130-K134 HydrophobicContact CE1-CB 4.38Å; F130-K134 HydrophobicContact CE1-CD 3.67Å; F130-K134 HydrophobicContact CZ-CD 4.06Å; F130-K134 PolarHBondContact O-N 3.13Å; Y131-K134 PolarHBondContact O-N 3.49Å; N132-K134 VanDerWaalsContact C-N 3.29Å; N132-K134 PolarHBondContact O-N 2.89Å; K134-S137 CarbonylContact O-C 3.54Å; K134-S137 WeakPolarHBondContact O-CA 3.48Å; K134-S137 WeakPolarHBondContact O-CB 3.37Å; K134-S137 PolarHBondContact O-N 3.16Å; K134-N138 WeakPolarHBondContact O-CB 3.38Å; K134-N138 PolarHBondContact O-N 2.89Å; K134-N138 PolarHBondContact O-OD1 3.13Å
135	K	54.4	Low	56.2	Low	102 Å²	102	72.9 Å²	72.9	44%	0.443	37%	0.37	S	S	.	.	H	α-helix	trans	-68.7	-36.1	-179.8	-164.9	171.5	-174.7	173.9	0	113.7	Y131 N132 S137 N138 S139	Y131-K135 VanDerWaalsContact O-CB 3.29Å; Y131-K135 WeakPolarHBondContact O-CB 3.4Å; Y131-K135 PolarHBondContact O-N 3.5Å; N132-K135 PolarHBondContact O-N 2.82Å; N132-K135 VanDerWaalsContact O-N 3.17Å; K135-S137 VanDerWaalsContact C-N 3.28Å; K135-S137 PolarHBondContact O-N 2.94Å; K135-N138 CarbonylContact O-C 3.56Å; K135-N138 VanDerWaalsContact O-C 3.25Å; K135-N138 PolarHBondContact O-N 2.84Å; K135-S139 PolarHBondContact O-N 3.25Å
136	I	46.8	Very low	53.5	Low	126 Å²	126	77.4 Å²	77.4	65%	0.646	40%	0.399	S	S	*	.	H	α-helix	trans	-66.1	-32.8	171.9	-68.2	166.8	0	0	0	110.8	N132	N132-I136 WeakPolarHBondContact O-CB 3.48Å; N132-I136 VanDerWaalsContact O-CG1 3.32Å; N132-I136 WeakPolarHBondContact O-CG1 3.44Å; N132-I136 PolarHBondContact O-N 2.9Å
137	S	43.5	Very low	50.7	Low	52 Å²	52	83.9 Å²	83.9	36%	0.364	43%	0.434	S	S	.	.	H	α-helix	trans	-78.7	-13.6	169	-171	0	0	0	0	114.3	S133 K134 K135	S133-S137 WeakPolarHBondContact O-CB 3.42Å; S133-S137 PolarHBondContact O-N 2.8Å; S133-S137 VanDerWaalsContact O-N 3.11Å; K134-S137 CarbonylContact O-C 3.54Å; K134-S137 WeakPolarHBondContact O-CA 3.48Å; K134-S137 WeakPolarHBondContact O-CB 3.37Å; K134-S137 PolarHBondContact O-N 3.16Å; K135-S137 VanDerWaalsContact C-N 3.28Å; K135-S137 PolarHBondContact O-N 2.94Å
138	N	40.1	Very low	47.9	Very low	27 Å²	27	92.7 Å²	92.7	14%	0.144	47%	0.472	C	S	.	.			trans	-129.8	42.5	-167.3	-69.1	4.2	0	0	0	112.7	K134 K135 Q140 K141	K134-N138 WeakPolarHBondContact O-CB 3.38Å; K134-N138 PolarHBondContact O-N 2.89Å; K134-N138 PolarHBondContact O-OD1 3.13Å; K135-N138 CarbonylContact O-C 3.56Å; K135-N138 VanDerWaalsContact O-C 3.25Å; K135-N138 PolarHBondContact O-N 2.84Å; N138-Q140 PolarHBondContact O-N 3.12Å; N138-K141 HydrophobicContact CB-CB 3.72Å; N138-K141 PolarHBondContact O-N 3.18Å
139	S	31	Very low	45.2	Very low	112 Å²	112	98 Å²	98	78%	0.783	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-10.9	164.1	56.8	0	0	0	0	112.9	K135	K135-S139 PolarHBondContact O-N 3.25Å
140	Q	36.5	Very low	42.5	Very low	173 Å²	173	101.1 Å²	101.1	81%	0.808	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.2	34.6	176.5	-59.1	-176.5	-61.3	0	0	113.1	N138	N138-Q140 PolarHBondContact O-N 3.12Å
141	K	39	Very low	40.2	Very low	72 Å²	72	110.1 Å²	110.1	31%	0.313	58%	0.576	S	S	.	*			trans	-149.5	87.9	-177.3	-148.4	170.5	-163.4	160.9	0	116.5	N138 A279	N138-K141 HydrophobicContact CB-CB 3.72Å; N138-K141 PolarHBondContact O-N 3.18Å; K141-A279 WeakPolarHBondContact CE-O 3.34Å; K141-A279 PolarHBondContact NZ-O 2.9Å
142	Y	30.9	Very low	37.8	Very low	149 Å²	149	115.8 Å²	115.8	58%	0.584	61%	0.609	S	S	*	*			trans	-129.5	141.2	150.4	-72.4	-95.7	0	0	0	107.8	Y131	Y131-Y142 PolarHBondContact OH-OH 2.76Å; Y131-Y142 VanDerWaalsContact OH-OH 3.1Å
143	M	34.7	Very low	35.5	Very low	134 Å²	134	126.2 Å²	126.2	66%	0.66	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-95.5	137.8	153	-64.7	-174.2	74.6	0	0	106.3
144	S	26.4	Very low	33.5	Very low	110 Å²	110	129.8 Å²	129.8	77%	0.769	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-76.9	138.6	164.7	-159.5	0	0	0	0	107.9
145	F	30.8	Very low	31.8	Very low	175 Å²	175	132.4 Å²	132.4	77%	0.768	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-78.8	160.2	152.7	-66.4	-88.8	0	0	0	108.2
146	T	29	Very low	30.4	Very low	122 Å²	122	133.3 Å²	133.3	75%	0.748	72%	0.715	S	S	*	*	S	Bend	trans	65.8	138.8	-172.4	66	0	0	0	0	118.2
147	D	26.6	Very low	29.3	Very low	157 Å²	157	134.4 Å²	134.4	84%	0.84	72%	0.722	S	S	*	*			trans	66.8	119.3	158.4	-55.1	-10.9	0	0	0	122.5
148	K	26.6	Very low	28.4	Very low	186 Å²	186	137.7 Å²	137.7	81%	0.809	74%	0.74	S	S	*	*			trans	-104.7	153.5	148.5	-75.8	177.2	-178.8	166.3	0	108.9
149	S	26.5	Very low	27.7	Very low	112 Å²	112	143.9 Å²	143.9	78%	0.783	77%	0.772	S	S	*	*			trans	53.4	89.3	160.4	54.7	0	0	0	0	118.1
150	T	25.5	Very low	27.3	Very low	147 Å²	147	145.4 Å²	145.4	90%	0.902	77%	0.772	S	S	*	*				-128.1	134.7	124.4	33.6	0	0	0	0	108.3
151	E	26	Very low	26.9	Very low	194 Å²	194	143.8 Å²	143.8	91%	0.907	77%	0.773	S	S	*	*			trans	-93.3	162.7	172.1	-69.9	-169.8	144.1	0	0	110.6	Y153	E151-Y153 PolarHBondContact O-N 2.97Å
152	D	23.2	Very low	26.3	Very low	150 Å²	150	149 Å²	149	80%	0.802	80%	0.796	S	S	*	*			trans	-56.6	132.7	-172.9	-70.3	-70.9	0	0	0	114.4
153	Y	23.7	Very low	26	Very low	234 Å²	234	146.3 Å²	146.3	92%	0.918	81%	0.805	S	S	*	*			trans	-139.4	124.2	142.2	-115.6	-82.9	0	0	0	111.3	E151	E151-Y153 PolarHBondContact O-N 2.97Å
154	T	21.9	Very low	25.7	Very low	121 Å²	121	146.2 Å²	146.2	74%	0.742	81%	0.811	S	S	*	*			trans	-92.2	125.5	178.6	38	0	0	0	0	111.2
155	S	24.3	Very low	25.6	Very low	126 Å²	126	146.3 Å²	146.3	88%	0.881	81%	0.812	S	S	*	*			trans	-164.3	141.2	150.3	-88.6	0	0	0	0	112.8
156	S	24.6	Very low	25.5	Very low	120 Å²	120	146.8 Å²	146.8	84%	0.839	82%	0.816	S	S	*	*			trans	-71.9	145.1	-174.7	-43.5	0	0	0	0	113.6
157	N	24.7	Very low	25.4	Very low	150 Å²	150	147.5 Å²	147.5	80%	0.802	82%	0.821	S	S	*	*			trans	-151.8	146.7	131.2	-147.7	-10.9	0	0	0	112
158	T	23.5	Very low	25.6	Very low	120 Å²	120	146.2 Å²	146.2	74%	0.736	82%	0.821	S	S	*	*			trans	-128.1	115.1	-173.5	46	0	0	0	0	111.6
159	L	26.1	Very low	25.5	Very low	158 Å²	158	141.5 Å²	141.5	83%	0.827	82%	0.817	S	S	*	*			trans	-131.7	67.3	175.4	-74.2	179	0	0	0	113.6
160	N	23.6	Very low	25.6	Very low	144 Å²	144	142.7 Å²	142.7	77%	0.77	82%	0.819	S	S	*	*			trans	4.7	109.3	134.8	-166.3	25.1	0	0	0	117.7
161	V	28.1	Very low	25.9	Very low	138 Å²	138	141 Å²	141	84%	0.836	81%	0.81	S	S	*	*			trans	-132	142	156.3	-178.2	0	0	0	0	108.4
162	K	26.1	Very low	25.8	Very low	182 Å²	182	137.1 Å²	137.1	79%	0.791	81%	0.805	S	S	*	*			trans	-88.5	151.5	-171.7	-65.5	-179.9	178.1	177.8	0	113
163	A	25	Very low	26	Very low	93 Å²	93	136.8 Å²	136.8	77%	0.769	81%	0.808	S	S	*	*			trans	-74.1	155.7	162.3	0	0	0	0	0	111.9
164	V	26.7	Very low	26.2	Very low	132 Å²	132	129.8 Å²	129.8	80%	0.8	79%	0.793	S	S	*	*			trans	-133.4	131	159.5	-179.5	0	0	0	0	106.8
165	S	25.2	Very low	26.6	Very low	112 Å²	112	131.8 Å²	131.8	78%	0.783	79%	0.794	S	S	*	*			trans	-117.2	131.5	174.8	-57	0	0	0	0	108.6
166	E	27.6	Very low	26.8	Very low	184 Å²	184	132.6 Å²	132.6	86%	0.86	79%	0.789	S	S	*	*			trans	-151.2	119	170.2	-119.8	165.2	-139	0	0	110.6
167	T	27.8	Very low	27.2	Very low	138 Å²	138	135.5 Å²	135.5	85%	0.847	79%	0.789	S	S	*	*			trans	-140	125.6	171.1	43.1	0	0	0	0	108.9
168	P	30.8	Very low	27.6	Very low	130 Å²	130	136.3 Å²	136.3	84%	0.844	79%	0.793	S	S	*	*			trans	-85.3	139	175.7	-8.6	26.4	0	0	0	112.4
169	A	25.1	Very low	28.2	Very low	86 Å²	86	138.1 Å²	138.1	71%	0.711	80%	0.799	S	S	*	*			trans	-84.9	174	145.4	0	0	0	0	0	108.2
170	V	27.6	Very low	28.7	Very low	137 Å²	137	140.2 Å²	140.2	83%	0.83	80%	0.804	S	S	*	*			cis	-152.2	-167.6	18.2	-123	0	0	0	0	106.1
171	P	32	Very low	29.2	Very low	111 Å²	111	141 Å²	141	72%	0.721	81%	0.809	S	S	*	*			cis	-128.4	176.3	3.1	42	-25.5	0	0	0	115.8
172	S	24.2	Very low	29.7	Very low	114 Å²	114	142.2 Å²	142.2	80%	0.797	81%	0.81	S	S	*	*			trans	-82.6	157.5	163.3	49.7	0	0	0	0	112.4
173	V	28.4	Very low	30.2	Very low	142 Å²	142	137.6 Å²	137.6	86%	0.861	81%	0.806	S	S	*	*			trans	-138.1	145.1	171.7	-159.7	0	0	0	0	109.3
174	S	27.9	Very low	31.4	Very low	87 Å²	87	137.6 Å²	137.6	61%	0.608	81%	0.806	S	S	*	*			trans	-101.3	-177.7	174.1	65	0	0	0	0	110.5
175	E	29.6	Very low	32.7	Very low	163 Å²	163	136.8 Å²	136.8	76%	0.762	80%	0.803	S	S	*	*			cis	-153.9	-146.5	-0.5	-137.4	130.5	-158.5	0	0	107.6
176	D	28.2	Very low	33.7	Very low	143 Å²	143	137 Å²	137	77%	0.765	80%	0.802	S	S	*	*			trans	71.7	105.6	169.8	-44.6	-19.6	0	0	0	115.2
177	E	33.5	Very low	34.9	Very low	181 Å²	181	134.1 Å²	134.1	85%	0.846	80%	0.8	S	S	*	*				88.8	113.7	55.4	-73.1	-168.5	169.9	0	0	114.7
178	D	32.6	Very low	35.8	Very low	168 Å²	168	134.4 Å²	134.4	90%	0.898	80%	0.801	S	S	*	*			trans	-179.6	152.4	131.8	-97	-18.7	0	0	0	110.8
179	D	35.2	Very low	36.7	Very low	158 Å²	158	135.7 Å²	135.7	85%	0.845	80%	0.799	S	S	*	*			trans	-92	159.3	-162.7	-65.1	-61.7	0	0	0	116.9
180	E	36.8	Very low	37.8	Very low	201 Å²	201	135.5 Å²	135.5	94%	0.939	80%	0.798	S	S	*	*				-170.9	145.3	111.4	-103.7	-175	175.6	0	0	112.8
181	D	35.8	Very low	39.4	Very low	162 Å²	162	134.9 Å²	134.9	87%	0.866	80%	0.796	S	S	*	*			trans	-99.9	133.4	-171.8	-126.5	-21.4	0	0	0	112.1
182	D	37	Very low	40.1	Very low	162 Å²	162	138.4 Å²	138.4	87%	0.866	80%	0.795	S	S	*	*			trans	-149	121.7	150	-165.5	6.3	0	0	0	111.5	A184	D182-A184 PolarHBondContact O-N 3.21Å
183	A	38.3	Very low	42	Very low	86 Å²	86	136.6 Å²	136.6	71%	0.711	78%	0.781	S	S	*	*			trans	-102.4	80.7	-163.9	0	0	0	0	0	112.6
184	A	49.3	Very low	43.2	Very low	93 Å²	93	136.4 Å²	136.4	77%	0.769	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-66.1	131	175.9	0	0	0	0	0	112.6	D182	D182-A184 PolarHBondContact O-N 3.21Å
185	P	53.8	Low	44.5	Very low	114 Å²	114	140.1 Å²	140.1	74%	0.74	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-71.3	154.3	178.3	29.5	-35.2	0	0	0	112.4
186	P	47.2	Very low	45.5	Very low	118 Å²	118	134.3 Å²	134.3	77%	0.766	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-64.1	146.3	-176.7	26.2	-35.1	0	0	0	112.6
187	P	52.4	Low	46.4	Very low	123 Å²	123	133.6 Å²	133.6	80%	0.799	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-65.9	139.6	-174.6	26.7	-34.9	0	0	0	112.5	I189	P187-I189 PolarHBondContact O-N 2.94Å
188	V	46.1	Very low	46.8	Very low	144 Å²	144	129 Å²	129	87%	0.873	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-65.1	122.1	178.7	178.9	0	0	0	0	110.2	A190	V188-A190 PolarHBondContact O-N 2.86Å
189	I	49.1	Very low	47.5	Very low	156 Å²	156	128.8 Å²	128.8	80%	0.8	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-62.1	120.8	176.8	-60.2	173.2	0	0	0	109.4	P187	P187-I189 PolarHBondContact O-N 2.94Å
190	A	50	Low	47.8	Very low	83 Å²	83	131.4 Å²	131.4	69%	0.686	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-61.3	136.1	178	0	0	0	0	0	111.3	V188 R192	V188-A190 PolarHBondContact O-N 2.86Å; A190-R192 PolarHBondContact O-N 3.03Å
191	P	61.2	Low	48	Very low	124 Å²	124	127.4 Å²	127.4	81%	0.805	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-64	136.2	-178.1	25.4	-33.7	0	0	0	111.6
192	R	46.3	Very low	48	Very low	184 Å²	184	130.5 Å²	130.5	69%	0.694	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-56.5	131.5	-175.2	-162.4	-170	178.2	-174.8	-3.9	111.4	A190 T196	A190-R192 PolarHBondContact O-N 3.03Å; R192-T196 VanDerWaalsContact CD-OG1 3.22Å; R192-T196 WeakPolarHBondContact CD-OG1 3.44Å; R192-T196 VanDerWaalsContact CG-OG1 3.28Å; R192-T196 WeakPolarHBondContact CG-OG1 3.47Å; R192-T196 PolarHBondContact NE-OG1 2.85Å; R192-T196 VanDerWaalsContact NE-OG1 3.1Å
193	P	63.4	Low	48	Very low	77 Å²	77	128.3 Å²	128.3	50%	0.5	71%	0.714	S	S	.	*	P	Polyproline II helix	trans	-63	141.7	-172.1	23.3	-34.7	0	0	0	113.6	H195 T196	P193-H195 PolarHBondContact O-N 3.05Å; P193-T196 PolarHBondContact O-N 2.85Å; P193-T196 PolarHBondContact O-OG1 2.9Å
194	E	53.4	Low	47.9	Very low	137 Å²	137	129.6 Å²	129.6	64%	0.64	71%	0.714	S	S	*	*	G	3₁₀ helix	trans	-43.4	-42	-172.1	-75	-64.9	120.9	0	0	115	T196 K197	E194-T196 PolarHBondContact O-N 3.12Å; E194-K197 WeakPolarHBondContact O-CB 3.43Å; E194-K197 PolarHBondContact O-N 2.82Å; E194-K197 WeakPolarHBondContact OE1-CE 3.4Å; E194-K197 IonicContact OE1-NZ 3.73Å; E194-K197 PolarHBondContact OE1-NZ 2.8Å; E194-K197 IonicContact OE2-NZ 3.71Å
195	H	55.1	Low	47.3	Very low	166 Å²	166	132.4 Å²	132.4	77%	0.769	71%	0.714	S	S	*	*	G	3₁₀ helix	trans	-60.6	-9.6	-176.4	78.5	-96.3	0	0	0	114.7	P193	P193-H195 PolarHBondContact O-N 3.05Å
196	T	50.1	Low	46.4	Very low	41 Å²	41	134.5 Å²	134.5	25%	0.252	72%	0.719	S	S	.	*	G	3₁₀ helix	trans	-102.6	-0.1	179.7	65.3	0	0	0	0	114.2	R192 P193 E194	R192-T196 VanDerWaalsContact CD-OG1 3.22Å; R192-T196 WeakPolarHBondContact CD-OG1 3.44Å; R192-T196 VanDerWaalsContact CG-OG1 3.28Å; R192-T196 WeakPolarHBondContact CG-OG1 3.47Å; R192-T196 PolarHBondContact NE-OG1 2.85Å; R192-T196 VanDerWaalsContact NE-OG1 3.1Å; P193-T196 PolarHBondContact O-N 2.85Å; P193-T196 PolarHBondContact O-OG1 2.9Å; E194-T196 PolarHBondContact O-N 3.12Å
197	K	47.6	Very low	45.8	Very low	127 Å²	127	134.2 Å²	134.2	55%	0.552	72%	0.717	S	S	*	*	S	Bend	trans	-78.1	124.1	177.2	-68.5	179.4	175.1	176.8	0	110.5	E194	E194-K197 WeakPolarHBondContact O-CB 3.43Å; E194-K197 PolarHBondContact O-N 2.82Å; E194-K197 WeakPolarHBondContact OE1-CE 3.4Å; E194-K197 IonicContact OE1-NZ 3.73Å; E194-K197 PolarHBondContact OE1-NZ 2.8Å; E194-K197 IonicContact OE2-NZ 3.71Å
198	S	41.9	Very low	45	Very low	86 Å²	86	136.5 Å²	136.5	60%	0.601	72%	0.722	S	S	*	*			trans	-70.9	131.1	175.7	-176.7	0	0	0	0	110.9	Y200	S198-Y200 PolarHBondContact O-N 3.18Å
199	I	47	Very low	44.7	Very low	163 Å²	163	135 Å²	135	84%	0.836	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71	-10.7	-176	-61.3	171.1	0	0	0	112.1
200	Y	42.3	Very low	44.2	Very low	213 Å²	213	133.3 Å²	133.3	84%	0.835	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.8	8.5	-166.7	-88.1	-80.8	0	0	0	117.1	S198	S198-Y200 PolarHBondContact O-N 3.18Å
201	T	41.1	Very low	44	Very low	116 Å²	116	135 Å²	135	71%	0.712	72%	0.718	S	S	*	*			trans	-121.2	87.6	176.4	53.1	0	0	0	0	112.2	S203	T201-S203 PolarHBondContact O-N 2.57Å
202	R	35.7	Very low	42.7	Very low	228 Å²	228	135.3 Å²	135.3	86%	0.86	72%	0.718	S	S	*	*			trans	-85.2	103.2	169	178.8	-179.6	179.6	177.2	1.9	110.1
203	S	37.5	Very low	42	Very low	115 Å²	115	136.8 Å²	136.8	80%	0.804	72%	0.724	S	S	*	*			trans	-64.6	148	160.6	-61	0	0	0	0	110.2	T201	T201-S203 PolarHBondContact O-N 2.57Å
204	V	35.9	Very low	40.5	Very low	114 Å²	114	139.1 Å²	139.1	69%	0.691	73%	0.732	S	S	*	*			trans	-115.2	155.5	178.9	-177.2	0	0	0	0	108
205	I	37.3	Very low	39.5	Very low	152 Å²	152	138.6 Å²	138.6	78%	0.779	74%	0.737	S	S	*	*			trans	89.6	106.4	-174.7	-52.8	158	0	0	0	112.7
206	D	33.2	Very low	38.3	Very low	158 Å²	158	134.7 Å²	134.7	85%	0.845	73%	0.734	S	S	*	*				-160.5	159.7	116.1	-106.1	-23.7	0	0	0	110.8
207	P	35.9	Very low	37.4	Very low	112 Å²	112	139.3 Å²	139.3	73%	0.727	76%	0.762	S	S	*	*			trans	-99.4	162.2	-166.4	37.6	-35.8	0	0	0	116.2
208	L	35.5	Very low	36.4	Very low	171 Å²	171	138.3 Å²	138.3	90%	0.895	77%	0.772	S	S	*	*			trans	-83.1	149.2	173.8	-76.6	158.3	0	0	0	113.1
209	P	38.6	Very low	36.5	Very low	112 Å²	112	139.3 Å²	139.3	73%	0.727	78%	0.776	S	S	*	*			trans	-134.1	-161.9	131.9	46.1	-34.6	0	0	0	111.1
210	P	39.3	Very low	35.7	Very low	120 Å²	120	138.9 Å²	138.9	78%	0.779	77%	0.774	S	S	*	*				-123.4	177.9	-118.5	20.8	6.4	0	0	0	116.2
211	P	45.5	Very low	35.1	Very low	120 Å²	120	133.8 Å²	133.8	78%	0.779	77%	0.769	S	S	*	*			trans	-111.1	156.2	-167.7	39.9	-33.7	0	0	0	117.6
212	T	33.3	Very low	34.4	Very low	130 Å²	130	133.4 Å²	133.4	80%	0.798	77%	0.771	S	S	*	*			trans	-141.7	137.9	159.2	51.5	0	0	0	0	108.5
213	R	33.2	Very low	34.5	Very low	215 Å²	215	127.5 Å²	127.5	81%	0.811	76%	0.763	S	S	*	*				66.1	140.4	52	-68	-168.9	172.9	-152.9	4.4	112.9
214	D	32	Very low	34	Very low	125 Å²	125	128.2 Å²	128.2	67%	0.668	76%	0.762	S	S	*	*			cis	-169.3	164.1	-3.2	-97.9	-16.8	0	0	0	106.4
215	V	32.1	Very low	33.7	Very low	126 Å²	126	130.7 Å²	130.7	76%	0.764	77%	0.766	S	S	*	*			cis	-166.3	170.3	0.3	113.5	0	0	0	0	110.2
216	A	29.1	Very low	33.2	Very low	84 Å²	84	129.6 Å²	129.6	69%	0.694	76%	0.762	S	S	*	*			trans	78	157.7	161.9	0	0	0	0	0	119.7
217	T	31	Very low	33	Very low	138 Å²	138	128 Å²	128	85%	0.847	76%	0.763	S	S	*	*			cis	-147.9	154.8	6.4	-21.1	0	0	0	0	113.4
218	S	28.1	Very low	32.6	Very low	107 Å²	107	129.5 Å²	129.5	75%	0.748	77%	0.77	S	S	*	*			trans	-110.3	-167.3	166.9	-45.9	0	0	0	0	109.7
219	P	43.8	Very low	32.3	Very low	107 Å²	107	127.7 Å²	127.7	70%	0.695	77%	0.766	S	S	*	*			cis	-142.4	-158.7	1.8	40.5	-17.2	0	0	0	115.5
220	I	29.9	Very low	32.2	Very low	154 Å²	154	128 Å²	128	79%	0.79	77%	0.769	S	S	*	*			trans	74.7	134.8	160.9	-69.8	165.8	0	0	0	116.3
221	S	29.1	Very low	32.1	Very low	106 Å²	106	128.3 Å²	128.3	74%	0.741	77%	0.77	S	S	*	*			cis	-158.8	171	-13	-99.4	0	0	0	0	112.2
222	S	26.7	Very low	31.3	Very low	107 Å²	107	128.9 Å²	128.9	75%	0.748	77%	0.767	S	S	*	*			trans	-72.9	171.8	178.2	49.9	0	0	0	0	113.9
223	P	38	Very low	31.2	Very low	105 Å²	105	130.5 Å²	130.5	68%	0.682	77%	0.768	S	S	*	*			cis	-148.8	168.3	31.2	44.4	-23.7	0	0	0	121.8
224	T	26.5	Very low	31.1	Very low	130 Å²	130	127.4 Å²	127.4	80%	0.798	77%	0.766	S	S	*	*			trans	52.6	124.6	150.7	48.2	0	0	0	0	119.8
225	E	28.9	Very low	31.2	Very low	166 Å²	166	126.5 Å²	126.5	78%	0.776	77%	0.765	S	S	*	*				-155.9	157.2	74.7	-103.3	-169.2	-155.9	0	0	116.5
226	N	27.3	Very low	31.2	Very low	129 Å²	129	131.2 Å²	131.2	69%	0.69	77%	0.769	S	S	*	*			trans	35.6	103.8	146.7	-62.2	-39.3	0	0	0	121.7
227	S	29.2	Very low	31.2	Very low	123 Å²	123	133.5 Å²	133.5	86%	0.86	77%	0.77	S	S	*	*				173.4	149.9	104.4	47.1	0	0	0	0	112.7
228	T	28.2	Very low	31.4	Very low	144 Å²	144	132.3 Å²	132.3	88%	0.883	76%	0.762	S	S	*	*			trans	-102.8	129.4	-175.9	40.8	0	0	0	0	113
229	T	29.6	Very low	31.7	Very low	133 Å²	133	135.4 Å²	135.4	82%	0.816	77%	0.765	S	S	*	*			trans	-134.7	137.1	166	42.6	0	0	0	0	110.3
230	P	36.3	Very low	31.5	Very low	119 Å²	119	139.2 Å²	139.2	77%	0.773	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-77.9	154.2	168.2	-9.8	27.3	0	0	0	111.3
231	P	36.5	Very low	31.9	Very low	126 Å²	126	140.9 Å²	140.9	82%	0.818	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-73.8	141.6	-178.2	30.1	-35.1	0	0	0	113
232	D	28.6	Very low	32.3	Very low	133 Å²	133	145.2 Å²	145.2	71%	0.711	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-79.4	128	-176.3	-169.5	5.4	0	0	0	112.5
233	M	31.6	Very low	33.2	Very low	164 Å²	164	149.1 Å²	149.1	81%	0.808	78%	0.784	S	S	*	*			trans	-97	92	173.5	-80.8	-163.5	68.9	0	0	110	V235	M233-V235 VanDerWaalsContact C-N 3.25Å; M233-V235 PolarHBondContact O-N 2.94Å
234	L	31.3	Very low	33.6	Very low	149 Å²	149	153.6 Å²	153.6	78%	0.78	79%	0.793	S	S	*	*			trans	-66.2	75.1	178.6	-67.3	173.6	0	0	0	113.2	R236	L234-R236 VanDerWaalsContact C-N 3.35Å; L234-R236 PolarHBondContact O-N 2.73Å
235	V	32.8	Very low	34.8	Very low	107 Å²	107	153.2 Å²	153.2	65%	0.648	79%	0.792	S	S	*	*			trans	-70	92.6	165.9	-179.4	0	0	0	0	108.1	M233 N237	M233-V235 VanDerWaalsContact C-N 3.25Å; M233-V235 PolarHBondContact O-N 2.94Å; V235-N237 VanDerWaalsContact C-N 3.27Å; V235-N237 PolarHBondContact O-N 2.82Å
236	R	32	Very low	36.5	Very low	225 Å²	225	151.7 Å²	151.7	85%	0.849	78%	0.783	S	S	*	*			trans	-71.8	79.3	-179.9	-167.2	178.3	-170.9	171.4	3.8	110.9	L234 T238	L234-R236 VanDerWaalsContact C-N 3.35Å; L234-R236 PolarHBondContact O-N 2.73Å; R236-T238 PolarHBondContact O-N 2.99Å
237	N	29.4	Very low	38.7	Very low	132 Å²	132	148.3 Å²	148.3	71%	0.706	76%	0.764	S	S	*	*			trans	-60.4	93.4	173.6	-86.7	-6.8	0	0	0	110.8	V235 E239	V235-N237 VanDerWaalsContact C-N 3.27Å; V235-N237 PolarHBondContact O-N 2.82Å; N237-E239 VanDerWaalsContact C-N 3.26Å; N237-E239 PolarHBondContact O-N 3.14Å
238	T	34.9	Very low	41.3	Very low	112 Å²	112	145.1 Å²	145.1	69%	0.687	74%	0.742	S	S	*	*			trans	-78.6	79.8	165.4	48.9	0	0	0	0	108.8	R236 K240	R236-T238 PolarHBondContact O-N 2.99Å; T238-K240 PolarHBondContact O-N 3.15Å
239	E	35.5	Very low	43.9	Very low	172 Å²	172	142 Å²	142	80%	0.804	72%	0.72	S	S	*	*			trans	-63.6	89.6	168.9	-69.1	-157.3	141.2	0	0	109.8	N237 Q241	N237-E239 VanDerWaalsContact C-N 3.26Å; N237-E239 PolarHBondContact O-N 3.14Å; E239-Q241 PolarHBondContact O-N 3.39Å
240	K	39.3	Very low	46.6	Very low	187 Å²	187	141 Å²	141	81%	0.813	71%	0.706	S	S	*	*			trans	-57.8	111.1	165.7	-72.2	-174.7	175.3	-174.4	0	107.3	T238 K242	T238-K240 PolarHBondContact O-N 3.15Å; K240-K242 PolarHBondContact O-N 2.74Å
241	Q	38.1	Very low	49	Very low	189 Å²	189	140.3 Å²	140.3	88%	0.883	69%	0.692	S	S	*	*			trans	-54.1	104.2	174.5	-70.1	-177.2	-5.7	0	0	109.2	E239 K243	E239-Q241 PolarHBondContact O-N 3.39Å; Q241-K243 PolarHBondContact O-N 2.79Å
242	K	37.8	Very low	51.4	Low	198 Å²	198	134.4 Å²	134.4	86%	0.861	65%	0.654	S	S	*	*			trans	-65.7	105	170.4	-74.1	-178.4	176.4	178.2	0	107.1	K240 K244	K240-K242 PolarHBondContact O-N 2.74Å; K242-K244 PolarHBondContact O-N 3.32Å; K242-K244 VanDerWaalsContact O-N 3.16Å
243	K	44.8	Very low	54.1	Low	188 Å²	188	129.6 Å²	129.6	82%	0.817	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-47.2	124.6	162.3	-69.5	176.3	179.9	172.1	0	106.4	Q241	Q241-K243 PolarHBondContact O-N 2.79Å
244	K	46.2	Very low	56.9	Low	199 Å²	199	127.9 Å²	127.9	87%	0.865	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-54.6	134.5	174.9	-73.5	-177.5	177	178.8	0	107.7	K242 K246	K242-K244 PolarHBondContact O-N 3.32Å; K242-K244 VanDerWaalsContact O-N 3.16Å; K244-K246 PolarHBondContact O-N 2.92Å
245	P	53.3	Low	59.7	Low	122 Å²	122	125.5 Å²	125.5	79%	0.792	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-57.3	142.8	176.7	25.4	-33.7	0	0	0	109.2	M247	P245-M247 PolarHBondContact O-N 2.96Å
246	K	64.9	Low	62.4	Low	134 Å²	134	120.4 Å²	120.4	58%	0.583	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-63.4	123.4	171.5	-167.8	-174.4	-175.7	-171.6	0	107	K244 P306 E309	K244-K246 PolarHBondContact O-N 2.92Å; K246-P306 PolarHBondContact NZ-O 3.47Å; K246-E309 VanDerWaalsContact CE-CD 3.45Å; K246-E309 WeakPolarHBondContact CE-OE1 3.18Å; K246-E309 WeakPolarHBondContact CE-OE2 3.38Å; K246-E309 IonicContact NZ-OE1 3.48Å; K246-E309 IonicContact NZ-OE2 3.52Å
247	M	71.9	Confident	65.2	Low	59 Å²	59	115.2 Å²	115.2	29%	0.291	55%	0.551	S	S	.	*	P	Polyproline II helix	trans	-57.7	139.7	176.5	57.9	-172.4	-48.8	0	0	110.3	P245 E251 I252 K255 E309 I312	P245-M247 PolarHBondContact O-N 2.96Å; M247-E251 HydrophobicContact CB-CB 4.46Å; M247-E251 HydrophobicContact CE-CB 4.45Å; M247-I252 HydrophobicContact CB-CG1 4.4Å; M247-I252 HydrophobicContact CE-CB 4.32Å; M247-I252 HydrophobicContact CE-CG1 3.62Å; M247-I252 HydrophobicContact CG-CD1 3.96Å; M247-I252 HydrophobicContact CG-CG1 3.57Å; M247-I252 HydrophobicContact SD-CG1 3.8Å; M247-K255 HydrophobicContact CE-CB 4.4Å; M247-E309 HydrophobicContact CG-CB 4.14Å; M247-E309 HydrophobicContact SD-CB 3.79Å; M247-I312 HydrophobicContact CE-CD1 3.93Å; M247-I312 HydrophobicContact SD-CD1 4.29Å
248	S	84.6	Confident	68.2	Low	56 Å²	56	112.8 Å²	112.8	39%	0.392	54%	0.544	S	S	.	.	P	Polyproline II helix	trans	-74.8	158.1	179.7	64.5	0	0	0	0	111.7	E250 E251 I252	S248-E250 PolarHBondContact O-N 2.83Å; S248-E251 WeakPolarHBondContact CB-OE2 3.33Å; S248-E251 PolarHBondContact N-OE2 2.84Å; S248-E251 PolarHBondContact O-N 3.3Å; S248-E251 VanDerWaalsContact O-N 3.1Å; S248-E251 VanDerWaalsContact OG-CD 3.31Å; S248-E251 WeakPolarHBondContact OG-CG 3.49Å; S248-E251 PolarHBondContact OG-OE2 3.07Å; S248-I252 VanDerWaalsContact O-CG1 3.31Å; S248-I252 WeakPolarHBondContact O-CG1 3.41Å; S248-I252 PolarHBondContact O-N 2.97Å
249	D	82	Confident	70.9	Confident	79 Å²	79	108.4 Å²	108.4	42%	0.422	52%	0.517	S	S	.	.	H	α-helix	trans	-59.2	-32	-177.9	-77	-3.4	0	0	0	113.2	I252 L253 K308	D249-I252 PolarHBondContact O-N 3.11Å; D249-L253 WeakPolarHBondContact O-CB 3.49Å; D249-L253 VanDerWaalsContact O-CG 3.29Å; D249-L253 WeakPolarHBondContact O-CG 3.48Å; D249-L253 PolarHBondContact O-N 2.7Å; D249-K308 IonicContact OD1-NZ 2.99Å; D249-K308 IonicContact OD2-NZ 3.87Å; D249-K308 PolarHBondContact OD2-NZ 2.86Å
250	E	86.2	Confident	73.7	Confident	112 Å²	112	101.2 Å²	101.2	52%	0.523	48%	0.484	S	S	.	.	H	α-helix	trans	-73.8	-39.1	176	-165.2	62.2	-119.6	0	0	112	S248 I252 L253 E254 R257	S248-E250 PolarHBondContact O-N 2.83Å; E250-I252 VanDerWaalsContact C-N 3.27Å; E250-I252 PolarHBondContact O-N 3.27Å; E250-L253 PolarHBondContact O-N 3.5Å; E250-E254 WeakPolarHBondContact O-CB 3.48Å; E250-E254 PolarHBondContact O-N 2.69Å; E250-R257 IonicContact OE1-CZ 3.26Å; E250-R257 IonicContact OE1-NH1 2.69Å; E250-R257 PolarHBondContact OE1-NH1 2.69Å; E250-R257 IonicContact OE1-NH2 2.9Å; E250-R257 PolarHBondContact OE1-NH2 3.2Å
251	E	87.8	Confident	76.3	Confident	104 Å²	104	94.6 Å²	94.6	49%	0.486	46%	0.461	S	S	.	.	H	α-helix	trans	-63.2	-34.8	171.7	-69.5	166.2	121.9	0	0	111.4	M247 S248 K255	M247-E251 HydrophobicContact CB-CB 4.46Å; M247-E251 HydrophobicContact CE-CB 4.45Å; S248-E251 WeakPolarHBondContact CB-OE2 3.33Å; S248-E251 PolarHBondContact N-OE2 2.84Å; S248-E251 PolarHBondContact O-N 3.3Å; S248-E251 VanDerWaalsContact O-N 3.1Å; S248-E251 VanDerWaalsContact OG-CD 3.31Å; S248-E251 WeakPolarHBondContact OG-CG 3.49Å; S248-E251 PolarHBondContact OG-OE2 3.07Å; E251-K255 WeakPolarHBondContact O-CB 3.31Å; E251-K255 PolarHBondContact O-N 2.81Å
252	I	85.6	Confident	79	Confident	1 Å²	1	92.9 Å²	92.9	1%	0.005	46%	0.463	C	S	.	.	H	α-helix	trans	-65.8	-48.7	173.8	-66	162.5	0	0	0	110.4	M247 S248 D249 E250 K255 L256 K308 I312	M247-I252 HydrophobicContact CB-CG1 4.4Å; M247-I252 HydrophobicContact CE-CB 4.32Å; M247-I252 HydrophobicContact CE-CG1 3.62Å; M247-I252 HydrophobicContact CG-CD1 3.96Å; M247-I252 HydrophobicContact CG-CG1 3.57Å; M247-I252 HydrophobicContact SD-CG1 3.8Å; S248-I252 VanDerWaalsContact O-CG1 3.31Å; S248-I252 WeakPolarHBondContact O-CG1 3.41Å; S248-I252 PolarHBondContact O-N 2.97Å; D249-I252 PolarHBondContact O-N 3.11Å; E250-I252 VanDerWaalsContact C-N 3.27Å; E250-I252 PolarHBondContact O-N 3.27Å; I252-K255 PolarHBondContact O-N 3.31Å; I252-L256 HydrophobicContact CG2-CD1 3.99Å; I252-L256 HydrophobicContact CG2-CG 4.49Å; I252-L256 WeakPolarHBondContact O-CB 3.3Å; I252-L256 WeakPolarHBondContact O-CG 3.47Å; I252-L256 PolarHBondContact O-N 3.43Å; I252-K308 HydrophobicContact CD1-CB 3.81Å; I252-K308 HydrophobicContact CG2-CB 3.81Å; I252-I312 HydrophobicContact CG2-CD1 4.01Å
253	L	86.8	Confident	81.5	Confident	33 Å²	33	85.7 Å²	85.7	17%	0.173	45%	0.446	C	S	.	.	H	α-helix	trans	-65.3	-38.6	178.6	-72.1	169.3	0	0	0	111.7	D249 E250 L256 R257 L302 L334	D249-L253 WeakPolarHBondContact O-CB 3.49Å; D249-L253 VanDerWaalsContact O-CG 3.29Å; D249-L253 WeakPolarHBondContact O-CG 3.48Å; D249-L253 PolarHBondContact O-N 2.7Å; E250-L253 PolarHBondContact O-N 3.5Å; L253-L256 PolarHBondContact O-N 3.03Å; L253-R257 WeakPolarHBondContact O-CB 3.46Å; L253-R257 WeakPolarHBondContact O-CG 3.44Å; L253-R257 PolarHBondContact O-N 2.74Å; L253-R257 PolarHBondContact O-NE 2.99Å; L253-L302 HydrophobicContact CD2-CD1 3.6Å; L253-L334 HydrophobicContact CD2-CD2 4.37Å
254	E	89.4	Confident	83.8	Confident	128 Å²	128	79.7 Å²	79.7	60%	0.598	42%	0.422	S	S	*	.	H	α-helix	trans	-64.7	-44	173.7	-171	167.2	-131.3	0	0	111.8	E250 L256 R257 S258	E250-E254 WeakPolarHBondContact O-CB 3.48Å; E250-E254 PolarHBondContact O-N 2.69Å; E254-L256 PolarHBondContact O-N 3.12Å; E254-R257 PolarHBondContact O-N 3.28Å; E254-S258 PolarHBondContact O-N 3.28Å
255	K	89.7	Confident	86.1	Confident	99 Å²	99	70.2 Å²	70.2	43%	0.43	38%	0.382	S	S	.	.	H	α-helix	trans	-61.4	-43.8	175.1	-169.7	67.7	173.5	-177.1	0	111.4	M247 E251 I252 S258 I259 I312	M247-K255 HydrophobicContact CE-CB 4.4Å; E251-K255 WeakPolarHBondContact O-CB 3.31Å; E251-K255 PolarHBondContact O-N 2.81Å; I252-K255 PolarHBondContact O-N 3.31Å; K255-S258 PolarHBondContact O-N 3.34Å; K255-S258 PolarHBondContact O-OG 2.77Å; K255-I259 PolarHBondContact O-N 2.88Å; K255-I312 HydrophobicContact CB-CD1 3.93Å; K255-I312 HydrophobicContact CG-CD1 3.8Å; K255-I312 HydrophobicContact CG-CG1 4.26Å; K255-I312 HydrophobicContact CG-CG2 4.07Å
256	L	89.6	Confident	88	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-61.2	-50	174.1	-74	170.5	0	0	0	111.2	I252 L253 E254 S258 I259 V260 L302 I312 I315	I252-L256 HydrophobicContact CG2-CD1 3.99Å; I252-L256 HydrophobicContact CG2-CG 4.49Å; I252-L256 WeakPolarHBondContact O-CB 3.3Å; I252-L256 WeakPolarHBondContact O-CG 3.47Å; I252-L256 PolarHBondContact O-N 3.43Å; L253-L256 PolarHBondContact O-N 3.03Å; E254-L256 PolarHBondContact O-N 3.12Å; L256-S258 PolarHBondContact O-N 3.14Å; L256-S258 VanDerWaalsContact O-N 3.1Å; L256-I259 HydrophobicContact CD2-CD1 4.43Å; L256-I259 WeakPolarHBondContact O-CG1 3.29Å; L256-I259 PolarHBondContact O-N 3.28Å; L256-V260 WeakPolarHBondContact O-CG1 3.28Å; L256-V260 WeakPolarHBondContact O-CG2 3.46Å; L256-V260 PolarHBondContact O-N 2.73Å; L256-V260 VanDerWaalsContact O-N 3.09Å; L256-L302 HydrophobicContact CD1-CD1 3.7Å; L256-L302 HydrophobicContact CD1-CD2 4.05Å; L256-I312 HydrophobicContact CD2-CG1 3.7Å; L256-I312 HydrophobicContact CG-CD1 4.49Å; L256-I312 HydrophobicContact CG-CG1 3.93Å; L256-I315 HydrophobicContact CD2-CD1 3.63Å
257	R	90.8	Very high	89.4	Confident	115 Å²	115	71.5 Å²	71.5	43%	0.434	38%	0.375	S	S	.	.	H	α-helix	trans	-56	-26.2	175.3	-72.6	177.6	-55.4	-127	5	113.2	E250 L253 E254 L334	E250-R257 IonicContact OE1-CZ 3.26Å; E250-R257 IonicContact OE1-NH1 2.69Å; E250-R257 PolarHBondContact OE1-NH1 2.69Å; E250-R257 IonicContact OE1-NH2 2.9Å; E250-R257 PolarHBondContact OE1-NH2 3.2Å; L253-R257 WeakPolarHBondContact O-CB 3.46Å; L253-R257 WeakPolarHBondContact O-CG 3.44Å; L253-R257 PolarHBondContact O-N 2.74Å; L253-R257 PolarHBondContact O-NE 2.99Å; E254-R257 PolarHBondContact O-N 3.28Å; R257-L334 HydrophobicContact CG-CD2 3.52Å
258	S	91.9	Very high	90.6	Very high	82 Å²	82	71.9 Å²	71.9	57%	0.573	38%	0.375	S	S	*	.	H	α-helix	trans	-83.3	-14.5	176.1	77.1	0	0	0	0	116	E254 K255 L256	E254-S258 PolarHBondContact O-N 3.28Å; K255-S258 PolarHBondContact O-N 3.34Å; K255-S258 PolarHBondContact O-OG 2.77Å; L256-S258 PolarHBondContact O-N 3.14Å; L256-S258 VanDerWaalsContact O-N 3.1Å
259	I	92.1	Very high	91.2	Very high	20 Å²	20	69.6 Å²	69.6	10%	0.103	36%	0.357	C	S	.	.	H	α-helix	trans	-114.8	-24	-176.2	66.6	176.9	0	0	0	114.5	K255 L256 I312 I315 L316 R319	K255-I259 PolarHBondContact O-N 2.88Å; L256-I259 HydrophobicContact CD2-CD1 4.43Å; L256-I259 WeakPolarHBondContact O-CG1 3.29Å; L256-I259 PolarHBondContact O-N 3.28Å; I259-I312 HydrophobicContact CD1-CG2 4.2Å; I259-I315 HydrophobicContact CD1-CB 4.11Å; I259-I315 HydrophobicContact CD1-CD1 3.76Å; I259-I315 HydrophobicContact CD1-CG2 4.05Å; I259-I315 HydrophobicContact CG1-CD1 4.29Å; I259-L316 HydrophobicContact CD1-CG 4.44Å; I259-L316 HydrophobicContact CG2-CD2 4.46Å; I259-R319 PolarHBondContact O-NH1 2.93Å
260	V	94.5	Very high	92	Very high	20 Å²	20	68.9 Å²	68.9	12%	0.121	36%	0.356	C	S	.	.	S	Bend	trans	-77.7	160.3	175.4	-58.2	0	0	0	0	112.2	L256 I315 L334 L339	L256-V260 WeakPolarHBondContact O-CG1 3.28Å; L256-V260 WeakPolarHBondContact O-CG2 3.46Å; L256-V260 PolarHBondContact O-N 2.73Å; L256-V260 VanDerWaalsContact O-N 3.09Å; V260-I315 HydrophobicContact CG1-CD1 4.49Å; V260-L334 HydrophobicContact CG2-CB 4.04Å; V260-L339 HydrophobicContact CG1-CD1 3.68Å
261	S	95	Very high	92.4	Very high	48 Å²	48	72.1 Å²	72.1	34%	0.336	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-73.7	142	171.8	-70.5	0	0	0	0	112	G263 D331 S332 Y333	S261-G263 PolarHBondContact O-N 3.12Å; S261-D331 WeakPolarHBondContact CB-OD1 3.13Å; S261-D331 PolarHBondContact OG-OD1 2.85Å; S261-S332 WeakPolarHBondContact CB-O 3.5Å; S261-S332 PolarHBondContact N-O 3.42Å; S261-Y333 WeakPolarHBondContact O-CD1 3.48Å
262	V	93.3	Very high	92.8	Very high	153 Å²	153	70.8 Å²	70.8	93%	0.927	36%	0.356	S	S	*	.	S	Bend	trans	-81	117.3	176	-179	0	0	0	0	109.6
263	G	91.4	Very high	93.3	Very high	47 Å²	47	77.1 Å²	77.1	49%	0.485	39%	0.386	S	S	.	.	S	Bend	trans	163	175.7	175.2	0	0	0	0	0	113	S261	S261-G263 PolarHBondContact O-N 3.12Å
264	D	92	Very high	93.7	Very high	62 Å²	62	80.7 Å²	80.7	33%	0.332	40%	0.4	S	S	.	.			trans	-103.5	106.7	171.2	173.3	7.2	0	0	0	108.5	K266 K267	D264-K266 PolarHBondContact O-N 3.07Å; D264-K266 VanDerWaalsContact O-N 3.16Å; D264-K266 WeakPolarHBondContact OD1-CB 3.28Å; D264-K266 PolarHBondContact OD1-N 2.55Å; D264-K267 HydrophobicContact CB-CD 4.09Å; D264-K267 HydrophobicContact CB-CG 4.39Å; D264-K267 PolarHBondContact O-N 3.08Å; D264-K267 VanDerWaalsContact O-N 3.08Å; D264-K267 WeakPolarHBondContact OD2-CE 3.28Å; D264-K267 IonicContact OD2-NZ 3.14Å; D264-K267 PolarHBondContact OD2-NZ 3.04Å; D264-K267 VanDerWaalsContact OD2-NZ 3.14Å
265	P	95.1	Very high	93.8	Very high	1 Å²	1	78.6 Å²	78.6	1%	0.006	39%	0.392	C	S	.	.	G	3₁₀ helix	trans	-63.6	-21.3	-176.4	25.7	-34.2	0	0	0	112.7	K267 K268 Y269 Y333 V335 W340	P265-K267 PolarHBondContact O-N 3.27Å; P265-K267 VanDerWaalsContact O-N 3.13Å; P265-K268 PolarHBondContact O-N 2.8Å; P265-Y269 HydrophobicContact CB-CD2 4.02Å; P265-Y269 HydrophobicContact CB-CE2 4.4Å; P265-Y269 WeakPolarHBondContact O-CD2 3.18Å; P265-Y269 PolarHBondContact O-N 2.63Å; P265-Y333 HydrophobicContact CB-CD1 4.38Å; P265-Y333 HydrophobicContact CB-CD2 3.81Å; P265-Y333 HydrophobicContact CB-CE2 4.19Å; P265-Y333 HydrophobicContact CB-CG 3.91Å; P265-Y333 HydrophobicContact CG-CD1 4.5Å; P265-Y333 HydrophobicContact CG-CD2 4.29Å; P265-Y333 HydrophobicContact CG-CG 3.97Å; P265-V335 HydrophobicContact CG-CG2 3.48Å; P265-V335 VanDerWaalsContact CG-CG2 3.48Å; P265-W340 HydrophobicContact CB-CE3 3.72Å; P265-W340 HydrophobicContact CB-CZ3 4Å; P265-W340 HydrophobicContact CG-CD2 3.93Å; P265-W340 HydrophobicContact CG-CE3 3.39Å; P265-W340 HydrophobicContact CG-CZ3 3.77Å
266	K	94	Very high	93.6	Very high	120 Å²	120	75.2 Å²	75.2	52%	0.522	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-69.6	-6.1	176.6	-58.7	175.9	-179.6	175.5	0	113.1	D264 W340	D264-K266 PolarHBondContact O-N 3.07Å; D264-K266 VanDerWaalsContact O-N 3.16Å; D264-K266 WeakPolarHBondContact OD1-CB 3.28Å; D264-K266 PolarHBondContact OD1-N 2.55Å; K266-W340 HydrophobicContact CD-CH2 4.17Å; K266-W340 HydrophobicContact CG-CH2 3.65Å; K266-W340 HydrophobicContact CG-CZ2 4.43Å; K266-W340 HydrophobicContact CG-CZ3 4.11Å
267	K	94.4	Very high	93.4	Very high	163 Å²	163	81 Å²	81	71%	0.709	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-102.5	-16.4	171.7	-62.9	173.5	-174.7	147.8	0	113.5	D264 P265	D264-K267 HydrophobicContact CB-CD 4.09Å; D264-K267 HydrophobicContact CB-CG 4.39Å; D264-K267 PolarHBondContact O-N 3.08Å; D264-K267 VanDerWaalsContact O-N 3.08Å; D264-K267 WeakPolarHBondContact OD2-CE 3.28Å; D264-K267 IonicContact OD2-NZ 3.14Å; D264-K267 PolarHBondContact OD2-NZ 3.04Å; D264-K267 VanDerWaalsContact OD2-NZ 3.14Å; P265-K267 PolarHBondContact O-N 3.27Å; P265-K267 VanDerWaalsContact O-N 3.13Å
268	K	96.6	Very high	92.6	Very high	67 Å²	67	77.4 Å²	77.4	29%	0.291	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-33.1	178.3	-173.1	-178.6	177.6	-157.7	0	111.9	P265 D288 V289 D331 Y333	P265-K268 PolarHBondContact O-N 2.8Å; K268-D288 WeakPolarHBondContact CE-OD2 3.3Å; K268-V289 WeakPolarHBondContact O-CB 3.34Å; K268-V289 WeakPolarHBondContact O-CG2 3.39Å; K268-V289 PolarHBondContact O-N 3.49Å; K268-D331 IonicContact NZ-OD2 3.96Å; K268-D331 PolarHBondContact NZ-OD2 3.43Å; K268-Y333 WeakPolarHBondContact CD-OH 3.2Å; K268-Y333 PolarHBondContact NZ-OH 3.48Å
269	Y	97.8	Very high	91.6	Very high	7 Å²	7	75.9 Å²	75.9	3%	0.027	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	145.1	-177	-57.7	-70.9	0	0	0	111.6	P265 F272 M287 D288 V295 I297 Y333 V342	P265-Y269 HydrophobicContact CB-CD2 4.02Å; P265-Y269 HydrophobicContact CB-CE2 4.4Å; P265-Y269 WeakPolarHBondContact O-CD2 3.18Å; P265-Y269 PolarHBondContact O-N 2.63Å; Y269-F272 WeakPolarHBondContact O-CE2 3.35Å; Y269-M287 CarbonylContact C-O 3.58Å; Y269-M287 WeakPolarHBondContact CA-O 3.42Å; Y269-D288 HydrophobicContact CD1-CB 4.03Å; Y269-D288 HydrophobicContact CE1-CB 3.79Å; Y269-D288 WeakPolarHBondContact CE1-OD2 3.44Å; Y269-V295 HydrophobicContact CD1-CG2 3.71Å; Y269-V295 HydrophobicContact CE1-CG2 3.71Å; Y269-I297 HydrophobicContact CD1-CD1 4.19Å; Y269-I297 HydrophobicContact CD2-CD1 3.84Å; Y269-I297 HydrophobicContact CE2-CD1 4.43Å; Y269-I297 HydrophobicContact CG-CD1 3.71Å; Y269-Y333 AromaticContact CE2-CE2 3.96Å; Y269-Y333 HydrophobicContact CE2-CE2 3.96Å; Y269-V342 HydrophobicContact CE1-CG1 4.23Å; Y269-V342 HydrophobicContact CE2-CG1 4.44Å; Y269-V342 HydrophobicContact CE2-CG2 3.91Å
270	T	97.1	Very high	90.9	Very high	64 Å²	64	76 Å²	76	39%	0.393	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	175.6	179.4	-170.4	0	0	0	0	111.1	A286 M287 V289	T270-A286 CarbonylContact O-C 3.57Å; T270-A286 WeakPolarHBondContact O-CA 3.48Å; T270-M287 HydrophobicContact CG2-CB 4.24Å; T270-M287 PolarHBondContact N-O 2.68Å; T270-M287 PolarHBondContact O-N 3.09Å; T270-V289 HydrophobicContact CG2-CG2 3.71Å
271	R	95.1	Very high	90.5	Very high	180 Å²	180	75.7 Å²	75.7	68%	0.679	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	52.8	55.4	-179.4	-60.8	176.2	179.4	176	-0.4	113.1	E273	R271-E273 PolarHBondContact O-N 3Å
272	F	96.8	Very high	90.3	Very high	77 Å²	77	74.5 Å²	74.5	34%	0.338	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	116	175.9	-66.5	-92.8	0	0	0	110.9	Y269 Y284 T285 A286 I297 W340	Y269-F272 WeakPolarHBondContact O-CE2 3.35Å; F272-Y284 HydrophobicContact CB-CD1 4.43Å; F272-T285 WeakPolarHBondContact CA-O 3.45Å; F272-A286 HydrophobicContact CD1-CB 4.01Å; F272-A286 HydrophobicContact CE1-CB 4.04Å; F272-A286 HydrophobicContact CG-CB 4.47Å; F272-I297 HydrophobicContact CE1-CD1 3.87Å; F272-W340 AromaticContact CE1-CH2 3.95Å; F272-W340 HydrophobicContact CE1-CH2 3.95Å; F272-W340 AromaticContact CE1-CZ3 3.55Å; F272-W340 HydrophobicContact CE1-CZ3 3.55Å; F272-W340 HydrophobicContact CZ-CH2 4.08Å; F272-W340 AromaticContact CZ-CZ3 3.69Å; F272-W340 HydrophobicContact CZ-CZ3 3.69Å
273	E	96.3	Very high	90.4	Very high	134 Å²	134	69 Å²	69	63%	0.626	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.1	133.4	174.3	172.8	170.6	-156.2	0	0	109.4	R271 I275 Y284 T285	R271-E273 PolarHBondContact O-N 3Å; E273-I275 PolarHBondContact O-N 2.74Å; E273-Y284 CarbonylContact O-C 3.59Å; E273-Y284 WeakPolarHBondContact O-CA 3.2Å; E273-Y284 WeakPolarHBondContact O-CB 3.44Å; E273-T285 PolarHBondContact N-O 3.42Å; E273-T285 VanDerWaalsContact N-O 3.1Å; E273-T285 PolarHBondContact O-N 3.31Å; E273-T285 PolarHBondContact O-OG1 3.1Å
274	K	95.3	Very high	90.6	Very high	107 Å²	107	69.4 Å²	69.4	47%	0.465	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	107.2	-173.5	176.8	172.8	171.5	160.1	0	110.4	T282 Y284	K274-T282 HydrophobicContact CD-CG2 3.63Å; K274-T282 HydrophobicContact CG-CG2 3.77Å; K274-Y284 HydrophobicContact CB-CD1 3.86Å; K274-Y284 HydrophobicContact CB-CE1 3.79Å; K274-Y284 HydrophobicContact CG-CE1 4.35Å
275	I	90.8	Very high	90.9	Very high	85 Å²	85	66.6 Å²	66.6	44%	0.436	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	-20.4	178.8	61.4	165.5	0	0	0	113.9	E273 V283 T285 Y345	E273-I275 PolarHBondContact O-N 2.74Å; I275-V283 HydrophobicContact CD1-CG1 3.93Å; I275-V283 HydrophobicContact CG1-CB 4.24Å; I275-V283 HydrophobicContact CG1-CG1 3.95Å; I275-V283 PolarHBondContact N-O 2.78Å; I275-T285 HydrophobicContact CD1-CG2 4.23Å; I275-T285 HydrophobicContact CG2-CG2 3.86Å; I275-Y345 HydrophobicContact CD1-CD2 4.39Å; I275-Y345 HydrophobicContact CD1-CE2 4.01Å
276	G	85.8	Confident	91	Very high	28 Å²	28	66.7 Å²	66.7	29%	0.289	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.3	166.3	-179.2	0	0	0	0	0	114.8	T282 V283	G276-T282 WeakPolarHBondContact O-CG2 3.48Å; G276-V283 PolarHBondContact N-O 3.44Å; G276-V283 VanDerWaalsContact N-O 3.15Å; G276-V283 PolarHBondContact O-N 3Å
277	Q	84.6	Confident	91.2	Very high	120 Å²	120	63.6 Å²	63.6	56%	0.561	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.9	110.1	170.6	-178.9	174.6	-13.2	0	0	109.4
278	G	75	Confident	91.3	Very high	41 Å²	41	56.5 Å²	56.5	42%	0.423	30%	0.296	S	S	.	.			trans	-107.4	-175	-176.7	0	0	0	0	0	113	S280 G281	G278-S280 PolarHBondContact O-N 2.87Å; G278-S280 VanDerWaalsContact O-N 3.09Å; G278-G281 PolarHBondContact N-O 3.26Å; G278-G281 PolarHBondContact O-N 3.21Å
279	A	70.9	Confident	91.3	Very high	50 Å²	50	57.9 Å²	57.9	41%	0.413	31%	0.31	S	S	.	.	S	Bend	trans	-62.1	-17.9	-176.1	0	0	0	0	0	115	K141	K141-A279 WeakPolarHBondContact CE-O 3.34Å; K141-A279 PolarHBondContact NZ-O 2.9Å
280	S	77.9	Confident	91.2	Very high	21 Å²	21	62 Å²	62	15%	0.147	35%	0.345	C	S	.	.	S	Bend	trans	-107.1	-24.5	179.7	-167	0	0	0	0	113.4	G278 M300 Q305	G278-S280 PolarHBondContact O-N 2.87Å; G278-S280 VanDerWaalsContact O-N 3.09Å; S280-M300 WeakPolarHBondContact O-CG 3.5Å; S280-M300 PolarHBondContact OG-SD 3.11Å; S280-Q305 PolarHBondContact O-NE2 3.09Å
281	G	85.3	Confident	91.1	Very high	15 Å²	15	63.5 Å²	63.5	16%	0.155	35%	0.354	C	S	.	.			trans	174.5	-173.9	-172.7	0	0	0	0	0	114.5	G278 Q299	G278-G281 PolarHBondContact N-O 3.26Å; G278-G281 PolarHBondContact O-N 3.21Å; G281-Q299 CarbonylContact C-O 3.41Å; G281-Q299 WeakPolarHBondContact CA-O 3.18Å
282	T	91.4	Very high	91.1	Very high	23 Å²	23	57 Å²	57	14%	0.141	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	136.9	176.5	-58.6	0	0	0	0	110.1	K274 G276 Y284 Q299	K274-T282 HydrophobicContact CD-CG2 3.63Å; K274-T282 HydrophobicContact CG-CG2 3.77Å; G276-T282 WeakPolarHBondContact O-CG2 3.48Å; T282-Y284 HydrophobicContact CG2-CD2 4.07Å; T282-Y284 HydrophobicContact CG2-CE1 4.24Å; T282-Y284 HydrophobicContact CG2-CE2 3.38Å; T282-Y284 VanDerWaalsContact CG2-CZ 3.49Å; T282-Q299 PolarHBondContact N-O 2.86Å; T282-Q299 PolarHBondContact O-N 3.22Å
283	V	94.2	Very high	91	Very high	37 Å²	37	58 Å²	58	22%	0.224	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	131.7	178.3	-170.9	0	0	0	0	109.6	I275 G276 A296 I297 K298	I275-V283 HydrophobicContact CD1-CG1 3.93Å; I275-V283 HydrophobicContact CG1-CB 4.24Å; I275-V283 HydrophobicContact CG1-CG1 3.95Å; I275-V283 PolarHBondContact N-O 2.78Å; G276-V283 PolarHBondContact N-O 3.44Å; G276-V283 VanDerWaalsContact N-O 3.15Å; G276-V283 PolarHBondContact O-N 3Å; V283-A296 HydrophobicContact CG1-CB 4.41Å; V283-I297 WeakPolarHBondContact CA-O 3.43Å; V283-K298 HydrophobicContact CG2-CB 4.38Å; V283-K298 HydrophobicContact CG2-CG 4.26Å
284	Y	96.8	Very high	91.1	Very high	55 Å²	55	56 Å²	56	22%	0.216	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	144.6	177.3	-58.2	-99.6	0	0	0	110.5	F272 E273 K274 T282 A296 I297 Q299	F272-Y284 HydrophobicContact CB-CD1 4.43Å; E273-Y284 CarbonylContact O-C 3.59Å; E273-Y284 WeakPolarHBondContact O-CA 3.2Å; E273-Y284 WeakPolarHBondContact O-CB 3.44Å; K274-Y284 HydrophobicContact CB-CD1 3.86Å; K274-Y284 HydrophobicContact CB-CE1 3.79Å; K274-Y284 HydrophobicContact CG-CE1 4.35Å; T282-Y284 HydrophobicContact CG2-CD2 4.07Å; T282-Y284 HydrophobicContact CG2-CE1 4.24Å; T282-Y284 HydrophobicContact CG2-CE2 3.38Å; T282-Y284 VanDerWaalsContact CG2-CZ 3.49Å; Y284-A296 CarbonylContact O-C 3.55Å; Y284-A296 WeakPolarHBondContact O-CA 3.46Å; Y284-I297 PolarHBondContact N-O 3.25Å; Y284-I297 PolarHBondContact O-N 3.25Å; Y284-Q299 HydrophobicContact CD2-CG 3.98Å; Y284-Q299 HydrophobicContact CE2-CB 4.23Å; Y284-Q299 HydrophobicContact CE2-CG 3.93Å
285	T	97.3	Very high	91.2	Very high	4 Å²	4	51 Å²	51	3%	0.025	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	150.5	153	38.3	0	0	0	0	109.3	F272 E273 I275 E294 V295 Y345	F272-T285 WeakPolarHBondContact CA-O 3.45Å; E273-T285 PolarHBondContact N-O 3.42Å; E273-T285 VanDerWaalsContact N-O 3.1Å; E273-T285 PolarHBondContact O-N 3.31Å; E273-T285 PolarHBondContact O-OG1 3.1Å; I275-T285 HydrophobicContact CD1-CG2 4.23Å; I275-T285 HydrophobicContact CG2-CG2 3.86Å; T285-E294 HydrophobicContact CG2-CG 4.48Å; T285-V295 CarbonylContact C-O 3.25Å; T285-V295 WeakPolarHBondContact CA-O 3.42Å; T285-Y345 HydrophobicContact CG2-CD1 3.96Å; T285-Y345 HydrophobicContact CG2-CD2 3.73Å; T285-Y345 HydrophobicContact CG2-CE1 3.68Å; T285-Y345 HydrophobicContact CG2-CE2 3.5Å; T285-Y345 VanDerWaalsContact CG2-CE2 3.5Å; T285-Y345 HydrophobicContact CG2-CG 3.96Å; T285-Y345 VanDerWaalsContact CG2-CZ 3.44Å
286	A	97.9	Very high	91.5	Very high	3 Å²	3	47.3 Å²	47.3	3%	0.025	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	164.5	168.4	0	0	0	0	0	110	T270 F272 E294 V295 I297	T270-A286 CarbonylContact O-C 3.57Å; T270-A286 WeakPolarHBondContact O-CA 3.48Å; F272-A286 HydrophobicContact CD1-CB 4.01Å; F272-A286 HydrophobicContact CE1-CB 4.04Å; F272-A286 HydrophobicContact CG-CB 4.47Å; A286-E294 WeakPolarHBondContact O-CA 3.39Å; A286-V295 HydrophobicContact CB-CG2 4.31Å; A286-V295 PolarHBondContact N-O 3.17Å; A286-V295 WeakPolarHBondContact O-CG2 3.38Å; A286-V295 PolarHBondContact O-N 2.89Å; A286-I297 HydrophobicContact CB-CD1 3.69Å; A286-I297 HydrophobicContact CB-CG1 4.31Å
287	M	97.7	Very high	92	Very high	54 Å²	54	46 Å²	46	27%	0.266	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	126.8	176.7	-177.5	167	-80.6	0	0	110.2	Y269 T270 V289 Q293	Y269-M287 CarbonylContact C-O 3.58Å; Y269-M287 WeakPolarHBondContact CA-O 3.42Å; T270-M287 HydrophobicContact CG2-CB 4.24Å; T270-M287 PolarHBondContact N-O 2.68Å; T270-M287 PolarHBondContact O-N 3.09Å; M287-V289 PolarHBondContact O-N 3.24Å; M287-Q293 WeakPolarHBondContact CA-O 3.19Å
288	D	97.2	Very high	92.4	Very high	15 Å²	15	41 Å²	41	8%	0.08	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	124.8	171.5	-171	-63.8	0	0	0	109.7	K268 Y269 A290 T291 G292 Q293	K268-D288 WeakPolarHBondContact CE-OD2 3.3Å; Y269-D288 HydrophobicContact CD1-CB 4.03Å; Y269-D288 HydrophobicContact CE1-CB 3.79Å; Y269-D288 WeakPolarHBondContact CE1-OD2 3.44Å; D288-A290 VanDerWaalsContact C-N 3.28Å; D288-A290 PolarHBondContact O-N 2.94Å; D288-A290 WeakPolarHBondContact OD1-CB 3.44Å; D288-A290 PolarHBondContact OD1-N 2.77Å; D288-T291 WeakPolarHBondContact CB-OG1 3.11Å; D288-T291 PolarHBondContact OD1-N 2.93Å; D288-G292 VanDerWaalsContact O-CA 3.28Å; D288-G292 WeakPolarHBondContact O-CA 3.46Å; D288-G292 PolarHBondContact O-N 3.38Å; D288-Q293 PolarHBondContact N-O 2.86Å
289	V	96	Very high	93.3	Very high	95 Å²	95	40.3 Å²	40.3	58%	0.576	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-23.5	-173.5	175	0	0	0	0	112.3	K268 T270 M287	K268-V289 WeakPolarHBondContact O-CB 3.34Å; K268-V289 WeakPolarHBondContact O-CG2 3.39Å; K268-V289 PolarHBondContact O-N 3.49Å; T270-V289 HydrophobicContact CG2-CG2 3.71Å; M287-V289 PolarHBondContact O-N 3.24Å
290	A	95.9	Very high	94.3	Very high	94 Å²	94	37.9 Å²	37.9	78%	0.777	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-33.5	-178.2	0	0	0	0	0	113.1	D288	D288-A290 VanDerWaalsContact C-N 3.28Å; D288-A290 PolarHBondContact O-N 2.94Å; D288-A290 WeakPolarHBondContact OD1-CB 3.44Å; D288-A290 PolarHBondContact OD1-N 2.77Å
291	T	95.6	Very high	94.8	Very high	95 Å²	95	39 Å²	39	58%	0.583	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-106.3	-18.3	-177.7	65.9	0	0	0	0	114.2	D288 Q293	D288-T291 WeakPolarHBondContact CB-OG1 3.11Å; D288-T291 PolarHBondContact OD1-N 2.93Å; T291-Q293 PolarHBondContact O-N 3.29Å; T291-Q293 WeakPolarHBondContact OG1-CB 3.35Å; T291-Q293 PolarHBondContact OG1-N 3.25Å; T291-Q293 VanDerWaalsContact OG1-N 3.17Å
292	G	94.6	Very high	94.9	Very high	45 Å²	45	38.5 Å²	38.5	46%	0.464	23%	0.228	S	C	.	.			trans	71.7	4.4	-169.1	0	0	0	0	0	114.1	D288	D288-G292 VanDerWaalsContact O-CA 3.28Å; D288-G292 WeakPolarHBondContact O-CA 3.46Å; D288-G292 PolarHBondContact O-N 3.38Å
293	Q	95.1	Very high	94.6	Very high	96 Å²	96	41.8 Å²	41.8	45%	0.449	24%	0.242	S	C	.	.			trans	-71.2	136.4	-179.2	-176.5	177.5	-1.4	0	0	111.2	M287 D288 T291 V295	M287-Q293 WeakPolarHBondContact CA-O 3.19Å; D288-Q293 PolarHBondContact N-O 2.86Å; T291-Q293 PolarHBondContact O-N 3.29Å; T291-Q293 WeakPolarHBondContact OG1-CB 3.35Å; T291-Q293 PolarHBondContact OG1-N 3.25Å; T291-Q293 VanDerWaalsContact OG1-N 3.17Å; Q293-V295 HydrophobicContact CG-CG1 4.3Å
294	E	96.9	Very high	94.1	Very high	92 Å²	92	46.5 Å²	46.5	43%	0.43	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	133.9	169.5	-164.2	171.6	-154	0	0	110.8	T285 A286 Y345	T285-E294 HydrophobicContact CG2-CG 4.48Å; A286-E294 WeakPolarHBondContact O-CA 3.39Å; E294-Y345 HydrophobicContact CB-CD1 4.26Å; E294-Y345 VanDerWaalsContact CD-CE1 3.43Å; E294-Y345 HydrophobicContact CG-CD1 3.56Å; E294-Y345 HydrophobicContact CG-CE1 4.15Å; E294-Y345 HydrophobicContact CG-CG 4.3Å; E294-Y345 WeakPolarHBondContact OE2-CD1 3.4Å; E294-Y345 WeakPolarHBondContact OE2-CE1 3.44Å
295	V	97.8	Very high	93.2	Very high	2 Å²	2	45.1 Å²	45.1	1%	0.012	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	153.7	-174.4	-62.3	0	0	0	0	110.6	Y269 T285 A286 Q293 I297 L330 V342	Y269-V295 HydrophobicContact CD1-CG2 3.71Å; Y269-V295 HydrophobicContact CE1-CG2 3.71Å; T285-V295 CarbonylContact C-O 3.25Å; T285-V295 WeakPolarHBondContact CA-O 3.42Å; A286-V295 HydrophobicContact CB-CG2 4.31Å; A286-V295 PolarHBondContact N-O 3.17Å; A286-V295 WeakPolarHBondContact O-CG2 3.38Å; A286-V295 PolarHBondContact O-N 2.89Å; Q293-V295 HydrophobicContact CG-CG1 4.3Å; V295-I297 HydrophobicContact CG2-CD1 4.2Å; V295-I297 HydrophobicContact CG2-CG1 4.13Å; V295-L330 HydrophobicContact CB-CD1 4.3Å; V295-L330 HydrophobicContact CG1-CD1 3.55Å; V295-V342 HydrophobicContact CB-CG1 3.94Å; V295-V342 HydrophobicContact CG1-CG1 4.36Å; V295-V342 HydrophobicContact CG2-CG1 3.92Å
296	A	97.3	Very high	92	Very high	8 Å²	8	48.1 Å²	48.1	7%	0.066	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	137.4	170.5	0	0	0	0	0	110.1	V283 Y284 V342 M343 Y345	V283-A296 HydrophobicContact CG1-CB 4.41Å; Y284-A296 CarbonylContact O-C 3.55Å; Y284-A296 WeakPolarHBondContact O-CA 3.46Å; A296-V342 WeakPolarHBondContact O-CA 3.35Å; A296-M343 HydrophobicContact CB-CG 3.77Å; A296-M343 HydrophobicContact CB-SD 4.46Å; A296-M343 PolarHBondContact N-O 2.66Å; A296-M343 PolarHBondContact O-N 3.47Å; A296-Y345 HydrophobicContact CB-CD2 4.47Å
297	I	96.3	Very high	90.9	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	109	-177.3	-55.7	-173.8	0	0	0	109.3	Y269 F272 V283 Y284 A286 V295 Q299 W340 V341 V342	Y269-I297 HydrophobicContact CD1-CD1 4.19Å; Y269-I297 HydrophobicContact CD2-CD1 3.84Å; Y269-I297 HydrophobicContact CE2-CD1 4.43Å; Y269-I297 HydrophobicContact CG-CD1 3.71Å; F272-I297 HydrophobicContact CE1-CD1 3.87Å; V283-I297 WeakPolarHBondContact CA-O 3.43Å; Y284-I297 PolarHBondContact N-O 3.25Å; Y284-I297 PolarHBondContact O-N 3.25Å; A286-I297 HydrophobicContact CB-CD1 3.69Å; A286-I297 HydrophobicContact CB-CG1 4.31Å; V295-I297 HydrophobicContact CG2-CD1 4.2Å; V295-I297 HydrophobicContact CG2-CG1 4.13Å; I297-Q299 HydrophobicContact CG2-CG 4.16Å; I297-W340 HydrophobicContact CG2-CB 4.27Å; I297-W340 HydrophobicContact CG2-CD2 4.33Å; I297-W340 HydrophobicContact CG2-CE3 3.88Å; I297-V341 CarbonylContact C-O 3.56Å; I297-V341 WeakPolarHBondContact CA-O 3.36Å; I297-V342 HydrophobicContact CD1-CG2 4.3Å; I297-V342 HydrophobicContact CG1-CG1 4.17Å; I297-V342 HydrophobicContact CG1-CG2 4.15Å
298	K	93.9	Very high	90	Very high	17 Å²	17	50.7 Å²	50.7	7%	0.074	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	107.4	176.1	-175	-179.4	-178.8	-174.2	0	108.8	V283 M300 E314 W340 V341 M343 D406	V283-K298 HydrophobicContact CG2-CB 4.38Å; V283-K298 HydrophobicContact CG2-CG 4.26Å; K298-M300 HydrophobicContact CD-CE 4.12Å; K298-M300 HydrophobicContact CD-SD 3.98Å; K298-M300 HydrophobicContact CG-CE 4.13Å; K298-M300 HydrophobicContact CG-CG 4.02Å; K298-M300 HydrophobicContact CG-SD 4.1Å; K298-E314 IonicContact NZ-OE1 2.79Å; K298-E314 PolarHBondContact NZ-OE1 2.72Å; K298-E314 IonicContact NZ-OE2 2.73Å; K298-W340 WeakPolarHBondContact O-CA 3.47Å; K298-V341 PolarHBondContact N-O 2.61Å; K298-V341 PolarHBondContact O-N 3.43Å; K298-M343 HydrophobicContact CB-CE 3.71Å; K298-M343 HydrophobicContact CD-CE 4.45Å; K298-D406 IonicContact NZ-OD1 3.5Å; K298-D406 PolarHBondContact NZ-OD1 3.42Å
299	Q	93.7	Very high	89	Confident	25 Å²	25	52.2 Å²	52.2	12%	0.117	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	117	178.5	-61.3	179.7	2.7	0	0	109.8	G281 T282 Y284 I297 W340	G281-Q299 CarbonylContact C-O 3.41Å; G281-Q299 WeakPolarHBondContact CA-O 3.18Å; T282-Q299 PolarHBondContact N-O 2.86Å; T282-Q299 PolarHBondContact O-N 3.22Å; Y284-Q299 HydrophobicContact CD2-CG 3.98Å; Y284-Q299 HydrophobicContact CE2-CB 4.23Å; Y284-Q299 HydrophobicContact CE2-CG 3.93Å; I297-Q299 HydrophobicContact CG2-CG 4.16Å; Q299-W340 HydrophobicContact CG-CD2 3.9Å; Q299-W340 HydrophobicContact CG-CG 4Å; Q299-W340 HydrophobicContact CG-CZ2 4.25Å; Q299-W340 VanDerWaalsContact NE2-CH2 3.31Å
300	M	90.6	Very high	88.2	Confident	0 Å²	0	50 Å²	50	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	109.3	-173.8	-63.2	174.3	-82.5	0	0	109.5	S280 K298 L302 E338 L339 V341	S280-M300 WeakPolarHBondContact O-CG 3.5Å; S280-M300 PolarHBondContact OG-SD 3.11Å; K298-M300 HydrophobicContact CD-CE 4.12Å; K298-M300 HydrophobicContact CD-SD 3.98Å; K298-M300 HydrophobicContact CG-CE 4.13Å; K298-M300 HydrophobicContact CG-CG 4.02Å; K298-M300 HydrophobicContact CG-SD 4.1Å; M300-L302 PolarHBondContact O-N 3.44Å; M300-E338 WeakPolarHBondContact O-CA 3.47Å; M300-L339 HydrophobicContact CE-CD2 3.72Å; M300-L339 HydrophobicContact CE-CG 4.21Å; M300-L339 PolarHBondContact N-O 3.15Å; M300-L339 PolarHBondContact O-N 3.29Å; M300-V341 HydrophobicContact CE-CB 4.13Å; M300-V341 HydrophobicContact CE-CG2 3.48Å; M300-V341 VanDerWaalsContact CE-CG2 3.48Å
301	N	89.8	Confident	87.5	Confident	45 Å²	45	45.8 Å²	45.8	24%	0.241	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	119.1	171.6	-179.5	-64.1	0	0	0	108.7	Q303 Q304 Q305	N301-Q303 PolarHBondContact OD1-N 3.26Å; N301-Q304 HydrophobicContact CB-CB 4.44Å; N301-Q304 HydrophobicContact CB-CG 4.28Å; N301-Q304 PolarHBondContact O-N 3.13Å; N301-Q304 PolarHBondContact OD1-N 3.23Å; N301-Q305 WeakPolarHBondContact O-CG 3.15Å; N301-Q305 PolarHBondContact O-NE2 3.25Å; N301-Q305 VanDerWaalsContact O-NE2 3.12Å
302	L	86.8	Confident	86.8	Confident	4 Å²	4	41.7 Å²	41.7	2%	0.021	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-70.7	-33.3	-173.3	-65.4	177.4	0	0	0	112.7	L253 L256 M300 Q304 Q305 K308 I311 L334 E337 L339	L253-L302 HydrophobicContact CD2-CD1 3.6Å; L256-L302 HydrophobicContact CD1-CD1 3.7Å; L256-L302 HydrophobicContact CD1-CD2 4.05Å; M300-L302 PolarHBondContact O-N 3.44Å; L302-Q304 PolarHBondContact O-N 2.97Å; L302-Q305 PolarHBondContact O-N 2.89Å; L302-Q305 VanDerWaalsContact O-N 3.14Å; L302-K308 WeakPolarHBondContact O-CE 3.24Å; L302-I311 HydrophobicContact CD2-CD1 3.44Å; L302-I311 VanDerWaalsContact CD2-CD1 3.44Å; L302-L334 HydrophobicContact CD1-CD1 3.56Å; L302-E337 VanDerWaalsContact CB-O 3.28Å; L302-E337 WeakPolarHBondContact CB-O 3.28Å; L302-E337 VanDerWaalsContact CG-O 3.28Å; L302-E337 WeakPolarHBondContact CG-O 3.2Å; L302-E337 PolarHBondContact N-O 3.2Å; L302-L339 HydrophobicContact CD2-CB 3.95Å; L302-L339 HydrophobicContact CG-CB 4.42Å
303	Q	84.6	Confident	86	Confident	92 Å²	92	43.2 Å²	43.2	43%	0.43	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	-67.2	-24.1	-180	-60.8	-64	6.5	0	0	112.8	N301 Q305 E337	N301-Q303 PolarHBondContact OD1-N 3.26Å; Q303-Q305 VanDerWaalsContact C-N 3.3Å; Q303-Q305 PolarHBondContact O-N 3.24Å; Q303-E337 VanDerWaalsContact CG-OE2 3.24Å; Q303-E337 WeakPolarHBondContact CG-OE2 3.11Å; Q303-E337 PolarHBondContact NE2-OE1 2.98Å
304	Q	83.6	Confident	85.3	Confident	136 Å²	136	39 Å²	39	64%	0.636	19%	0.193	S	C	*	.	G	3₁₀ helix	trans	-82.2	-2.5	176.2	-66.1	174.7	-0.2	0	0	113.6	N301 L302	N301-Q304 HydrophobicContact CB-CB 4.44Å; N301-Q304 HydrophobicContact CB-CG 4.28Å; N301-Q304 PolarHBondContact O-N 3.13Å; N301-Q304 PolarHBondContact OD1-N 3.23Å; L302-Q304 PolarHBondContact O-N 2.97Å
305	Q	79.3	Confident	84.8	Confident	25 Å²	25	34.7 Å²	34.7	12%	0.117	17%	0.173	C	C	.	.			trans	-95.3	118.1	-176.3	-50.9	-57.6	-31.2	0	0	111.5	S280 N301 L302 Q303 K307 K308 I311	S280-Q305 PolarHBondContact O-NE2 3.09Å; N301-Q305 WeakPolarHBondContact O-CG 3.15Å; N301-Q305 PolarHBondContact O-NE2 3.25Å; N301-Q305 VanDerWaalsContact O-NE2 3.12Å; L302-Q305 PolarHBondContact O-N 2.89Å; L302-Q305 VanDerWaalsContact O-N 3.14Å; Q303-Q305 VanDerWaalsContact C-N 3.3Å; Q303-Q305 PolarHBondContact O-N 3.24Å; Q305-K307 PolarHBondContact O-N 3.24Å; Q305-K308 HydrophobicContact CB-CG 4.18Å; Q305-K308 WeakPolarHBondContact O-CG 3.49Å; Q305-I311 HydrophobicContact CB-CD1 3.9Å; Q305-I311 HydrophobicContact CG-CD1 3.66Å
306	P	70.4	Confident	84.2	Confident	67 Å²	67	36.9 Å²	36.9	44%	0.435	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-18.1	-177	27.8	-35.3	0	0	0	113.4	K246	K246-P306 PolarHBondContact NZ-O 3.47Å
307	K	75.6	Confident	83.6	Confident	91 Å²	91	36.9 Å²	36.9	40%	0.396	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-138.2	70.7	179.1	-64.7	-178	-175.4	169.5	0	110.2	Q305 E309 L310	Q305-K307 PolarHBondContact O-N 3.24Å; K307-E309 WeakPolarHBondContact CA-OE2 3.37Å; K307-E309 HydrophobicContact CB-CG 4.49Å; K307-E309 PolarHBondContact O-N 3.38Å; K307-L310 HydrophobicContact CB-CD1 3.85Å; K307-L310 HydrophobicContact CB-CG 3.92Å; K307-L310 HydrophobicContact CD-CD1 4.02Å; K307-L310 PolarHBondContact O-N 2.82Å
308	K	78.6	Confident	83.1	Confident	21 Å²	21	37.1 Å²	37.1	9%	0.091	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-25.4	-179.8	-51.9	176.5	-175.9	177.9	0	112.5	D249 I252 L302 Q305 L310 I311	D249-K308 IonicContact OD1-NZ 2.99Å; D249-K308 IonicContact OD2-NZ 3.87Å; D249-K308 PolarHBondContact OD2-NZ 2.86Å; I252-K308 HydrophobicContact CD1-CB 3.81Å; I252-K308 HydrophobicContact CG2-CB 3.81Å; L302-K308 WeakPolarHBondContact O-CE 3.24Å; Q305-K308 HydrophobicContact CB-CG 4.18Å; Q305-K308 WeakPolarHBondContact O-CG 3.49Å; K308-L310 VanDerWaalsContact C-N 3.27Å; K308-L310 PolarHBondContact O-N 3.12Å; K308-I311 HydrophobicContact CB-CD1 4.28Å; K308-I311 WeakPolarHBondContact O-CB 3.18Å; K308-I311 WeakPolarHBondContact O-CG1 3.34Å; K308-I311 PolarHBondContact O-N 3.18Å
309	E	76.8	Confident	82.8	Confident	46 Å²	46	42.3 Å²	42.3	22%	0.215	20%	0.204	C	C	.	.	H	α-helix	trans	-61.3	-25.2	173.7	67.1	-88.7	-156.3	0	0	114.9	K246 M247 K307	K246-E309 VanDerWaalsContact CE-CD 3.45Å; K246-E309 WeakPolarHBondContact CE-OE1 3.18Å; K246-E309 WeakPolarHBondContact CE-OE2 3.38Å; K246-E309 IonicContact NZ-OE1 3.48Å; K246-E309 IonicContact NZ-OE2 3.52Å; M247-E309 HydrophobicContact CG-CB 4.14Å; M247-E309 HydrophobicContact SD-CB 3.79Å; K307-E309 WeakPolarHBondContact CA-OE2 3.37Å; K307-E309 HydrophobicContact CB-CG 4.49Å; K307-E309 PolarHBondContact O-N 3.38Å
310	L	78.1	Confident	82.5	Confident	49 Å²	49	47.1 Å²	47.1	26%	0.257	23%	0.226	S	C	.	.	H	α-helix	trans	-74.6	-28	179	-64.5	179.7	0	0	0	112.6	K307 K308 I312 N313 E314	K307-L310 HydrophobicContact CB-CD1 3.85Å; K307-L310 HydrophobicContact CB-CG 3.92Å; K307-L310 HydrophobicContact CD-CD1 4.02Å; K307-L310 PolarHBondContact O-N 2.82Å; K308-L310 VanDerWaalsContact C-N 3.27Å; K308-L310 PolarHBondContact O-N 3.12Å; L310-I312 VanDerWaalsContact C-N 3.3Å; L310-I312 PolarHBondContact O-N 3.22Å; L310-N313 WeakPolarHBondContact O-CA 3.48Å; L310-N313 WeakPolarHBondContact O-CB 3.44Å; L310-N313 PolarHBondContact O-N 3.17Å; L310-E314 PolarHBondContact O-N 3.42Å
311	I	81.8	Confident	82.3	Confident	6 Å²	6	47.5 Å²	47.5	3%	0.031	23%	0.229	C	C	.	.	H	α-helix	trans	-68.2	-33.8	-175.7	-45.1	168.9	0	0	0	110.9	L302 Q305 K308 N313 E314 I315 L339	L302-I311 HydrophobicContact CD2-CD1 3.44Å; L302-I311 VanDerWaalsContact CD2-CD1 3.44Å; Q305-I311 HydrophobicContact CB-CD1 3.9Å; Q305-I311 HydrophobicContact CG-CD1 3.66Å; K308-I311 HydrophobicContact CB-CD1 4.28Å; K308-I311 WeakPolarHBondContact O-CB 3.18Å; K308-I311 WeakPolarHBondContact O-CG1 3.34Å; K308-I311 PolarHBondContact O-N 3.18Å; I311-N313 VanDerWaalsContact C-N 3.28Å; I311-N313 PolarHBondContact O-N 3.31Å; I311-E314 WeakPolarHBondContact O-CB 3.4Å; I311-E314 PolarHBondContact O-N 2.68Å; I311-I315 PolarHBondContact O-N 3.27Å; I311-I315 VanDerWaalsContact O-N 3.12Å; I311-L339 HydrophobicContact CG2-CD2 3.21Å
312	I	81.8	Confident	82.4	Confident	8 Å²	8	50.6 Å²	50.6	4%	0.041	24%	0.24	C	C	.	.	H	α-helix	trans	-60.8	-41	171.9	-68.7	157.8	0	0	0	110.1	M247 I252 K255 L256 I259 L310 L316	M247-I312 HydrophobicContact CE-CD1 3.93Å; M247-I312 HydrophobicContact SD-CD1 4.29Å; I252-I312 HydrophobicContact CG2-CD1 4.01Å; K255-I312 HydrophobicContact CB-CD1 3.93Å; K255-I312 HydrophobicContact CG-CD1 3.8Å; K255-I312 HydrophobicContact CG-CG1 4.26Å; K255-I312 HydrophobicContact CG-CG2 4.07Å; L256-I312 HydrophobicContact CD2-CG1 3.7Å; L256-I312 HydrophobicContact CG-CD1 4.49Å; L256-I312 HydrophobicContact CG-CG1 3.93Å; I259-I312 HydrophobicContact CD1-CG2 4.2Å; L310-I312 VanDerWaalsContact C-N 3.3Å; L310-I312 PolarHBondContact O-N 3.22Å; I312-L316 HydrophobicContact CG2-CD1 3.89Å; I312-L316 WeakPolarHBondContact O-CB 3.46Å; I312-L316 VanDerWaalsContact O-CG 3.26Å; I312-L316 WeakPolarHBondContact O-CG 3.32Å; I312-L316 PolarHBondContact O-N 3.1Å; I312-L316 VanDerWaalsContact O-N 3.12Å
313	N	77.8	Confident	82.8	Confident	78 Å²	78	52 Å²	52	42%	0.417	25%	0.248	S	C	.	.	H	α-helix	trans	-70.6	-37.3	177.1	-58.4	-27.8	0	0	0	111.6	L310 I311 L316 V317	L310-N313 WeakPolarHBondContact O-CA 3.48Å; L310-N313 WeakPolarHBondContact O-CB 3.44Å; L310-N313 PolarHBondContact O-N 3.17Å; I311-N313 VanDerWaalsContact C-N 3.28Å; I311-N313 PolarHBondContact O-N 3.31Å; N313-L316 PolarHBondContact O-N 3.06Å; N313-V317 VanDerWaalsContact O-CB 3.31Å; N313-V317 WeakPolarHBondContact O-CB 3.32Å; N313-V317 VanDerWaalsContact O-CG2 3.27Å; N313-V317 WeakPolarHBondContact O-CG2 3.41Å; N313-V317 PolarHBondContact O-N 3.25Å
314	E	80.3	Confident	83.4	Confident	7 Å²	7	52.4 Å²	52.4	3%	0.033	26%	0.258	C	S	.	.	H	α-helix	trans	-56.5	-50	175	-173.4	-179.1	159.9	0	0	111.1	K298 L310 I311 M318 F407 G408	K298-E314 IonicContact NZ-OE1 2.79Å; K298-E314 PolarHBondContact NZ-OE1 2.72Å; K298-E314 IonicContact NZ-OE2 2.73Å; L310-E314 PolarHBondContact O-N 3.42Å; I311-E314 WeakPolarHBondContact O-CB 3.4Å; I311-E314 PolarHBondContact O-N 2.68Å; E314-M318 HydrophobicContact CG-SD 4.36Å; E314-M318 WeakPolarHBondContact O-CB 3.29Å; E314-M318 WeakPolarHBondContact O-CG 3.4Å; E314-M318 PolarHBondContact O-N 3.2Å; E314-F407 HydrophobicContact CG-CB 4.17Å; E314-G408 VanDerWaalsContact OE2-CA 3.29Å; E314-G408 WeakPolarHBondContact OE2-CA 3.18Å
315	I	85.1	Confident	84.1	Confident	2 Å²	2	46.8 Å²	46.8	1%	0.01	23%	0.232	C	C	.	.	H	α-helix	trans	-60.6	-49.3	176	-61.5	159.5	0	0	0	111.2	L256 I259 V260 I311 M318 R319 Y329 L339 V341	L256-I315 HydrophobicContact CD2-CD1 3.63Å; I259-I315 HydrophobicContact CD1-CB 4.11Å; I259-I315 HydrophobicContact CD1-CD1 3.76Å; I259-I315 HydrophobicContact CD1-CG2 4.05Å; I259-I315 HydrophobicContact CG1-CD1 4.29Å; V260-I315 HydrophobicContact CG1-CD1 4.49Å; I311-I315 PolarHBondContact O-N 3.27Å; I311-I315 VanDerWaalsContact O-N 3.12Å; I315-M318 PolarHBondContact O-N 3Å; I315-R319 WeakPolarHBondContact O-CB 3.25Å; I315-R319 PolarHBondContact O-N 3.33Å; I315-Y329 HydrophobicContact CG2-CE2 4.19Å; I315-L339 HydrophobicContact CD1-CD1 3.97Å; I315-L339 HydrophobicContact CD1-CD2 3.69Å; I315-L339 HydrophobicContact CD1-CG 4.49Å; I315-L339 HydrophobicContact CG1-CD2 4.1Å; I315-V341 HydrophobicContact CG1-CG2 4.33Å
316	L	86.4	Confident	84.9	Confident	47 Å²	47	45.7 Å²	45.7	25%	0.246	23%	0.227	C	C	.	.	H	α-helix	trans	-64.9	-47	-174.3	-70.9	171.9	0	0	0	111.6	I259 I312 N313 R319 E320	I259-L316 HydrophobicContact CD1-CG 4.44Å; I259-L316 HydrophobicContact CG2-CD2 4.46Å; I312-L316 HydrophobicContact CG2-CD1 3.89Å; I312-L316 WeakPolarHBondContact O-CB 3.46Å; I312-L316 VanDerWaalsContact O-CG 3.26Å; I312-L316 WeakPolarHBondContact O-CG 3.32Å; I312-L316 PolarHBondContact O-N 3.1Å; I312-L316 VanDerWaalsContact O-N 3.12Å; N313-L316 PolarHBondContact O-N 3.06Å; L316-R319 PolarHBondContact O-N 3.2Å; L316-E320 WeakPolarHBondContact O-CB 3.45Å; L316-E320 WeakPolarHBondContact O-CG 3.48Å; L316-E320 PolarHBondContact O-N 2.69Å
317	V	85	Confident	86.1	Confident	8 Å²	8	42.6 Å²	42.6	5%	0.048	21%	0.207	C	C	.	.	H	α-helix	trans	-59.6	-51.1	175.8	170.7	0	0	0	0	110.5	N313 R319 E320 N321 V384 F407	N313-V317 VanDerWaalsContact O-CB 3.31Å; N313-V317 WeakPolarHBondContact O-CB 3.32Å; N313-V317 VanDerWaalsContact O-CG2 3.27Å; N313-V317 WeakPolarHBondContact O-CG2 3.41Å; N313-V317 PolarHBondContact O-N 3.25Å; V317-R319 PolarHBondContact O-N 3.44Å; V317-E320 PolarHBondContact O-N 2.91Å; V317-N321 VanDerWaalsContact O-CB 3.23Å; V317-N321 WeakPolarHBondContact O-CB 3.32Å; V317-N321 PolarHBondContact O-N 3.42Å; V317-N321 PolarHBondContact O-OD1 3.24Å; V317-V384 HydrophobicContact CG1-CG1 4.02Å; V317-V384 HydrophobicContact CG1-CG2 4.41Å; V317-V384 HydrophobicContact CG2-CG2 4.43Å; V317-F407 HydrophobicContact CG1-CD1 3.6Å; V317-F407 HydrophobicContact CG1-CE1 4.21Å; V317-F407 HydrophobicContact CG1-CG 4.49Å
318	M	84.8	Confident	87	Confident	6 Å²	6	41 Å²	41	3%	0.03	20%	0.203	C	C	.	.	H	α-helix	trans	-64.3	-28.1	179.7	-70.2	-172.1	71.7	0	0	113.6	E314 I315 Y329 F407	E314-M318 HydrophobicContact CG-SD 4.36Å; E314-M318 WeakPolarHBondContact O-CB 3.29Å; E314-M318 WeakPolarHBondContact O-CG 3.4Å; E314-M318 PolarHBondContact O-N 3.2Å; I315-M318 PolarHBondContact O-N 3Å; M318-Y329 HydrophobicContact CB-CD2 4.25Å; M318-Y329 HydrophobicContact CB-CG 4.49Å; M318-Y329 VanDerWaalsContact O-CB 3.28Å; M318-Y329 WeakPolarHBondContact O-CB 3.46Å; M318-F407 HydrophobicContact CE-CD2 4.35Å; M318-F407 HydrophobicContact CG-CB 3.77Å; M318-F407 HydrophobicContact CG-CD1 4.42Å; M318-F407 HydrophobicContact CG-CD2 3.66Å; M318-F407 HydrophobicContact CG-CE2 4.45Å; M318-F407 HydrophobicContact CG-CG 3.67Å; M318-F407 HydrophobicContact SD-CB 4.21Å; M318-F407 HydrophobicContact SD-CD2 3.98Å; M318-F407 HydrophobicContact SD-CG 4.36Å
319	R	88.2	Confident	87.8	Confident	125 Å²	125	40.7 Å²	40.7	47%	0.472	20%	0.201	S	C	.	.	H	α-helix	trans	-77.5	-38.5	177.8	-179.6	177.4	179.6	157.4	-0.1	112.8	I259 I315 L316 V317 Y329	I259-R319 PolarHBondContact O-NH1 2.93Å; I315-R319 WeakPolarHBondContact O-CB 3.25Å; I315-R319 PolarHBondContact O-N 3.33Å; L316-R319 PolarHBondContact O-N 3.2Å; V317-R319 PolarHBondContact O-N 3.44Å; R319-Y329 HydrophobicContact CB-CD1 4.21Å; R319-Y329 HydrophobicContact CB-CE1 4.25Å; R319-Y329 HydrophobicContact CG-CD1 4.43Å; R319-Y329 HydrophobicContact CG-CE1 4.23Å
320	E	88.2	Confident	88.6	Confident	126 Å²	126	41.4 Å²	41.4	59%	0.589	21%	0.206	S	C	*	.	H	α-helix	trans	-88.1	-39.1	-175.9	-68.2	171.5	-163.9	0	0	112	L316 V317 K322	L316-E320 WeakPolarHBondContact O-CB 3.45Å; L316-E320 WeakPolarHBondContact O-CG 3.48Å; L316-E320 PolarHBondContact O-N 2.69Å; V317-E320 PolarHBondContact O-N 2.91Å; E320-K322 PolarHBondContact O-N 3.39Å; E320-K322 VanDerWaalsContact O-N 3.17Å
321	N	86	Confident	89.4	Confident	9 Å²	9	40.1 Å²	40.1	5%	0.048	20%	0.199	C	C	.	.			trans	-91.4	60.7	-174.8	-62.7	109.5	0	0	0	113.1	V317 F378 L379 N382	V317-N321 VanDerWaalsContact O-CB 3.23Å; V317-N321 WeakPolarHBondContact O-CB 3.32Å; V317-N321 PolarHBondContact O-N 3.42Å; V317-N321 PolarHBondContact O-OD1 3.24Å; N321-F378 HydrophobicContact CB-CE1 3.75Å; N321-F378 HydrophobicContact CB-CZ 4.33Å; N321-L379 HydrophobicContact CB-CD2 4.09Å; N321-N382 WeakPolarHBondContact ND2-CB 3.31Å
322	K	91.6	Very high	90.1	Very high	109 Å²	109	39.8 Å²	39.8	47%	0.474	20%	0.198	S	C	.	.			trans	-76.7	124.4	174.4	-72.3	177	177	-89	0	112.1	E320 N328 Y329 F378	E320-K322 PolarHBondContact O-N 3.39Å; E320-K322 VanDerWaalsContact O-N 3.17Å; K322-N328 PolarHBondContact NZ-OD1 3.33Å; K322-Y329 PolarHBondContact NZ-O 2.8Å; K322-F378 WeakPolarHBondContact O-CZ 3.5Å
323	N	95.5	Very high	90.7	Very high	35 Å²	35	40.1 Å²	40.1	19%	0.187	20%	0.199	C	C	.	.			trans	-149.6	149	-179.1	178.5	-74.8	0	0	0	110.1	N325 I326 F378	N323-N325 PolarHBondContact O-N 3.13Å; N323-N325 PolarHBondContact OD1-N 3.45Å; N323-I326 HydrophobicContact CB-CB 4.19Å; N323-I326 HydrophobicContact CB-CD1 3.95Å; N323-I326 HydrophobicContact CB-CG1 4.07Å; N323-I326 PolarHBondContact O-N 2.83Å; N323-I326 VanDerWaalsContact O-N 3.12Å; N323-F378 HydrophobicContact CB-CD1 3.56Å; N323-F378 HydrophobicContact CB-CE1 3.6Å; N323-F378 HydrophobicContact CB-CG 4.07Å; N323-F378 HydrophobicContact CB-CZ 4.16Å; N323-F378 WeakPolarHBondContact ND2-CB 3.33Å; N323-F378 VanDerWaalsContact ND2-CG 3.34Å; N323-F378 WeakPolarHBondContact ND2-CG 3.4Å
324	P	96.8	Very high	91.5	Very high	99 Å²	99	38.1 Å²	38.1	64%	0.643	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57	-31.2	179.5	-26.8	36.3	0	0	0	115.1	K403	P324-K403 WeakPolarHBondContact O-CD 3.44Å; P324-K403 WeakPolarHBondContact O-CE 3.5Å
325	N	97.9	Very high	92.1	Very high	18 Å²	18	39.4 Å²	39.4	10%	0.096	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	16.5	-178.6	-54	101.3	0	0	0	112.7	N323 E371 Q374 A375 K403 L404	N323-N325 PolarHBondContact O-N 3.13Å; N323-N325 PolarHBondContact OD1-N 3.45Å; N325-E371 WeakPolarHBondContact CB-O 3.49Å; N325-E371 WeakPolarHBondContact ND2-CB 3.28Å; N325-E371 PolarHBondContact ND2-OE2 2.67Å; N325-Q374 PolarHBondContact OD1-OE1 3.11Å; N325-A375 HydrophobicContact CB-CB 3.95Å; N325-A375 WeakPolarHBondContact O-CB 3.48Å; N325-K403 WeakPolarHBondContact O-CA 3.22Å; N325-L404 PolarHBondContact O-N 2.95Å
326	I	96.4	Very high	92.3	Very high	3 Å²	3	42.3 Å²	42.3	2%	0.015	23%	0.227	C	C	.	.	B	Isolated β-bridge	trans	-123.5	140.1	173.7	-68.1	179.5	0	0	0	108.4	N323 N328 A375 F378 L379 F407	N323-I326 HydrophobicContact CB-CB 4.19Å; N323-I326 HydrophobicContact CB-CD1 3.95Å; N323-I326 HydrophobicContact CB-CG1 4.07Å; N323-I326 PolarHBondContact O-N 2.83Å; N323-I326 VanDerWaalsContact O-N 3.12Å; I326-N328 PolarHBondContact O-N 3.31Å; I326-N328 VanDerWaalsContact O-N 3.14Å; I326-A375 HydrophobicContact CG1-CB 3.98Å; I326-F378 HydrophobicContact CD1-CD1 3.85Å; I326-F378 HydrophobicContact CD1-CE1 4.12Å; I326-L379 HydrophobicContact CD1-CD1 4.06Å; I326-L379 HydrophobicContact CD1-CD2 3.85Å; I326-L379 HydrophobicContact CD1-CG 3.84Å; I326-F407 HydrophobicContact CB-CZ 4.45Å; I326-F407 HydrophobicContact CD1-CE1 4.48Å; I326-F407 HydrophobicContact CD1-CZ 4.1Å; I326-F407 HydrophobicContact CG1-CZ 4.19Å; I326-F407 HydrophobicContact CG2-CE1 4.5Å; I326-F407 HydrophobicContact CG2-CE2 3.8Å; I326-F407 HydrophobicContact CG2-CZ 3.53Å
327	V	95.4	Very high	92.4	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.006	24%	0.237	C	C	.	.			trans	-59.7	116.7	177	171	0	0	0	0	110.6	Y329 M343 E344 L346 L395 K403 L404	V327-Y329 PolarHBondContact O-N 2.91Å; V327-Y329 VanDerWaalsContact O-N 3.15Å; V327-M343 HydrophobicContact CG1-CB 3.78Å; V327-M343 HydrophobicContact CG1-CG 3.84Å; V327-M343 HydrophobicContact CG1-SD 3.86Å; V327-E344 HydrophobicContact CG1-CG 4.15Å; V327-L346 HydrophobicContact CG2-CD1 3.73Å; V327-L395 HydrophobicContact CG2-CD1 4.19Å; V327-K403 HydrophobicContact CG2-CB 3.91Å; V327-L404 WeakPolarHBondContact CG2-O 3.26Å; V327-L404 PolarHBondContact N-O 3.32Å
328	N	94.3	Very high	92.7	Very high	58 Å²	58	47.4 Å²	47.4	31%	0.31	25%	0.249	S	C	.	.			trans	-67.7	110.4	-174.9	-180	36.7	0	0	0	111.9	K322 I326 L330 M343 E344	K322-N328 PolarHBondContact NZ-OD1 3.33Å; I326-N328 PolarHBondContact O-N 3.31Å; I326-N328 VanDerWaalsContact O-N 3.14Å; N328-L330 WeakPolarHBondContact ND2-CD2 3.33Å; N328-L330 PolarHBondContact O-N 2.85Å; N328-M343 WeakPolarHBondContact O-CA 3.46Å; N328-E344 HydrophobicContact CB-CB 4.45Å; N328-E344 HydrophobicContact CB-CG 4.08Å; N328-E344 WeakPolarHBondContact CB-OE1 3.45Å; N328-E344 PolarHBondContact N-OE1 2.98Å; N328-E344 PolarHBondContact O-N 3.23Å; N328-E344 VanDerWaalsContact O-N 3.1Å
329	Y	94.8	Very high	93	Very high	15 Å²	15	47.1 Å²	47.1	6%	0.059	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.3	126.3	165.8	173.7	-85.6	0	0	0	110.9	I315 M318 R319 K322 V327 D331 S332 V341	I315-Y329 HydrophobicContact CG2-CE2 4.19Å; M318-Y329 HydrophobicContact CB-CD2 4.25Å; M318-Y329 HydrophobicContact CB-CG 4.49Å; M318-Y329 VanDerWaalsContact O-CB 3.28Å; M318-Y329 WeakPolarHBondContact O-CB 3.46Å; R319-Y329 HydrophobicContact CB-CD1 4.21Å; R319-Y329 HydrophobicContact CB-CE1 4.25Å; R319-Y329 HydrophobicContact CG-CD1 4.43Å; R319-Y329 HydrophobicContact CG-CE1 4.23Å; K322-Y329 PolarHBondContact NZ-O 2.8Å; V327-Y329 PolarHBondContact O-N 2.91Å; V327-Y329 VanDerWaalsContact O-N 3.15Å; Y329-D331 WeakPolarHBondContact CE2-O 3.39Å; Y329-D331 VanDerWaalsContact CZ-C 3.48Å; Y329-D331 VanDerWaalsContact OH-C 3.3Å; Y329-S332 WeakPolarHBondContact OH-CB 3.43Å; Y329-S332 PolarHBondContact OH-N 3.29Å; Y329-S332 PolarHBondContact OH-OG 2.79Å; Y329-V341 HydrophobicContact CD2-CG1 4.08Å; Y329-V341 HydrophobicContact CE2-CG1 4.17Å
330	L	94.7	Very high	93.4	Very high	60 Å²	60	41.4 Å²	41.4	31%	0.314	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	-51.5	176	-59	179	0	0	0	111.1	V295 N328 V342	V295-L330 HydrophobicContact CB-CD1 4.3Å; V295-L330 HydrophobicContact CG1-CD1 3.55Å; N328-L330 WeakPolarHBondContact ND2-CD2 3.33Å; N328-L330 PolarHBondContact O-N 2.85Å; L330-V342 HydrophobicContact CB-CG1 4.27Å; L330-V342 HydrophobicContact CD1-CG1 4.33Å; L330-V342 PolarHBondContact N-O 3.12Å
331	D	95.1	Very high	93.7	Very high	22 Å²	22	35.5 Å²	35.5	12%	0.118	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.1	169.1	-169.7	-141.9	-27.3	0	0	0	112.2	S261 K268 Y329 Y333 V342	S261-D331 WeakPolarHBondContact CB-OD1 3.13Å; S261-D331 PolarHBondContact OG-OD1 2.85Å; K268-D331 IonicContact NZ-OD2 3.96Å; K268-D331 PolarHBondContact NZ-OD2 3.43Å; Y329-D331 WeakPolarHBondContact CE2-O 3.39Å; Y329-D331 VanDerWaalsContact CZ-C 3.48Å; Y329-D331 VanDerWaalsContact OH-C 3.3Å; D331-Y333 HydrophobicContact CB-CE2 3.92Å; D331-Y333 PolarHBondContact OD2-OH 3.14Å; D331-V342 HydrophobicContact CB-CB 4.07Å; D331-V342 HydrophobicContact CB-CG2 4.29Å; D331-V342 PolarHBondContact N-O 3.12Å; D331-V342 VanDerWaalsContact N-O 3.12Å; D331-V342 PolarHBondContact O-N 3.46Å
332	S	95.6	Very high	94.1	Very high	0 Å²	0	35 Å²	35	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	152.8	167.1	58.5	0	0	0	0	112.4	S261 Y329 W340	S261-S332 WeakPolarHBondContact CB-O 3.5Å; S261-S332 PolarHBondContact N-O 3.42Å; Y329-S332 WeakPolarHBondContact OH-CB 3.43Å; Y329-S332 PolarHBondContact OH-N 3.29Å; Y329-S332 PolarHBondContact OH-OG 2.79Å; S332-W340 CarbonylContact C-O 3.42Å; S332-W340 WeakPolarHBondContact CA-O 3.45Å; S332-W340 WeakPolarHBondContact CB-O 3.46Å
333	Y	95.8	Very high	94.3	Very high	14 Å²	14	30.4 Å²	30.4	6%	0.055	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	144.6	-173.1	-62.2	-89.2	0	0	0	110.8	S261 P265 K268 Y269 D331 W340 V342	S261-Y333 WeakPolarHBondContact O-CD1 3.48Å; P265-Y333 HydrophobicContact CB-CD1 4.38Å; P265-Y333 HydrophobicContact CB-CD2 3.81Å; P265-Y333 HydrophobicContact CB-CE2 4.19Å; P265-Y333 HydrophobicContact CB-CG 3.91Å; P265-Y333 HydrophobicContact CG-CD1 4.5Å; P265-Y333 HydrophobicContact CG-CD2 4.29Å; P265-Y333 HydrophobicContact CG-CG 3.97Å; K268-Y333 WeakPolarHBondContact CD-OH 3.2Å; K268-Y333 PolarHBondContact NZ-OH 3.48Å; Y269-Y333 AromaticContact CE2-CE2 3.96Å; Y269-Y333 HydrophobicContact CE2-CE2 3.96Å; D331-Y333 HydrophobicContact CB-CE2 3.92Å; D331-Y333 PolarHBondContact OD2-OH 3.14Å; Y333-W340 PolarHBondContact N-O 3.41Å; Y333-W340 PolarHBondContact O-N 3.03Å; Y333-V342 HydrophobicContact CD2-CG2 4.21Å; Y333-V342 HydrophobicContact CE2-CG2 4.15Å
334	L	94.2	Very high	94.4	Very high	36 Å²	36	30.3 Å²	30.3	19%	0.188	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	112.8	170.5	-175.2	70.1	0	0	0	109.9	L253 R257 V260 L302	L253-L334 HydrophobicContact CD2-CD2 4.37Å; R257-L334 HydrophobicContact CG-CD2 3.52Å; V260-L334 HydrophobicContact CG2-CB 4.04Å; L302-L334 HydrophobicContact CD1-CD1 3.56Å
335	V	92.7	Very high	94.4	Very high	34 Å²	34	28.8 Å²	28.8	21%	0.206	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	83	-175.7	-172.5	0	0	0	0	108.9	P265 E337 E338 W340	P265-V335 HydrophobicContact CG-CG2 3.48Å; P265-V335 VanDerWaalsContact CG-CG2 3.48Å; V335-E337 PolarHBondContact O-N 3.3Å; V335-E337 VanDerWaalsContact O-N 3.16Å; V335-E338 PolarHBondContact N-O 3.49Å; V335-E338 PolarHBondContact O-N 3.02Å; V335-E338 VanDerWaalsContact O-N 3.13Å; V335-W340 HydrophobicContact CG2-CD2 3.99Å; V335-W340 HydrophobicContact CG2-CG 3.98Å
336	G	89.1	Confident	94.3	Very high	64 Å²	64	28.5 Å²	28.5	66%	0.66	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.6	-110	-171.3	0	0	0	0	0	110.7
337	E	87.4	Confident	94.3	Very high	98 Å²	98	29.7 Å²	29.7	46%	0.458	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.2	8	176.3	-56.3	-166	134.5	0	0	113.4	L302 Q303 V335	L302-E337 VanDerWaalsContact CB-O 3.28Å; L302-E337 WeakPolarHBondContact CB-O 3.28Å; L302-E337 VanDerWaalsContact CG-O 3.28Å; L302-E337 WeakPolarHBondContact CG-O 3.2Å; L302-E337 PolarHBondContact N-O 3.2Å; Q303-E337 VanDerWaalsContact CG-OE2 3.24Å; Q303-E337 WeakPolarHBondContact CG-OE2 3.11Å; Q303-E337 PolarHBondContact NE2-OE1 2.98Å; V335-E337 PolarHBondContact O-N 3.3Å; V335-E337 VanDerWaalsContact O-N 3.16Å
338	E	91.6	Very high	94.3	Very high	63 Å²	63	29.7 Å²	29.7	29%	0.294	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	126.5	174.6	-60.8	-176.3	156.7	0	0	110.9	M300 V335 W340	M300-E338 WeakPolarHBondContact O-CA 3.47Å; V335-E338 PolarHBondContact N-O 3.49Å; V335-E338 PolarHBondContact O-N 3.02Å; V335-E338 VanDerWaalsContact O-N 3.13Å; E338-W340 PolarHBondContact OE2-NE1 2.97Å
339	L	92.4	Very high	94.4	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	129.2	162.5	177.5	73.4	0	0	0	109.2	V260 M300 L302 I311 I315 V341	V260-L339 HydrophobicContact CG1-CD1 3.68Å; M300-L339 HydrophobicContact CE-CD2 3.72Å; M300-L339 HydrophobicContact CE-CG 4.21Å; M300-L339 PolarHBondContact N-O 3.15Å; M300-L339 PolarHBondContact O-N 3.29Å; L302-L339 HydrophobicContact CD2-CB 3.95Å; L302-L339 HydrophobicContact CG-CB 4.42Å; I311-L339 HydrophobicContact CG2-CD2 3.21Å; I315-L339 HydrophobicContact CD1-CD1 3.97Å; I315-L339 HydrophobicContact CD1-CD2 3.69Å; I315-L339 HydrophobicContact CD1-CG 4.49Å; I315-L339 HydrophobicContact CG1-CD2 4.1Å; L339-V341 HydrophobicContact CD2-CG2 3.91Å; L339-V341 HydrophobicContact CG-CG2 4.09Å
340	W	95.1	Very high	94.5	Very high	6 Å²	6	28.2 Å²	28.2	2%	0.023	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	117.4	173.7	-70.6	31.5	0	0	0	108.4	P265 K266 F272 I297 K298 Q299 S332 Y333 V335 E338	P265-W340 HydrophobicContact CB-CE3 3.72Å; P265-W340 HydrophobicContact CB-CZ3 4Å; P265-W340 HydrophobicContact CG-CD2 3.93Å; P265-W340 HydrophobicContact CG-CE3 3.39Å; P265-W340 HydrophobicContact CG-CZ3 3.77Å; K266-W340 HydrophobicContact CD-CH2 4.17Å; K266-W340 HydrophobicContact CG-CH2 3.65Å; K266-W340 HydrophobicContact CG-CZ2 4.43Å; K266-W340 HydrophobicContact CG-CZ3 4.11Å; F272-W340 AromaticContact CE1-CH2 3.95Å; F272-W340 HydrophobicContact CE1-CH2 3.95Å; F272-W340 AromaticContact CE1-CZ3 3.55Å; F272-W340 HydrophobicContact CE1-CZ3 3.55Å; F272-W340 HydrophobicContact CZ-CH2 4.08Å; F272-W340 AromaticContact CZ-CZ3 3.69Å; F272-W340 HydrophobicContact CZ-CZ3 3.69Å; I297-W340 HydrophobicContact CG2-CB 4.27Å; I297-W340 HydrophobicContact CG2-CD2 4.33Å; I297-W340 HydrophobicContact CG2-CE3 3.88Å; K298-W340 WeakPolarHBondContact O-CA 3.47Å; Q299-W340 HydrophobicContact CG-CD2 3.9Å; Q299-W340 HydrophobicContact CG-CG 4Å; Q299-W340 HydrophobicContact CG-CZ2 4.25Å; Q299-W340 VanDerWaalsContact NE2-CH2 3.31Å; S332-W340 CarbonylContact C-O 3.42Å; S332-W340 WeakPolarHBondContact CA-O 3.45Å; S332-W340 WeakPolarHBondContact CB-O 3.46Å; Y333-W340 PolarHBondContact N-O 3.41Å; Y333-W340 PolarHBondContact O-N 3.03Å; V335-W340 HydrophobicContact CG2-CD2 3.99Å; V335-W340 HydrophobicContact CG2-CG 3.98Å; E338-W340 PolarHBondContact OE2-NE1 2.97Å
341	V	94.3	Very high	94.6	Very high	1 Å²	1	25.4 Å²	25.4	1%	0.006	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	126.1	173.9	177.6	0	0	0	0	109.2	I297 K298 M300 I315 Y329 L339 M343	I297-V341 CarbonylContact C-O 3.56Å; I297-V341 WeakPolarHBondContact CA-O 3.36Å; K298-V341 PolarHBondContact N-O 2.61Å; K298-V341 PolarHBondContact O-N 3.43Å; M300-V341 HydrophobicContact CE-CB 4.13Å; M300-V341 HydrophobicContact CE-CG2 3.48Å; M300-V341 VanDerWaalsContact CE-CG2 3.48Å; I315-V341 HydrophobicContact CG1-CG2 4.33Å; Y329-V341 HydrophobicContact CD2-CG1 4.08Å; Y329-V341 HydrophobicContact CE2-CG1 4.17Å; L339-V341 HydrophobicContact CD2-CG2 3.91Å; L339-V341 HydrophobicContact CG-CG2 4.09Å; V341-M343 HydrophobicContact CG1-CE 4.19Å
342	V	96.3	Very high	94.7	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	129	-178.1	-170.4	0	0	0	0	109.7	Y269 V295 A296 I297 L330 D331 Y333	Y269-V342 HydrophobicContact CE1-CG1 4.23Å; Y269-V342 HydrophobicContact CE2-CG1 4.44Å; Y269-V342 HydrophobicContact CE2-CG2 3.91Å; V295-V342 HydrophobicContact CB-CG1 3.94Å; V295-V342 HydrophobicContact CG1-CG1 4.36Å; V295-V342 HydrophobicContact CG2-CG1 3.92Å; A296-V342 WeakPolarHBondContact O-CA 3.35Å; I297-V342 HydrophobicContact CD1-CG2 4.3Å; I297-V342 HydrophobicContact CG1-CG1 4.17Å; I297-V342 HydrophobicContact CG1-CG2 4.15Å; L330-V342 HydrophobicContact CB-CG1 4.27Å; L330-V342 HydrophobicContact CD1-CG1 4.33Å; L330-V342 PolarHBondContact N-O 3.12Å; D331-V342 HydrophobicContact CB-CB 4.07Å; D331-V342 HydrophobicContact CB-CG2 4.29Å; D331-V342 PolarHBondContact N-O 3.12Å; D331-V342 VanDerWaalsContact N-O 3.12Å; D331-V342 PolarHBondContact O-N 3.46Å; Y333-V342 HydrophobicContact CD2-CG2 4.21Å; Y333-V342 HydrophobicContact CE2-CG2 4.15Å
343	M	95.7	Very high	94.6	Very high	12 Å²	12	29 Å²	29	6%	0.059	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	167.7	-177.3	68.8	-160.3	77.5	0	0	111.1	A296 K298 V327 N328 V341	A296-M343 HydrophobicContact CB-CG 3.77Å; A296-M343 HydrophobicContact CB-SD 4.46Å; A296-M343 PolarHBondContact N-O 2.66Å; A296-M343 PolarHBondContact O-N 3.47Å; K298-M343 HydrophobicContact CB-CE 3.71Å; K298-M343 HydrophobicContact CD-CE 4.45Å; V327-M343 HydrophobicContact CG1-CB 3.78Å; V327-M343 HydrophobicContact CG1-CG 3.84Å; V327-M343 HydrophobicContact CG1-SD 3.86Å; N328-M343 WeakPolarHBondContact O-CA 3.46Å; V341-M343 HydrophobicContact CG1-CE 4.19Å
344	E	95.9	Very high	94.7	Very high	33 Å²	33	28.4 Å²	28.4	15%	0.154	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	143.4	171.3	68.2	-179.9	131.3	0	0	111.6	V327 N328 K403	V327-E344 HydrophobicContact CG1-CG 4.15Å; N328-E344 HydrophobicContact CB-CB 4.45Å; N328-E344 HydrophobicContact CB-CG 4.08Å; N328-E344 WeakPolarHBondContact CB-OE1 3.45Å; N328-E344 PolarHBondContact N-OE1 2.98Å; N328-E344 PolarHBondContact O-N 3.23Å; N328-E344 VanDerWaalsContact O-N 3.1Å; E344-K403 WeakPolarHBondContact OE1-CD 3.48Å; E344-K403 IonicContact OE1-NZ 2.66Å; E344-K403 PolarHBondContact OE1-NZ 3.12Å; E344-K403 IonicContact OE2-NZ 3.28Å; E344-K403 PolarHBondContact OE2-NZ 3.13Å
345	Y	97.2	Very high	94.8	Very high	66 Å²	66	27.1 Å²	27.1	26%	0.259	16%	0.163	S	C	.	.			trans	-90.5	126.4	173.6	175.6	-132	0	0	0	110.8	I275 T285 E294 A296 A347	I275-Y345 HydrophobicContact CD1-CD2 4.39Å; I275-Y345 HydrophobicContact CD1-CE2 4.01Å; T285-Y345 HydrophobicContact CG2-CD1 3.96Å; T285-Y345 HydrophobicContact CG2-CD2 3.73Å; T285-Y345 HydrophobicContact CG2-CE1 3.68Å; T285-Y345 HydrophobicContact CG2-CE2 3.5Å; T285-Y345 VanDerWaalsContact CG2-CE2 3.5Å; T285-Y345 HydrophobicContact CG2-CG 3.96Å; T285-Y345 VanDerWaalsContact CG2-CZ 3.44Å; E294-Y345 HydrophobicContact CB-CD1 4.26Å; E294-Y345 VanDerWaalsContact CD-CE1 3.43Å; E294-Y345 HydrophobicContact CG-CD1 3.56Å; E294-Y345 HydrophobicContact CG-CE1 4.15Å; E294-Y345 HydrophobicContact CG-CG 4.3Å; E294-Y345 WeakPolarHBondContact OE2-CD1 3.4Å; E294-Y345 WeakPolarHBondContact OE2-CE1 3.44Å; A296-Y345 HydrophobicContact CB-CD2 4.47Å; Y345-A347 HydrophobicContact CD1-CB 4.12Å; Y345-A347 HydrophobicContact CE1-CB 3.6Å
346	L	96.9	Very high	94.9	Very high	13 Å²	13	29.4 Å²	29.4	7%	0.068	18%	0.177	C	C	.	.			trans	-105.8	92.2	176.3	-72.9	169.1	0	0	0	109.1	V327 G348 G349 L395 L396 K403	V327-L346 HydrophobicContact CG2-CD1 3.73Å; L346-G348 PolarHBondContact O-N 2.92Å; L346-G349 PolarHBondContact O-N 3.29Å; L346-L395 HydrophobicContact CB-CB 4.03Å; L346-L395 HydrophobicContact CD1-CB 3.47Å; L346-L395 VanDerWaalsContact CD1-CB 3.47Å; L346-L395 HydrophobicContact CD1-CD1 4.27Å; L346-L395 HydrophobicContact CG-CB 4.42Å; L346-L396 CarbonylContact C-O 3.58Å; L346-L396 WeakPolarHBondContact CB-O 3.47Å; L346-K403 HydrophobicContact CD1-CB 3.81Å; L346-K403 HydrophobicContact CD1-CD 4.05Å; L346-K403 HydrophobicContact CD1-CG 4.1Å; L346-K403 HydrophobicContact CD2-CD 4.32Å
347	A	95.9	Very high	95.1	Very high	28 Å²	28	30.5 Å²	30.5	23%	0.231	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-4.5	-170.7	0	0	0	0	0	114.8	Y345 G349 M398 K537	Y345-A347 HydrophobicContact CD1-CB 4.12Å; Y345-A347 HydrophobicContact CE1-CB 3.6Å; A347-G349 VanDerWaalsContact C-N 3.31Å; A347-M398 HydrophobicContact CB-CG 4.08Å; A347-K537 PolarHBondContact O-NZ 3.19Å
348	G	96.3	Very high	95.5	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.01	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-15.3	174.1	0	0	0	0	0	114.1	L346 L396	L346-G348 PolarHBondContact O-N 2.92Å; G348-L396 CarbonylContact C-O 3.42Å; G348-L396 WeakPolarHBondContact CA-O 3.31Å; G348-L396 PolarHBondContact N-O 3.22Å
349	G	95.3	Very high	95.7	Very high	24 Å²	24	29.7 Å²	29.7	25%	0.247	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	92.6	-156.5	-179	0	0	0	0	0	112.8	L346 A347 L395 L396	L346-G349 PolarHBondContact O-N 3.29Å; A347-G349 VanDerWaalsContact C-N 3.31Å; G349-L395 WeakPolarHBondContact O-CA 3.41Å; G349-L396 PolarHBondContact O-N 3.28Å
350	S	96	Very high	96	Very high	18 Å²	18	30.8 Å²	30.8	13%	0.126	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	165.7	175.3	71.2	0	0	0	0	111.6	T352 D353 I394	S350-T352 WeakPolarHBondContact OG-CB 3.45Å; S350-T352 PolarHBondContact OG-N 2.88Å; S350-D353 WeakPolarHBondContact CA-OD2 3.09Å; S350-D353 WeakPolarHBondContact CB-OD2 3.21Å; S350-D353 PolarHBondContact N-OD2 3.5Å; S350-D353 PolarHBondContact OG-N 3.38Å; S350-D353 PolarHBondContact OG-OD2 3.05Å; S350-I394 CarbonylContact C-O 3.57Å; S350-I394 WeakPolarHBondContact CA-O 3.43Å
351	L	98	Very high	96.1	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-69.4	-25.6	166.4	-177.6	64.5	0	0	0	111.4	D353 V354 V355 M360 V368 S391 I394 L396 M452 M456	L351-D353 VanDerWaalsContact C-N 3.34Å; L351-D353 PolarHBondContact O-N 2.87Å; L351-V354 HydrophobicContact CD1-CB 4.47Å; L351-V354 PolarHBondContact O-N 2.87Å; L351-V354 VanDerWaalsContact O-N 3.07Å; L351-V355 HydrophobicContact CD1-CG1 4.28Å; L351-V355 HydrophobicContact CG-CG1 4.2Å; L351-V355 PolarHBondContact O-N 3.32Å; L351-M360 HydrophobicContact CD1-SD 4.23Å; L351-V368 HydrophobicContact CD1-CG2 4.47Å; L351-V368 HydrophobicContact CD2-CG1 3.81Å; L351-S391 WeakPolarHBondContact CB-O 3.47Å; L351-I394 HydrophobicContact CB-CB 3.9Å; L351-I394 HydrophobicContact CB-CG2 4.13Å; L351-I394 HydrophobicContact CD2-CB 4.15Å; L351-I394 HydrophobicContact CD2-CG1 4.35Å; L351-I394 HydrophobicContact CD2-CG2 4.24Å; L351-I394 PolarHBondContact N-O 3.24Å; L351-L396 HydrophobicContact CD1-CD1 4.38Å; L351-M452 HydrophobicContact CD2-CE 3.93Å; L351-M452 HydrophobicContact CD2-CG 4.34Å; L351-M452 HydrophobicContact CD2-SD 4.13Å; L351-M456 HydrophobicContact CD1-SD 4.38Å; L351-M456 HydrophobicContact CD2-CG 4.32Å; L351-M456 HydrophobicContact CD2-SD 4.01Å
352	T	96.3	Very high	96.3	Very high	32 Å²	32	35.2 Å²	35.2	20%	0.196	20%	0.203	C	C	.	.	H	α-helix	trans	-56.1	-49	176	-41.7	0	0	0	0	110.9	S350 V354 V355 T356 S391 D392	S350-T352 WeakPolarHBondContact OG-CB 3.45Å; S350-T352 PolarHBondContact OG-N 2.88Å; T352-V354 PolarHBondContact O-N 3.29Å; T352-V354 VanDerWaalsContact O-N 3.13Å; T352-V355 WeakPolarHBondContact O-CG2 3.04Å; T352-V355 PolarHBondContact O-N 2.92Å; T352-T356 HydrophobicContact CG2-CG2 4.46Å; T352-T356 PolarHBondContact O-N 2.69Å; T352-T356 VanDerWaalsContact O-N 3.12Å; T352-T356 PolarHBondContact O-OG1 2.7Å; T352-S391 VanDerWaalsContact OG1-C 3.26Å; T352-S391 WeakPolarHBondContact OG1-CB 3.5Å; T352-S391 PolarHBondContact OG1-OG 3.33Å; T352-D392 WeakPolarHBondContact OG1-CA 3.44Å; T352-D392 PolarHBondContact OG1-N 2.93Å; T352-D392 PolarHBondContact OG1-OD1 2.92Å
353	D	95.2	Very high	96.4	Very high	64 Å²	64	35.5 Å²	35.5	34%	0.342	21%	0.205	S	C	.	.	H	α-helix	trans	-56.2	-32	178.1	-53.3	-64	0	0	0	112.1	S350 L351 E357 A536	S350-D353 WeakPolarHBondContact CA-OD2 3.09Å; S350-D353 WeakPolarHBondContact CB-OD2 3.21Å; S350-D353 PolarHBondContact N-OD2 3.5Å; S350-D353 PolarHBondContact OG-N 3.38Å; S350-D353 PolarHBondContact OG-OD2 3.05Å; L351-D353 VanDerWaalsContact C-N 3.34Å; L351-D353 PolarHBondContact O-N 2.87Å; D353-E357 WeakPolarHBondContact O-CG 3.42Å; D353-A536 HydrophobicContact CB-CB 4.41Å; D353-A536 WeakPolarHBondContact O-CB 3.4Å
354	V	97.4	Very high	96.5	Very high	3 Å²	3	35.7 Å²	35.7	2%	0.018	21%	0.206	C	C	.	.	H	α-helix	trans	-82.7	-36.9	-179.1	171.4	0	0	0	0	112.4	L351 T352 T358 M360 L396 L532 I533 A536	L351-V354 HydrophobicContact CD1-CB 4.47Å; L351-V354 PolarHBondContact O-N 2.87Å; L351-V354 VanDerWaalsContact O-N 3.07Å; T352-V354 PolarHBondContact O-N 3.29Å; T352-V354 VanDerWaalsContact O-N 3.13Å; V354-T358 WeakPolarHBondContact O-CB 3.13Å; V354-T358 PolarHBondContact O-N 3.4Å; V354-T358 VanDerWaalsContact O-N 3.11Å; V354-T358 PolarHBondContact O-OG1 3.5Å; V354-M360 HydrophobicContact CG1-CG 4.38Å; V354-M360 HydrophobicContact CG1-SD 4.21Å; V354-L396 HydrophobicContact CB-CD1 4.4Å; V354-L396 HydrophobicContact CG2-CD1 3.67Å; V354-L532 HydrophobicContact CG1-CB 3.91Å; V354-L532 HydrophobicContact CG1-CD1 4.18Å; V354-I533 HydrophobicContact CG2-CG1 4.08Å; V354-A536 HydrophobicContact CG2-CB 4.17Å
355	V	96.3	Very high	96.7	Very high	9 Å²	9	34.3 Å²	34.3	6%	0.055	20%	0.2	C	C	.	.	H	α-helix	trans	-80.5	-24	-178.2	-59.2	0	0	0	0	113.8	L351 T352 M360 M456	L351-V355 HydrophobicContact CD1-CG1 4.28Å; L351-V355 HydrophobicContact CG-CG1 4.2Å; L351-V355 PolarHBondContact O-N 3.32Å; T352-V355 WeakPolarHBondContact O-CG2 3.04Å; T352-V355 PolarHBondContact O-N 2.92Å; V355-M360 HydrophobicContact CG1-SD 4.08Å; V355-M456 HydrophobicContact CG1-CB 4.3Å; V355-M456 HydrophobicContact CG1-CG 3.68Å
356	T	94.3	Very high	96.7	Very high	82 Å²	82	31.2 Å²	31.2	50%	0.503	19%	0.188	S	C	.	.	H	α-helix	trans	-80.3	-40.2	174.2	63.9	0	0	0	0	112.4	T352	T352-T356 HydrophobicContact CG2-CG2 4.46Å; T352-T356 PolarHBondContact O-N 2.69Å; T352-T356 VanDerWaalsContact O-N 3.12Å; T352-T356 PolarHBondContact O-OG1 2.7Å
357	E	94.4	Very high	96.8	Very high	87 Å²	87	30.6 Å²	30.6	41%	0.407	18%	0.184	S	C	.	.	H	α-helix	trans	-94.4	-13.4	-172.9	-51.8	-51.8	116.7	0	0	114.1	D353 A536 A539	D353-E357 WeakPolarHBondContact O-CG 3.42Å; E357-A536 HydrophobicContact CB-CB 4.24Å; E357-A536 HydrophobicContact CG-CB 4.5Å; E357-A539 HydrophobicContact CB-CB 4.12Å; E357-A539 HydrophobicContact CG-CB 3.98Å; E357-A539 WeakPolarHBondContact OE2-CB 3.49Å
358	T	95.2	Very high	97	Very high	21 Å²	21	29.2 Å²	29.2	13%	0.129	17%	0.173	C	C	.	.			trans	-142	155.3	-173.7	83.4	0	0	0	0	113.8	V354 L532 A535 A536	V354-T358 WeakPolarHBondContact O-CB 3.13Å; V354-T358 PolarHBondContact O-N 3.4Å; V354-T358 VanDerWaalsContact O-N 3.11Å; V354-T358 PolarHBondContact O-OG1 3.5Å; T358-L532 HydrophobicContact CG2-CB 4.3Å; T358-A535 HydrophobicContact CG2-CB 4.04Å; T358-A536 HydrophobicContact CG2-CB 4.41Å
359	C	95.4	Very high	97.1	Very high	123 Å²	123	29.2 Å²	29.2	83%	0.831	17%	0.173	S	C	*	.	P	Polyproline II helix	trans	-95.4	126.5	171.8	-54.8	0	0	0	0	110.8
360	M	97.8	Very high	97.3	Very high	22 Å²	22	30.7 Å²	30.7	11%	0.108	17%	0.171	C	C	.	.	P	Polyproline II helix	trans	-92.2	141.4	174.9	-60.6	-176.6	67	0	0	111.5	L351 V354 V355 Q364 I365 V368 M456 L529 L532	L351-M360 HydrophobicContact CD1-SD 4.23Å; V354-M360 HydrophobicContact CG1-CG 4.38Å; V354-M360 HydrophobicContact CG1-SD 4.21Å; V355-M360 HydrophobicContact CG1-SD 4.08Å; M360-Q364 HydrophobicContact CB-CB 4.47Å; M360-Q364 HydrophobicContact CE-CB 3.94Å; M360-I365 HydrophobicContact CB-CD1 4.16Å; M360-I365 HydrophobicContact CB-CG1 3.67Å; M360-I365 HydrophobicContact CE-CG1 4.33Å; M360-V368 HydrophobicContact CE-CG2 3.9Å; M360-M456 HydrophobicContact CE-SD 3.88Å; M360-M456 HydrophobicContact SD-CB 4.07Å; M360-M456 HydrophobicContact SD-CG 3.71Å; M360-M456 HydrophobicContact SD-SD 3.86Å; M360-L529 HydrophobicContact CE-CD2 3.85Å; M360-L532 HydrophobicContact CG-CD1 3.79Å
361	D	97.6	Very high	97.4	Very high	61 Å²	61	30.9 Å²	30.9	33%	0.326	17%	0.17	S	C	.	.	P	Polyproline II helix	trans	-89.8	157.4	168.9	75	70.5	0	0	0	112.5	G363 Q364 I365 K524	D361-G363 PolarHBondContact O-N 3.15Å; D361-G363 WeakPolarHBondContact OD1-CA 3.45Å; D361-G363 PolarHBondContact OD1-N 2.93Å; D361-Q364 WeakPolarHBondContact O-CA 3.3Å; D361-Q364 WeakPolarHBondContact O-CB 3.4Å; D361-Q364 PolarHBondContact O-N 3.04Å; D361-Q364 PolarHBondContact OD1-N 3.35Å; D361-Q364 PolarHBondContact OD2-OE1 2.84Å; D361-I365 WeakPolarHBondContact O-CG1 3.32Å; D361-I365 PolarHBondContact O-N 2.94Å; D361-K524 WeakPolarHBondContact OD1-CE 3.42Å; D361-K524 IonicContact OD1-NZ 3.13Å; D361-K524 PolarHBondContact OD1-NZ 3.23Å; D361-K524 IonicContact OD2-NZ 3.39Å; D361-K524 PolarHBondContact OD2-NZ 3.32Å
362	E	98.5	Very high	97.4	Very high	40 Å²	40	31.1 Å²	31.1	19%	0.187	17%	0.172	C	C	.	.	H	α-helix	trans	-52.4	-29.3	-176.4	-71.3	-164.2	-171.6	0	0	114.4	A366 L489 S490 F493 F519 I522	E362-A366 WeakPolarHBondContact O-CB 3.35Å; E362-A366 PolarHBondContact O-N 3.45Å; E362-L489 WeakPolarHBondContact OE1-CA 3.46Å; E362-S490 PolarHBondContact OE1-N 2.92Å; E362-S490 PolarHBondContact OE1-OG 3.08Å; E362-S490 WeakPolarHBondContact OE2-CB 3.29Å; E362-S490 PolarHBondContact OE2-OG 3.21Å; E362-F493 HydrophobicContact CG-CD1 3.71Å; E362-F493 HydrophobicContact CG-CE1 4.26Å; E362-F493 HydrophobicContact CG-CG 4.5Å; E362-F519 HydrophobicContact CB-CE2 4.14Å; E362-I522 HydrophobicContact CB-CD1 3.74Å
363	G	98.6	Very high	97.5	Very high	5 Å²	5	29.6 Å²	29.6	5%	0.052	16%	0.163	C	C	.	.	H	α-helix	trans	-74.2	-31.9	176.3	0	0	0	0	0	113.2	D361 A367 I522 A523 K524	D361-G363 PolarHBondContact O-N 3.15Å; D361-G363 WeakPolarHBondContact OD1-CA 3.45Å; D361-G363 PolarHBondContact OD1-N 2.93Å; G363-A367 PolarHBondContact O-N 3.42Å; G363-I522 WeakPolarHBondContact CA-O 3.48Å; G363-A523 CarbonylContact O-C 3.59Å; G363-A523 WeakPolarHBondContact O-CA 3.39Å; G363-K524 PolarHBondContact O-N 3.11Å
364	Q	98.7	Very high	97.7	Very high	17 Å²	17	29.9 Å²	29.9	8%	0.079	16%	0.162	C	C	.	.	H	α-helix	trans	-73.2	-44.4	171.1	-69	165.1	-40.7	0	0	110.7	M360 D361 A367 V368 K524 S528 L529	M360-Q364 HydrophobicContact CB-CB 4.47Å; M360-Q364 HydrophobicContact CE-CB 3.94Å; D361-Q364 WeakPolarHBondContact O-CA 3.3Å; D361-Q364 WeakPolarHBondContact O-CB 3.4Å; D361-Q364 PolarHBondContact O-N 3.04Å; D361-Q364 PolarHBondContact OD1-N 3.35Å; D361-Q364 PolarHBondContact OD2-OE1 2.84Å; Q364-A367 WeakPolarHBondContact O-CB 3.48Å; Q364-A367 PolarHBondContact O-N 2.97Å; Q364-A367 VanDerWaalsContact O-N 3.11Å; Q364-V368 PolarHBondContact O-N 3.26Å; Q364-V368 VanDerWaalsContact O-N 3.07Å; Q364-K524 HydrophobicContact CG-CD 4.29Å; Q364-S528 PolarHBondContact NE2-O 2.59Å; Q364-L529 HydrophobicContact CB-CD2 3.76Å; Q364-L529 HydrophobicContact CG-CD2 4.07Å
365	I	98.8	Very high	97.7	Very high	4 Å²	4	29.7 Å²	29.7	2%	0.021	16%	0.161	C	C	.	.	H	α-helix	trans	-60.7	-48.3	177.1	-57.9	178.4	0	0	0	110.6	M360 D361 A367 V368 C369 M456 I457 F493 F519	M360-I365 HydrophobicContact CB-CD1 4.16Å; M360-I365 HydrophobicContact CB-CG1 3.67Å; M360-I365 HydrophobicContact CE-CG1 4.33Å; D361-I365 WeakPolarHBondContact O-CG1 3.32Å; D361-I365 PolarHBondContact O-N 2.94Å; I365-A367 PolarHBondContact O-N 3.48Å; I365-V368 PolarHBondContact O-N 3.26Å; I365-C369 WeakPolarHBondContact O-CB 3.48Å; I365-C369 PolarHBondContact O-N 2.87Å; I365-C369 PolarHBondContact O-SG 3.14Å; I365-C369 VanDerWaalsContact O-SG 3.4Å; I365-M456 HydrophobicContact CD1-CB 4.05Å; I365-M456 WeakPolarHBondContact CD1-O 3.32Å; I365-M456 HydrophobicContact CG1-CB 3.97Å; I365-M456 HydrophobicContact CG2-CB 4.15Å; I365-M456 HydrophobicContact CG2-CE 3.94Å; I365-M456 HydrophobicContact CG2-SD 4.1Å; I365-I457 HydrophobicContact CD1-CG1 4.28Å; I365-F493 HydrophobicContact CD1-CE1 4.08Å; I365-F493 HydrophobicContact CD1-CZ 4.3Å; I365-F493 HydrophobicContact CG2-CE1 4.38Å; I365-F493 HydrophobicContact CG2-CE2 4.25Å; I365-F493 HydrophobicContact CG2-CZ 3.71Å; I365-F519 HydrophobicContact CB-CZ 4.36Å; I365-F519 HydrophobicContact CG2-CZ 4.13Å
366	A	98.8	Very high	97.8	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-61.7	-27.5	176.5	0	0	0	0	0	112.8	E362 R370 F519 L520 I522 A523	E362-A366 WeakPolarHBondContact O-CB 3.35Å; E362-A366 PolarHBondContact O-N 3.45Å; A366-R370 VanDerWaalsContact O-CB 3.31Å; A366-R370 WeakPolarHBondContact O-CB 3.45Å; A366-R370 PolarHBondContact O-N 3.38Å; A366-R370 VanDerWaalsContact O-N 3.11Å; A366-F519 HydrophobicContact CB-CD1 3.98Å; A366-F519 HydrophobicContact CB-CD2 4.24Å; A366-F519 HydrophobicContact CB-CE1 3.65Å; A366-F519 HydrophobicContact CB-CE2 3.92Å; A366-F519 HydrophobicContact CB-CG 4.27Å; A366-F519 HydrophobicContact CB-CZ 3.61Å; A366-F519 WeakPolarHBondContact CB-O 3.41Å; A366-L520 HydrophobicContact CB-CD2 4.48Å; A366-L520 WeakPolarHBondContact O-CD2 3.43Å; A366-I522 HydrophobicContact CB-CG1 4.28Å; A366-A523 VanDerWaalsContact C-CB 3.46Å; A366-A523 HydrophobicContact CB-CB 3.73Å; A366-A523 WeakPolarHBondContact O-CB 3.28Å
367	A	98.8	Very high	98	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-70.8	-51.3	173.5	0	0	0	0	0	111.4	G363 Q364 I365 C369 R370 E371 A523 K524 L526	G363-A367 PolarHBondContact O-N 3.42Å; Q364-A367 WeakPolarHBondContact O-CB 3.48Å; Q364-A367 PolarHBondContact O-N 2.97Å; Q364-A367 VanDerWaalsContact O-N 3.11Å; I365-A367 PolarHBondContact O-N 3.48Å; A367-C369 PolarHBondContact O-N 3.03Å; A367-R370 WeakPolarHBondContact O-CB 3.47Å; A367-R370 PolarHBondContact O-N 3.16Å; A367-R370 VanDerWaalsContact O-N 3.15Å; A367-E371 WeakPolarHBondContact O-CG 3.26Å; A367-E371 PolarHBondContact O-N 2.96Å; A367-E371 VanDerWaalsContact O-N 3.13Å; A367-A523 HydrophobicContact CB-CB 4.29Å; A367-K524 WeakPolarHBondContact CB-O 3.36Å; A367-L526 HydrophobicContact CB-CD2 4.03Å
368	V	98.8	Very high	98.2	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-57.3	-49.1	175.3	174.7	0	0	0	0	111	L351 M360 Q364 I365 R370 E371 C372 V402 M452 M456 L529	L351-V368 HydrophobicContact CD1-CG2 4.47Å; L351-V368 HydrophobicContact CD2-CG1 3.81Å; M360-V368 HydrophobicContact CE-CG2 3.9Å; Q364-V368 PolarHBondContact O-N 3.26Å; Q364-V368 VanDerWaalsContact O-N 3.07Å; I365-V368 PolarHBondContact O-N 3.26Å; V368-R370 VanDerWaalsContact C-N 3.28Å; V368-R370 PolarHBondContact O-N 3.2Å; V368-E371 PolarHBondContact O-N 3.27Å; V368-C372 WeakPolarHBondContact O-CB 3.39Å; V368-C372 PolarHBondContact O-N 3.06Å; V368-C372 PolarHBondContact O-SG 3.25Å; V368-V402 HydrophobicContact CG1-CG1 4.25Å; V368-V402 HydrophobicContact CG2-CG2 4.26Å; V368-M452 HydrophobicContact CG1-CE 3.97Å; V368-M456 HydrophobicContact CB-CE 4.33Å; V368-M456 HydrophobicContact CB-SD 3.89Å; V368-M456 HydrophobicContact CG1-CE 3.99Å; V368-M456 HydrophobicContact CG1-SD 3.8Å; V368-M456 HydrophobicContact CG2-SD 4.33Å; V368-L529 HydrophobicContact CG2-CD1 3.84Å; V368-L529 HydrophobicContact CG2-CD2 4.23Å
369	C	98.9	Very high	98.3	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-56.4	-38.5	176.9	-73.3	0	0	0	0	113	I365 A367 L373 F496 L520	I365-C369 WeakPolarHBondContact O-CB 3.48Å; I365-C369 PolarHBondContact O-N 2.87Å; I365-C369 PolarHBondContact O-SG 3.14Å; I365-C369 VanDerWaalsContact O-SG 3.4Å; A367-C369 PolarHBondContact O-N 3.03Å; C369-L373 VanDerWaalsContact O-CB 3.27Å; C369-L373 WeakPolarHBondContact O-CB 3.47Å; C369-L373 WeakPolarHBondContact O-CD1 3.43Å; C369-L373 WeakPolarHBondContact O-CG 3.27Å; C369-L373 PolarHBondContact O-N 2.84Å; C369-F496 HydrophobicContact CB-CE1 4.14Å; C369-F496 HydrophobicContact CB-CZ 3.96Å; C369-L520 HydrophobicContact CB-CD2 4.02Å
370	R	98.8	Very high	98.3	Very high	56 Å²	56	20.5 Å²	20.5	21%	0.211	10%	0.097	C	C	.	.	H	α-helix	trans	-65.3	-48.8	177.4	-179.3	-171.4	66.2	-134.1	-12.7	111.8	A366 A367 V368 L373 Q374 L520	A366-R370 VanDerWaalsContact O-CB 3.31Å; A366-R370 WeakPolarHBondContact O-CB 3.45Å; A366-R370 PolarHBondContact O-N 3.38Å; A366-R370 VanDerWaalsContact O-N 3.11Å; A367-R370 WeakPolarHBondContact O-CB 3.47Å; A367-R370 PolarHBondContact O-N 3.16Å; A367-R370 VanDerWaalsContact O-N 3.15Å; V368-R370 VanDerWaalsContact C-N 3.28Å; V368-R370 PolarHBondContact O-N 3.2Å; R370-L373 PolarHBondContact O-N 3.04Å; R370-Q374 WeakPolarHBondContact O-CG 3.5Å; R370-Q374 PolarHBondContact O-N 2.78Å; R370-L520 HydrophobicContact CB-CD1 4.34Å; R370-L520 HydrophobicContact CB-CD2 4.26Å
371	E	98.7	Very high	98.2	Very high	21 Å²	21	22.5 Å²	22.5	10%	0.098	11%	0.113	C	C	.	.	H	α-helix	trans	-64.3	-41.7	179.8	-56	-47	115.9	0	0	111.3	N325 A367 V368 L373 Q374 A375 V402 L526	N325-E371 WeakPolarHBondContact CB-O 3.49Å; N325-E371 WeakPolarHBondContact ND2-CB 3.28Å; N325-E371 PolarHBondContact ND2-OE2 2.67Å; A367-E371 WeakPolarHBondContact O-CG 3.26Å; A367-E371 PolarHBondContact O-N 2.96Å; A367-E371 VanDerWaalsContact O-N 3.13Å; V368-E371 PolarHBondContact O-N 3.27Å; E371-L373 PolarHBondContact O-N 2.77Å; E371-Q374 WeakPolarHBondContact O-CB 3.35Å; E371-Q374 PolarHBondContact O-N 3.32Å; E371-Q374 PolarHBondContact OE2-OE1 2.96Å; E371-A375 PolarHBondContact O-N 3.34Å; E371-A375 VanDerWaalsContact O-N 3.09Å; E371-V402 HydrophobicContact CB-CB 3.74Å; E371-V402 HydrophobicContact CB-CG1 4.07Å; E371-V402 HydrophobicContact CB-CG2 4.41Å; E371-V402 HydrophobicContact CG-CB 3.91Å; E371-V402 HydrophobicContact CG-CG2 4.12Å; E371-L526 HydrophobicContact CG-CD1 4.07Å; E371-L526 HydrophobicContact CG-CD2 3.82Å
372	C	98.8	Very high	98	Very high	7 Å²	7	23.1 Å²	23.1	5%	0.047	12%	0.116	C	C	.	.	H	α-helix	trans	-62.9	-40.1	174.2	-63.9	0	0	0	0	112.1	V368 Q374 A375 L376 I394 L449	V368-C372 WeakPolarHBondContact O-CB 3.39Å; V368-C372 PolarHBondContact O-N 3.06Å; V368-C372 PolarHBondContact O-SG 3.25Å; C372-Q374 VanDerWaalsContact C-N 3.34Å; C372-Q374 PolarHBondContact O-N 3.06Å; C372-A375 PolarHBondContact O-N 3.18Å; C372-L376 WeakPolarHBondContact O-CB 3.48Å; C372-L376 WeakPolarHBondContact O-CG 3.47Å; C372-L376 PolarHBondContact O-N 3.17Å; C372-I394 VanDerWaalsContact SG-CD1 3.56Å; C372-L449 HydrophobicContact CB-CD1 3.86Å
373	L	98.8	Very high	97.8	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-67.6	-31.2	175.6	-78.2	166.9	0	0	0	113.2	C369 R370 E371 L376 E377 I446 L449 F496 A511 L514 L515 L520	C369-L373 VanDerWaalsContact O-CB 3.27Å; C369-L373 WeakPolarHBondContact O-CB 3.47Å; C369-L373 WeakPolarHBondContact O-CD1 3.43Å; C369-L373 WeakPolarHBondContact O-CG 3.27Å; C369-L373 PolarHBondContact O-N 2.84Å; R370-L373 PolarHBondContact O-N 3.04Å; E371-L373 PolarHBondContact O-N 2.77Å; L373-L376 PolarHBondContact O-N 2.85Å; L373-E377 WeakPolarHBondContact O-CB 3.31Å; L373-E377 PolarHBondContact O-N 3.49Å; L373-I446 HydrophobicContact CD2-CD1 3.95Å; L373-L449 HydrophobicContact CD1-CD2 4.19Å; L373-L449 HydrophobicContact CD2-CD2 3.49Å; L373-L449 VanDerWaalsContact CD2-CD2 3.49Å; L373-L449 HydrophobicContact CG-CD2 3.57Å; L373-F496 HydrophobicContact CD1-CE2 3.95Å; L373-F496 HydrophobicContact CD1-CZ 3.89Å; L373-A511 HydrophobicContact CD2-CB 4.09Å; L373-L514 HydrophobicContact CD1-CB 3.77Å; L373-L514 HydrophobicContact CD2-CB 3.84Å; L373-L514 HydrophobicContact CD2-CD1 4.14Å; L373-L515 HydrophobicContact CB-CD2 3.55Å; L373-L515 HydrophobicContact CB-CG 3.88Å; L373-L520 HydrophobicContact CD1-CD1 3.7Å
374	Q	98.6	Very high	97.6	Very high	69 Å²	69	24.5 Å²	24.5	32%	0.322	12%	0.122	S	C	.	.	H	α-helix	trans	-67.1	-42.3	172.7	-72.7	164.3	-23.6	0	0	111.4	N325 R370 E371 C372 F378 L515	N325-Q374 PolarHBondContact OD1-OE1 3.11Å; R370-Q374 WeakPolarHBondContact O-CG 3.5Å; R370-Q374 PolarHBondContact O-N 2.78Å; E371-Q374 WeakPolarHBondContact O-CB 3.35Å; E371-Q374 PolarHBondContact O-N 3.32Å; E371-Q374 PolarHBondContact OE2-OE1 2.96Å; C372-Q374 VanDerWaalsContact C-N 3.34Å; C372-Q374 PolarHBondContact O-N 3.06Å; Q374-F378 WeakPolarHBondContact O-CB 3.49Å; Q374-F378 PolarHBondContact O-N 2.92Å; Q374-L515 HydrophobicContact CG-CD2 3.87Å
375	A	98.2	Very high	97.4	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-61.9	-44.4	171.9	0	0	0	0	0	111.8	N325 I326 E371 C372 F378 L379 L404	N325-A375 HydrophobicContact CB-CB 3.95Å; N325-A375 WeakPolarHBondContact O-CB 3.48Å; I326-A375 HydrophobicContact CG1-CB 3.98Å; E371-A375 PolarHBondContact O-N 3.34Å; E371-A375 VanDerWaalsContact O-N 3.09Å; C372-A375 PolarHBondContact O-N 3.18Å; A375-F378 PolarHBondContact O-N 2.99Å; A375-L379 WeakPolarHBondContact O-CG 3.36Å; A375-L379 PolarHBondContact O-N 3.48Å; A375-L404 HydrophobicContact CB-CB 4.22Å; A375-L404 HydrophobicContact CB-CD2 4.19Å
376	L	98.4	Very high	97.2	Very high	1 Å²	1	23.5 Å²	23.5	1%	0.005	12%	0.117	C	C	.	.	H	α-helix	trans	-68.6	-40.4	-179.8	-71.2	177.1	0	0	0	113.2	C372 L373 F378 L379 H380 I389 D445 I446 L449 A511	C372-L376 WeakPolarHBondContact O-CB 3.48Å; C372-L376 WeakPolarHBondContact O-CG 3.47Å; C372-L376 PolarHBondContact O-N 3.17Å; L373-L376 PolarHBondContact O-N 2.85Å; L376-F378 VanDerWaalsContact C-N 3.3Å; L376-F378 PolarHBondContact O-N 3.11Å; L376-L379 PolarHBondContact O-N 3.17Å; L376-H380 VanDerWaalsContact O-CB 3.22Å; L376-H380 WeakPolarHBondContact O-CB 3.36Å; L376-H380 PolarHBondContact O-CD2 3.22Å; L376-H380 VanDerWaalsContact O-CD2 3.25Å; L376-H380 PolarHBondContact O-N 3.4Å; L376-I389 HydrophobicContact CD2-CD1 3.91Å; L376-I389 HydrophobicContact CD2-CG1 4.2Å; L376-D445 HydrophobicContact CD1-CB 4.15Å; L376-D445 HydrophobicContact CD2-CB 3.71Å; L376-I446 HydrophobicContact CD1-CD1 4.13Å; L376-L449 HydrophobicContact CD1-CD2 4.45Å; L376-A511 HydrophobicContact CB-CB 4.03Å
377	E	98.4	Very high	97	Very high	55 Å²	55	24.5 Å²	24.5	26%	0.257	12%	0.121	S	C	.	.	H	α-helix	trans	-62.8	-40.2	176.6	-158	-85.9	175.3	0	0	111.2	L373 S381 A511 K512 L515	L373-E377 WeakPolarHBondContact O-CB 3.31Å; L373-E377 PolarHBondContact O-N 3.49Å; E377-S381 VanDerWaalsContact O-CB 3.28Å; E377-S381 WeakPolarHBondContact O-CB 3.49Å; E377-S381 PolarHBondContact O-N 2.88Å; E377-S381 PolarHBondContact O-OG 3.19Å; E377-A511 HydrophobicContact CB-CB 3.87Å; E377-A511 HydrophobicContact CG-CB 4.36Å; E377-K512 HydrophobicContact CG-CB 3.79Å; E377-K512 HydrophobicContact CG-CG 4.33Å; E377-K512 WeakPolarHBondContact OE1-CD 3.49Å; E377-K512 IonicContact OE1-NZ 3.04Å; E377-L515 HydrophobicContact CB-CD1 3.88Å; E377-L515 HydrophobicContact CG-CD1 4.13Å
378	F	97.8	Very high	96.7	Very high	47 Å²	47	24.7 Å²	24.7	21%	0.206	12%	0.122	C	C	.	.	H	α-helix	trans	-65	-42.8	174	174.3	-102.1	0	0	0	112.9	N321 K322 N323 I326 Q374 A375 L376 S381 N382	N321-F378 HydrophobicContact CB-CE1 3.75Å; N321-F378 HydrophobicContact CB-CZ 4.33Å; K322-F378 WeakPolarHBondContact O-CZ 3.5Å; N323-F378 HydrophobicContact CB-CD1 3.56Å; N323-F378 HydrophobicContact CB-CE1 3.6Å; N323-F378 HydrophobicContact CB-CG 4.07Å; N323-F378 HydrophobicContact CB-CZ 4.16Å; N323-F378 WeakPolarHBondContact ND2-CB 3.33Å; N323-F378 VanDerWaalsContact ND2-CG 3.34Å; N323-F378 WeakPolarHBondContact ND2-CG 3.4Å; I326-F378 HydrophobicContact CD1-CD1 3.85Å; I326-F378 HydrophobicContact CD1-CE1 4.12Å; Q374-F378 WeakPolarHBondContact O-CB 3.49Å; Q374-F378 PolarHBondContact O-N 2.92Å; A375-F378 PolarHBondContact O-N 2.99Å; L376-F378 VanDerWaalsContact C-N 3.3Å; L376-F378 PolarHBondContact O-N 3.11Å; F378-S381 WeakPolarHBondContact CA-OG 3.35Å; F378-S381 PolarHBondContact O-OG 3.21Å; F378-N382 WeakPolarHBondContact CE2-ND2 3.23Å; F378-N382 WeakPolarHBondContact O-CB 3.35Å; F378-N382 PolarHBondContact O-N 2.78Å; F378-N382 PolarHBondContact O-ND2 2.96Å
379	L	96.2	Very high	96.7	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-68	-45.9	176.3	-71.2	170.8	0	0	0	111.8	N321 I326 A375 L376 S381 N382 Q383 V384 L404 F407	N321-L379 HydrophobicContact CB-CD2 4.09Å; I326-L379 HydrophobicContact CD1-CD1 4.06Å; I326-L379 HydrophobicContact CD1-CD2 3.85Å; I326-L379 HydrophobicContact CD1-CG 3.84Å; A375-L379 WeakPolarHBondContact O-CG 3.36Å; A375-L379 PolarHBondContact O-N 3.48Å; L376-L379 PolarHBondContact O-N 3.17Å; L379-S381 PolarHBondContact O-N 2.91Å; L379-N382 CarbonylContact O-C 3.51Å; L379-N382 WeakPolarHBondContact O-CA 3.35Å; L379-N382 PolarHBondContact O-N 2.96Å; L379-Q383 PolarHBondContact O-N 3.15Å; L379-Q383 VanDerWaalsContact O-N 3.15Å; L379-V384 CarbonylContact C-O 3.47Å; L379-V384 HydrophobicContact CB-CB 4.24Å; L379-V384 HydrophobicContact CD2-CB 4.08Å; L379-V384 HydrophobicContact CD2-CG1 4.07Å; L379-V384 PolarHBondContact O-N 2.96Å; L379-L404 HydrophobicContact CD1-CD2 3.73Å; L379-F407 HydrophobicContact CD1-CE1 3.83Å; L379-F407 HydrophobicContact CD1-CZ 4.28Å; L379-F407 HydrophobicContact CD2-CE1 3.88Å
380	H	96.6	Very high	96.6	Very high	25 Å²	25	25.9 Å²	25.9	12%	0.116	13%	0.127	C	C	.	.	H	α-helix	trans	-66.5	-37.8	-176.7	-67.1	-171.2	0	0	0	111.8	L376 Q383 V384 P442 D445	L376-H380 VanDerWaalsContact O-CB 3.22Å; L376-H380 WeakPolarHBondContact O-CB 3.36Å; L376-H380 PolarHBondContact O-CD2 3.22Å; L376-H380 VanDerWaalsContact O-CD2 3.25Å; L376-H380 PolarHBondContact O-N 3.4Å; H380-Q383 PolarHBondContact O-N 2.65Å; H380-Q383 VanDerWaalsContact O-N 3.16Å; H380-Q383 PolarHBondContact O-NE2 3.15Å; H380-V384 PolarHBondContact CD2-O 3.47Å; H380-P442 HydrophobicContact CB-CB 4.15Å; H380-P442 PolarHBondContact CE1-O 2.93Å; H380-P442 WeakPolarHBondContact ND1-CB 3.45Å; H380-P442 PolarHBondContact NE2-O 3.1Å; H380-D445 IonicContact CD2-OD2 2.95Å; H380-D445 IonicContact CE1-OD2 3.32Å; H380-D445 IonicContact NE2-OD2 2.7Å; H380-D445 PolarHBondContact NE2-OD2 3.33Å
381	S	95.9	Very high	96.5	Very high	64 Å²	64	23.3 Å²	23.3	45%	0.448	12%	0.118	S	C	.	.	H	α-helix	trans	-64.9	-41.6	172.6	54.2	0	0	0	0	111.9	E377 F378 L379 Q383	E377-S381 VanDerWaalsContact O-CB 3.28Å; E377-S381 WeakPolarHBondContact O-CB 3.49Å; E377-S381 PolarHBondContact O-N 2.88Å; E377-S381 PolarHBondContact O-OG 3.19Å; F378-S381 WeakPolarHBondContact CA-OG 3.35Å; F378-S381 PolarHBondContact O-OG 3.21Å; L379-S381 PolarHBondContact O-N 2.91Å; S381-Q383 PolarHBondContact O-N 2.88Å; S381-Q383 VanDerWaalsContact O-N 3.12Å; S381-Q383 PolarHBondContact O-NE2 3.23Å; S381-Q383 VanDerWaalsContact O-NE2 3.15Å
382	N	93.9	Very high	96.3	Very high	74 Å²	74	25.5 Å²	25.5	40%	0.396	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	13.6	171.7	-74.2	-80.9	0	0	0	114.5	N321 F378 L379 V384	N321-N382 WeakPolarHBondContact ND2-CB 3.31Å; F378-N382 WeakPolarHBondContact CE2-ND2 3.23Å; F378-N382 WeakPolarHBondContact O-CB 3.35Å; F378-N382 PolarHBondContact O-N 2.78Å; F378-N382 PolarHBondContact O-ND2 2.96Å; L379-N382 CarbonylContact O-C 3.51Å; L379-N382 WeakPolarHBondContact O-CA 3.35Å; L379-N382 PolarHBondContact O-N 2.96Å; N382-V384 VanDerWaalsContact C-N 3.3Å; N382-V384 PolarHBondContact O-N 3.05Å
383	Q	93.8	Very high	96.1	Very high	75 Å²	75	25.6 Å²	25.6	35%	0.35	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.3	31.2	177.6	-55.3	-53.3	-67.6	0	0	114.1	L379 H380 S381 Q412 I413	L379-Q383 PolarHBondContact O-N 3.15Å; L379-Q383 VanDerWaalsContact O-N 3.15Å; H380-Q383 PolarHBondContact O-N 2.65Å; H380-Q383 VanDerWaalsContact O-N 3.16Å; H380-Q383 PolarHBondContact O-NE2 3.15Å; S381-Q383 PolarHBondContact O-N 2.88Å; S381-Q383 VanDerWaalsContact O-N 3.12Å; S381-Q383 PolarHBondContact O-NE2 3.23Å; S381-Q383 VanDerWaalsContact O-NE2 3.15Å; Q383-Q412 CarbonylContact O-C 3.47Å; Q383-Q412 VanDerWaalsContact O-CA 3.26Å; Q383-Q412 WeakPolarHBondContact O-CA 3.15Å; Q383-I413 HydrophobicContact CB-CG1 3.96Å; Q383-I413 WeakPolarHBondContact CB-O 3.19Å; Q383-I413 WeakPolarHBondContact O-CG1 3.16Å; Q383-I413 PolarHBondContact O-N 3.38Å
384	V	93.9	Very high	96.1	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	133.1	173.9	-178.5	0	0	0	0	110.2	V317 L379 H380 N382 C410	V317-V384 HydrophobicContact CG1-CG1 4.02Å; V317-V384 HydrophobicContact CG1-CG2 4.41Å; V317-V384 HydrophobicContact CG2-CG2 4.43Å; L379-V384 CarbonylContact C-O 3.47Å; L379-V384 HydrophobicContact CB-CB 4.24Å; L379-V384 HydrophobicContact CD2-CB 4.08Å; L379-V384 HydrophobicContact CD2-CG1 4.07Å; L379-V384 PolarHBondContact O-N 2.96Å; H380-V384 PolarHBondContact CD2-O 3.47Å; N382-V384 VanDerWaalsContact C-N 3.3Å; N382-V384 PolarHBondContact O-N 3.05Å; V384-C410 HydrophobicContact CG1-CB 4.15Å
385	I	94.9	Very high	96.1	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	134.8	170.3	-44.9	176.2	0	0	0	108.3	R387 C410 A411 I413 P442 V444 D445	I385-R387 HydrophobicContact CB-CG 3.99Å; I385-R387 HydrophobicContact CG2-CG 3.48Å; I385-R387 VanDerWaalsContact CG2-CG 3.48Å; I385-C410 CarbonylContact O-C 3.56Å; I385-C410 VanDerWaalsContact O-CA 3.25Å; I385-C410 WeakPolarHBondContact O-CA 3.33Å; I385-A411 PolarHBondContact N-O 3.41Å; I385-A411 PolarHBondContact O-N 3.25Å; I385-I413 HydrophobicContact CD1-CD1 4.36Å; I385-I413 HydrophobicContact CD1-CG2 3.85Å; I385-I413 HydrophobicContact CG1-CD1 4.48Å; I385-I413 HydrophobicContact CG1-CG2 4.38Å; I385-P442 HydrophobicContact CD1-CG 4.35Å; I385-P442 HydrophobicContact CG1-CB 4.28Å; I385-P442 HydrophobicContact CG1-CG 4.05Å; I385-V444 HydrophobicContact CG2-CG2 3.65Å; I385-D445 WeakPolarHBondContact CG2-OD2 3.28Å
386	H	94.9	Very high	96.1	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.125	C	C	.	.			trans	-77.4	-50.7	-177.8	-158.5	-99.6	0	0	0	112.8	D388 I389 T405 F407 F409 C410 D445	H386-D388 PolarHBondContact CE1-O 3.11Å; H386-D388 PolarHBondContact ND1-O 3.18Å; H386-D388 VanDerWaalsContact ND1-O 3.14Å; H386-D388 PolarHBondContact O-N 2.68Å; H386-I389 HydrophobicContact CB-CD1 3.75Å; H386-I389 HydrophobicContact CB-CG1 4.05Å; H386-I389 WeakPolarHBondContact ND1-CD1 3.17Å; H386-T405 PolarHBondContact CE1-O 3.07Å; H386-T405 PolarHBondContact NE2-O 3.14Å; H386-F407 AromaticContact CD2-CE1 3.97Å; H386-F409 CarbonylContact O-C 3.58Å; H386-C410 PolarHBondContact CD2-SG 3.08Å; H386-D445 PolarHBondContact N-OD1 3.34Å; H386-D445 PolarHBondContact N-OD2 3.24Å
387	R	93.5	Very high	96	Very high	20 Å²	20	24.4 Å²	24.4	8%	0.075	13%	0.127	C	C	.	.	S	Bend	trans	67.8	7.3	176.9	-47.3	-174.2	-66.3	172.9	0.3	116.8	I385 F409 C410 A411 T422 V424 G425 Y440 V444 D445	I385-R387 HydrophobicContact CB-CG 3.99Å; I385-R387 HydrophobicContact CG2-CG 3.48Å; I385-R387 VanDerWaalsContact CG2-CG 3.48Å; R387-F409 PolarHBondContact NE-O 3.26Å; R387-F409 PolarHBondContact NH2-O 3.27Å; R387-C410 PolarHBondContact NH2-O 3.42Å; R387-C410 VanDerWaalsContact NH2-O 3.11Å; R387-A411 VanDerWaalsContact CZ-CB 3.49Å; R387-T422 PolarHBondContact NH1-OG1 3.22Å; R387-V424 HydrophobicContact CB-CG2 3.9Å; R387-V424 VanDerWaalsContact CZ-CG2 3.42Å; R387-G425 WeakPolarHBondContact O-CA 3.42Å; R387-Y440 VanDerWaalsContact CD-OH 3.26Å; R387-Y440 WeakPolarHBondContact CD-OH 3.48Å; R387-Y440 HydrophobicContact CG-CE2 4.36Å; R387-Y440 PolarHBondContact NH1-OH 3.37Å; R387-V444 HydrophobicContact CG-CG2 4.45Å; R387-D445 PolarHBondContact N-OD1 2.89Å
388	D	93.8	Very high	96	Very high	5 Å²	5	25.5 Å²	25.5	3%	0.027	13%	0.133	C	C	.	.			trans	-150	64.8	170.8	-154.6	48	0	0	0	109.3	H386 K390 N393 F409 T426	H386-D388 PolarHBondContact CE1-O 3.11Å; H386-D388 PolarHBondContact ND1-O 3.18Å; H386-D388 VanDerWaalsContact ND1-O 3.14Å; H386-D388 PolarHBondContact O-N 2.68Å; D388-K390 VanDerWaalsContact OD2-CE 3.25Å; D388-K390 WeakPolarHBondContact OD2-CE 3.27Å; D388-K390 IonicContact OD2-NZ 2.6Å; D388-N393 PolarHBondContact O-ND2 3.16Å; D388-N393 PolarHBondContact OD2-ND2 3.07Å; D388-F409 HydrophobicContact CB-CB 4.3Å; D388-F409 HydrophobicContact CB-CD2 3.79Å; D388-T426 VanDerWaalsContact OD1-CB 3.3Å; D388-T426 WeakPolarHBondContact OD1-CB 3.35Å; D388-T426 PolarHBondContact OD1-N 3.35Å; D388-T426 PolarHBondContact OD1-OG1 2.73Å; D388-T426 PolarHBondContact OD2-OG1 2.94Å
389	I	97.9	Very high	95.9	Very high	2 Å²	2	28.3 Å²	28.3	1%	0.01	15%	0.15	C	C	.	.			trans	-88.3	125.9	171.6	-60.9	-64.7	0	0	0	108.3	L376 H386 L404 W429 D445 S448 L449 M452	L376-I389 HydrophobicContact CD2-CD1 3.91Å; L376-I389 HydrophobicContact CD2-CG1 4.2Å; H386-I389 HydrophobicContact CB-CD1 3.75Å; H386-I389 HydrophobicContact CB-CG1 4.05Å; H386-I389 WeakPolarHBondContact ND1-CD1 3.17Å; I389-L404 HydrophobicContact CD1-CD1 3.48Å; I389-L404 VanDerWaalsContact CD1-CD1 3.48Å; I389-L404 HydrophobicContact CD1-CD2 3.89Å; I389-L404 HydrophobicContact CD1-CG 4.36Å; I389-W429 VanDerWaalsContact O-CD1 3.32Å; I389-D445 HydrophobicContact CG1-CB 3.99Å; I389-S448 WeakPolarHBondContact O-CB 3.38Å; I389-L449 HydrophobicContact CG2-CB 4.36Å; I389-M452 HydrophobicContact CG2-SD 4.18Å
390	K	96.6	Very high	96	Very high	22 Å²	22	28.3 Å²	28.3	10%	0.096	15%	0.15	C	C	.	.	S	Bend	trans	-171.9	164.5	-176.6	52.6	172.4	-178.7	157.8	0	109.5	D388 D392 N393 W429	D388-K390 VanDerWaalsContact OD2-CE 3.25Å; D388-K390 WeakPolarHBondContact OD2-CE 3.27Å; D388-K390 IonicContact OD2-NZ 2.6Å; K390-D392 VanDerWaalsContact C-N 3.32Å; K390-D392 HydrophobicContact CD-CB 4.07Å; K390-D392 WeakPolarHBondContact CD-OD2 3.34Å; K390-D392 WeakPolarHBondContact CE-OD2 3.43Å; K390-D392 HydrophobicContact CG-CB 4.28Å; K390-D392 IonicContact NZ-OD2 3.91Å; K390-D392 PolarHBondContact NZ-OD2 2.99Å; K390-D392 PolarHBondContact O-N 2.8Å; K390-N393 VanDerWaalsContact CE-ND2 3.32Å; K390-N393 WeakPolarHBondContact CE-ND2 3.35Å; K390-N393 HydrophobicContact CG-CB 4.21Å; K390-N393 PolarHBondContact O-N 3.07Å; K390-W429 HydrophobicContact CB-CD2 3.81Å; K390-W429 VanDerWaalsContact CB-CE2 3.41Å; K390-W429 HydrophobicContact CB-CG 3.93Å; K390-W429 HydrophobicContact CB-CZ2 3.86Å; K390-W429 VanDerWaalsContact CB-NE1 3.3Å; K390-W429 HydrophobicContact CD-CZ2 4.48Å
391	S	96.9	Very high	96	Very high	2 Å²	2	28.2 Å²	28.2	1%	0.014	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-44.6	-49	174.6	53	0	0	0	0	114.4	L351 T352 N393 I394 E455	L351-S391 WeakPolarHBondContact CB-O 3.47Å; T352-S391 VanDerWaalsContact OG1-C 3.26Å; T352-S391 WeakPolarHBondContact OG1-CB 3.5Å; T352-S391 PolarHBondContact OG1-OG 3.33Å; S391-N393 PolarHBondContact O-N 3.44Å; S391-N393 VanDerWaalsContact O-N 3.08Å; S391-I394 PolarHBondContact O-N 2.75Å; S391-E455 WeakPolarHBondContact CB-OE1 3.28Å; S391-E455 PolarHBondContact N-OE2 3.41Å; S391-E455 VanDerWaalsContact N-OE2 3.12Å; S391-E455 PolarHBondContact OG-OE1 3.23Å
392	D	94.1	Very high	96.2	Very high	68 Å²	68	25.3 Å²	25.3	36%	0.364	13%	0.131	S	C	.	.	G	3₁₀ helix	trans	-55.2	-32.9	-178.7	-60.1	-34.3	0	0	0	113.6	T352 K390	T352-D392 WeakPolarHBondContact OG1-CA 3.44Å; T352-D392 PolarHBondContact OG1-N 2.93Å; T352-D392 PolarHBondContact OG1-OD1 2.92Å; K390-D392 VanDerWaalsContact C-N 3.32Å; K390-D392 HydrophobicContact CD-CB 4.07Å; K390-D392 WeakPolarHBondContact CD-OD2 3.34Å; K390-D392 WeakPolarHBondContact CE-OD2 3.43Å; K390-D392 HydrophobicContact CG-CB 4.28Å; K390-D392 IonicContact NZ-OD2 3.91Å; K390-D392 PolarHBondContact NZ-OD2 2.99Å; K390-D392 PolarHBondContact O-N 2.8Å
393	N	95.9	Very high	96.4	Very high	9 Å²	9	23.3 Å²	23.3	5%	0.048	12%	0.119	C	C	.	.	G	3₁₀ helix	trans	-97.5	5.7	-172.5	-66.3	-9.1	0	0	0	112.1	D388 K390 S391 T405	D388-N393 PolarHBondContact O-ND2 3.16Å; D388-N393 PolarHBondContact OD2-ND2 3.07Å; K390-N393 VanDerWaalsContact CE-ND2 3.32Å; K390-N393 WeakPolarHBondContact CE-ND2 3.35Å; K390-N393 HydrophobicContact CG-CB 4.21Å; K390-N393 PolarHBondContact O-N 3.07Å; S391-N393 PolarHBondContact O-N 3.44Å; S391-N393 VanDerWaalsContact O-N 3.08Å; N393-T405 WeakPolarHBondContact O-CG2 3.46Å; N393-T405 PolarHBondContact O-N 3.38Å
394	I	98.3	Very high	96.6	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	118.4	167.8	-56.5	-52	0	0	0	108.4	S350 L351 C372 S391 V402 L404 M452	S350-I394 CarbonylContact C-O 3.57Å; S350-I394 WeakPolarHBondContact CA-O 3.43Å; L351-I394 HydrophobicContact CB-CB 3.9Å; L351-I394 HydrophobicContact CB-CG2 4.13Å; L351-I394 HydrophobicContact CD2-CB 4.15Å; L351-I394 HydrophobicContact CD2-CG1 4.35Å; L351-I394 HydrophobicContact CD2-CG2 4.24Å; L351-I394 PolarHBondContact N-O 3.24Å; C372-I394 VanDerWaalsContact SG-CD1 3.56Å; S391-I394 PolarHBondContact O-N 2.75Å; I394-V402 HydrophobicContact CG2-CG1 3.47Å; I394-V402 VanDerWaalsContact CG2-CG1 3.47Å; I394-L404 HydrophobicContact CD1-CB 4.4Å; I394-L404 HydrophobicContact CD1-CD1 3.78Å; I394-M452 HydrophobicContact CD1-SD 4.32Å; I394-M452 HydrophobicContact CG1-CE 4.13Å; I394-M452 HydrophobicContact CG1-SD 3.54Å; I394-M452 VanDerWaalsContact CG1-SD 3.54Å
395	L	97.9	Very high	96.5	Very high	39 Å²	39	20.7 Å²	20.7	20%	0.204	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	148.4	177.3	-62.3	-172.5	0	0	0	111.5	V327 L346 G349 K403 T405	V327-L395 HydrophobicContact CG2-CD1 4.19Å; L346-L395 HydrophobicContact CB-CB 4.03Å; L346-L395 HydrophobicContact CD1-CB 3.47Å; L346-L395 VanDerWaalsContact CD1-CB 3.47Å; L346-L395 HydrophobicContact CD1-CD1 4.27Å; L346-L395 HydrophobicContact CG-CB 4.42Å; G349-L395 WeakPolarHBondContact O-CA 3.41Å; L395-K403 PolarHBondContact N-O 2.86Å; L395-K403 PolarHBondContact O-N 3.44Å; L395-T405 HydrophobicContact CD1-CG2 3.9Å; L395-T405 HydrophobicContact CD2-CG2 4.31Å; L395-T405 HydrophobicContact CG-CG2 3.71Å
396	L	98.4	Very high	96.1	Very high	2 Å²	2	22.2 Å²	22.2	1%	0.01	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	136	-173.6	-58.7	177.6	0	0	0	111.7	L346 G348 G349 L351 V354 S401 V402 I533	L346-L396 CarbonylContact C-O 3.58Å; L346-L396 WeakPolarHBondContact CB-O 3.47Å; G348-L396 CarbonylContact C-O 3.42Å; G348-L396 WeakPolarHBondContact CA-O 3.31Å; G348-L396 PolarHBondContact N-O 3.22Å; G349-L396 PolarHBondContact O-N 3.28Å; L351-L396 HydrophobicContact CD1-CD1 4.38Å; V354-L396 HydrophobicContact CB-CD1 4.4Å; V354-L396 HydrophobicContact CG2-CD1 3.67Å; L396-S401 CarbonylContact C-O 3.59Å; L396-S401 WeakPolarHBondContact CA-O 3.3Å; L396-V402 HydrophobicContact CD2-CB 4.39Å; L396-V402 HydrophobicContact CD2-CG1 4.31Å; L396-V402 HydrophobicContact CD2-CG2 3.91Å; L396-I533 HydrophobicContact CB-CD1 3.85Å; L396-I533 HydrophobicContact CB-CG1 4.31Å; L396-I533 HydrophobicContact CD1-CD1 4.02Å; L396-I533 HydrophobicContact CD1-CG1 3.81Å; L396-I533 HydrophobicContact CG-CD1 4.46Å
397	G	97.6	Very high	95.7	Very high	4 Å²	4	22.3 Å²	22.3	4%	0.041	12%	0.117	C	C	.	.			trans	-84.6	156.6	166	0	0	0	0	0	111.6	D399 G400 S401 I533	G397-D399 WeakPolarHBondContact CA-OD1 3.38Å; G397-D399 PolarHBondContact O-N 2.8Å; G397-G400 WeakPolarHBondContact O-CA 3.15Å; G397-G400 PolarHBondContact O-N 2.76Å; G397-S401 PolarHBondContact N-O 2.93Å; G397-I533 WeakPolarHBondContact O-CD1 3.29Å
398	M	96.9	Very high	95.1	Very high	78 Å²	78	22 Å²	22	38%	0.384	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-20.3	177.1	-66.1	-61.4	-50.5	0	0	113.1	A347 T530 I533 I534 K537	A347-M398 HydrophobicContact CB-CG 4.08Å; M398-T530 VanDerWaalsContact O-CG2 3.25Å; M398-T530 WeakPolarHBondContact O-CG2 3.42Å; M398-T530 PolarHBondContact O-OG1 2.96Å; M398-I533 HydrophobicContact CE-CG2 4.27Å; M398-I533 HydrophobicContact SD-CG2 3.98Å; M398-I534 HydrophobicContact CE-CG1 4.09Å; M398-K537 HydrophobicContact SD-CD 4.41Å
399	D	96.4	Very high	94.5	Very high	105 Å²	105	24.6 Å²	24.6	56%	0.561	13%	0.131	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-3.4	170.5	66	-24.5	0	0	0	113.7	G397 S401	G397-D399 WeakPolarHBondContact CA-OD1 3.38Å; G397-D399 PolarHBondContact O-N 2.8Å; D399-S401 VanDerWaalsContact OD1-CB 3.28Å; D399-S401 WeakPolarHBondContact OD1-CB 3.1Å; D399-S401 PolarHBondContact OD1-N 2.93Å; D399-S401 PolarHBondContact OD1-OG 3.41Å; D399-S401 PolarHBondContact OD2-OG 3.39Å
400	G	97.5	Very high	94	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.134	C	C	.	.			trans	86.2	5.2	-173.6	0	0	0	0	0	114.5	G397 V402 L526	G397-G400 WeakPolarHBondContact O-CA 3.15Å; G397-G400 PolarHBondContact O-N 2.76Å; G400-V402 WeakPolarHBondContact O-CG2 3.29Å; G400-V402 PolarHBondContact O-N 3.33Å; G400-L526 WeakPolarHBondContact CA-O 3.13Å; G400-L526 WeakPolarHBondContact O-CB 3.27Å
401	S	98.1	Very high	93.5	Very high	23 Å²	23	24.3 Å²	24.3	16%	0.161	13%	0.132	C	C	.	.			trans	-58.9	137.8	176.6	55	0	0	0	0	111.6	L396 G397 D399	L396-S401 CarbonylContact C-O 3.59Å; L396-S401 WeakPolarHBondContact CA-O 3.3Å; G397-S401 PolarHBondContact N-O 2.93Å; D399-S401 VanDerWaalsContact OD1-CB 3.28Å; D399-S401 WeakPolarHBondContact OD1-CB 3.1Å; D399-S401 PolarHBondContact OD1-N 2.93Å; D399-S401 PolarHBondContact OD1-OG 3.41Å; D399-S401 PolarHBondContact OD2-OG 3.39Å
402	V	98.6	Very high	93	Very high	3 Å²	3	29.3 Å²	29.3	2%	0.018	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	122.8	-173.3	-176.3	0	0	0	0	109.2	V368 E371 I394 L396 G400 L526 L529	V368-V402 HydrophobicContact CG1-CG1 4.25Å; V368-V402 HydrophobicContact CG2-CG2 4.26Å; E371-V402 HydrophobicContact CB-CB 3.74Å; E371-V402 HydrophobicContact CB-CG1 4.07Å; E371-V402 HydrophobicContact CB-CG2 4.41Å; E371-V402 HydrophobicContact CG-CB 3.91Å; E371-V402 HydrophobicContact CG-CG2 4.12Å; I394-V402 HydrophobicContact CG2-CG1 3.47Å; I394-V402 VanDerWaalsContact CG2-CG1 3.47Å; L396-V402 HydrophobicContact CD2-CB 4.39Å; L396-V402 HydrophobicContact CD2-CG1 4.31Å; L396-V402 HydrophobicContact CD2-CG2 3.91Å; G400-V402 WeakPolarHBondContact O-CG2 3.29Å; G400-V402 PolarHBondContact O-N 3.33Å; V402-L526 HydrophobicContact CG2-CD2 4.06Å; V402-L529 HydrophobicContact CG2-CD1 3.81Å
403	K	98.3	Very high	92.7	Very high	32 Å²	32	26.3 Å²	26.3	14%	0.139	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	137.6	-177.7	-53.4	-165.8	-174.9	178.6	0	113.7	P324 N325 V327 E344 L346 L395	P324-K403 WeakPolarHBondContact O-CD 3.44Å; P324-K403 WeakPolarHBondContact O-CE 3.5Å; N325-K403 WeakPolarHBondContact O-CA 3.22Å; V327-K403 HydrophobicContact CG2-CB 3.91Å; E344-K403 WeakPolarHBondContact OE1-CD 3.48Å; E344-K403 IonicContact OE1-NZ 2.66Å; E344-K403 PolarHBondContact OE1-NZ 3.12Å; E344-K403 IonicContact OE2-NZ 3.28Å; E344-K403 PolarHBondContact OE2-NZ 3.13Å; L346-K403 HydrophobicContact CD1-CB 3.81Å; L346-K403 HydrophobicContact CD1-CD 4.05Å; L346-K403 HydrophobicContact CD1-CG 4.1Å; L346-K403 HydrophobicContact CD2-CD 4.32Å; L395-K403 PolarHBondContact N-O 2.86Å; L395-K403 PolarHBondContact O-N 3.44Å
404	L	97.4	Very high	92.3	Very high	3 Å²	3	28.7 Å²	28.7	2%	0.016	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	139.1	176.6	178.1	60.5	0	0	0	112.2	N325 V327 A375 L379 I389 I394 F407	N325-L404 PolarHBondContact O-N 2.95Å; V327-L404 WeakPolarHBondContact CG2-O 3.26Å; V327-L404 PolarHBondContact N-O 3.32Å; A375-L404 HydrophobicContact CB-CB 4.22Å; A375-L404 HydrophobicContact CB-CD2 4.19Å; L379-L404 HydrophobicContact CD1-CD2 3.73Å; I389-L404 HydrophobicContact CD1-CD1 3.48Å; I389-L404 VanDerWaalsContact CD1-CD1 3.48Å; I389-L404 HydrophobicContact CD1-CD2 3.89Å; I389-L404 HydrophobicContact CD1-CG 4.36Å; I394-L404 HydrophobicContact CD1-CB 4.4Å; I394-L404 HydrophobicContact CD1-CD1 3.78Å; L404-F407 HydrophobicContact CD2-CZ 4.36Å; L404-F407 HydrophobicContact CG-CZ 4.22Å
405	T	93.1	Very high	91.5	Very high	18 Å²	18	33.8 Å²	33.8	11%	0.11	19%	0.188	C	C	.	.			trans	-138	-179.8	180	-156.5	0	0	0	0	113.8	H386 N393 L395	H386-T405 PolarHBondContact CE1-O 3.07Å; H386-T405 PolarHBondContact NE2-O 3.14Å; N393-T405 WeakPolarHBondContact O-CG2 3.46Å; N393-T405 PolarHBondContact O-N 3.38Å; L395-T405 HydrophobicContact CD1-CG2 3.9Å; L395-T405 HydrophobicContact CD2-CG2 4.31Å; L395-T405 HydrophobicContact CG-CG2 3.71Å
406	D	86.1	Confident	90.8	Very high	31 Å²	31	39.6 Å²	39.6	17%	0.166	21%	0.214	C	C	.	.			trans	57.6	63.6	-178.4	-153.2	4.4	0	0	0	116.4	K298 G408	K298-D406 IonicContact NZ-OD1 3.5Å; K298-D406 PolarHBondContact NZ-OD1 3.42Å; D406-G408 PolarHBondContact O-N 3.35Å
407	F	86.3	Confident	90.1	Very high	2 Å²	2	44.6 Å²	44.6	1%	0.009	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-68.8	6.7	177.6	-69.1	-103.2	0	0	0	114.3	E314 V317 M318 I326 L379 H386 L404 F409 C410	E314-F407 HydrophobicContact CG-CB 4.17Å; V317-F407 HydrophobicContact CG1-CD1 3.6Å; V317-F407 HydrophobicContact CG1-CE1 4.21Å; V317-F407 HydrophobicContact CG1-CG 4.49Å; M318-F407 HydrophobicContact CE-CD2 4.35Å; M318-F407 HydrophobicContact CG-CB 3.77Å; M318-F407 HydrophobicContact CG-CD1 4.42Å; M318-F407 HydrophobicContact CG-CD2 3.66Å; M318-F407 HydrophobicContact CG-CE2 4.45Å; M318-F407 HydrophobicContact CG-CG 3.67Å; M318-F407 HydrophobicContact SD-CB 4.21Å; M318-F407 HydrophobicContact SD-CD2 3.98Å; M318-F407 HydrophobicContact SD-CG 4.36Å; I326-F407 HydrophobicContact CB-CZ 4.45Å; I326-F407 HydrophobicContact CD1-CE1 4.48Å; I326-F407 HydrophobicContact CD1-CZ 4.1Å; I326-F407 HydrophobicContact CG1-CZ 4.19Å; I326-F407 HydrophobicContact CG2-CE1 4.5Å; I326-F407 HydrophobicContact CG2-CE2 3.8Å; I326-F407 HydrophobicContact CG2-CZ 3.53Å; L379-F407 HydrophobicContact CD1-CE1 3.83Å; L379-F407 HydrophobicContact CD1-CZ 4.28Å; L379-F407 HydrophobicContact CD2-CE1 3.88Å; H386-F407 AromaticContact CD2-CE1 3.97Å; L404-F407 HydrophobicContact CD2-CZ 4.36Å; L404-F407 HydrophobicContact CG-CZ 4.22Å; F407-F409 PolarHBondContact O-N 2.93Å; F407-C410 VanDerWaalsContact CA-SG 3.57Å; F407-C410 WeakPolarHBondContact CD1-SG 3.21Å; F407-C410 VanDerWaalsContact O-CB 3.28Å; F407-C410 WeakPolarHBondContact O-CB 3.4Å; F407-C410 PolarHBondContact O-N 3.48Å; F407-C410 PolarHBondContact O-SG 2.85Å
408	G	80.4	Confident	89.4	Confident	14 Å²	14	47.1 Å²	47.1	14%	0.144	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-65.4	-18	-177	0	0	0	0	0	114.9	E314 D406	E314-G408 VanDerWaalsContact OE2-CA 3.29Å; E314-G408 WeakPolarHBondContact OE2-CA 3.18Å; D406-G408 PolarHBondContact O-N 3.35Å
409	F	82.3	Confident	88.9	Confident	60 Å²	60	48 Å²	48	26%	0.263	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-102	3.9	171.4	-68.1	-49.8	0	0	0	114.5	H386 R387 D388 F407 V424	H386-F409 CarbonylContact O-C 3.58Å; R387-F409 PolarHBondContact NE-O 3.26Å; R387-F409 PolarHBondContact NH2-O 3.27Å; D388-F409 HydrophobicContact CB-CB 4.3Å; D388-F409 HydrophobicContact CB-CD2 3.79Å; F407-F409 PolarHBondContact O-N 2.93Å; F409-V424 HydrophobicContact CD1-CB 4.26Å; F409-V424 HydrophobicContact CD1-CG1 4.49Å
410	C	87.4	Confident	88.4	Confident	9 Å²	9	46 Å²	46	6%	0.061	24%	0.24	C	C	.	.			trans	-61.4	159.4	-177.6	-73.7	0	0	0	0	114	V384 I385 H386 R387 F407	V384-C410 HydrophobicContact CG1-CB 4.15Å; I385-C410 CarbonylContact O-C 3.56Å; I385-C410 VanDerWaalsContact O-CA 3.25Å; I385-C410 WeakPolarHBondContact O-CA 3.33Å; H386-C410 PolarHBondContact CD2-SG 3.08Å; R387-C410 PolarHBondContact NH2-O 3.42Å; R387-C410 VanDerWaalsContact NH2-O 3.11Å; F407-C410 VanDerWaalsContact CA-SG 3.57Å; F407-C410 WeakPolarHBondContact CD1-SG 3.21Å; F407-C410 VanDerWaalsContact O-CB 3.28Å; F407-C410 WeakPolarHBondContact O-CB 3.4Å; F407-C410 PolarHBondContact O-N 3.48Å; F407-C410 PolarHBondContact O-SG 2.85Å
411	A	86.3	Confident	87.6	Confident	8 Å²	8	50.3 Å²	50.3	7%	0.066	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	121	166.5	0	0	0	0	0	111.2	I385 R387 R420	I385-A411 PolarHBondContact N-O 3.41Å; I385-A411 PolarHBondContact O-N 3.25Å; R387-A411 VanDerWaalsContact CZ-CB 3.49Å; A411-R420 HydrophobicContact CB-CG 4.24Å
412	Q	86.3	Confident	86.8	Confident	107 Å²	107	52.5 Å²	52.5	50%	0.5	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	132.1	160.7	-163.2	173.6	51.6	0	0	108.7	Q383 R420	Q383-Q412 CarbonylContact O-C 3.47Å; Q383-Q412 VanDerWaalsContact O-CA 3.26Å; Q383-Q412 WeakPolarHBondContact O-CA 3.15Å; Q412-R420 PolarHBondContact O-NH2 3.15Å
413	I	87.8	Confident	85.5	Confident	6 Å²	6	54.3 Å²	54.3	3%	0.031	29%	0.292	C	S	.	.			trans	-107.5	170.4	171.5	54.8	169.5	0	0	0	109.7	Q383 I385 Q417 S418 R420 P442	Q383-I413 HydrophobicContact CB-CG1 3.96Å; Q383-I413 WeakPolarHBondContact CB-O 3.19Å; Q383-I413 WeakPolarHBondContact O-CG1 3.16Å; Q383-I413 PolarHBondContact O-N 3.38Å; I385-I413 HydrophobicContact CD1-CD1 4.36Å; I385-I413 HydrophobicContact CD1-CG2 3.85Å; I385-I413 HydrophobicContact CG1-CD1 4.48Å; I385-I413 HydrophobicContact CG1-CG2 4.38Å; I413-Q417 WeakPolarHBondContact CB-O 3.15Å; I413-S418 WeakPolarHBondContact CD1-O 3.33Å; I413-R420 HydrophobicContact CG2-CG 3.93Å; I413-P442 HydrophobicContact CD1-CG 3.94Å
414	T	87.1	Confident	84.7	Confident	58 Å²	58	54 Å²	54	36%	0.356	29%	0.292	S	S	.	.			trans	-131.4	165.7	174.5	77.2	0	0	0	0	109.5	E416 Q417 S418	T414-E416 WeakPolarHBondContact CB-OE2 3.31Å; T414-E416 PolarHBondContact O-N 2.84Å; T414-E416 PolarHBondContact OG1-N 3.34Å; T414-E416 PolarHBondContact OG1-OE2 2.81Å; T414-Q417 PolarHBondContact N-O 3.46Å; T414-Q417 CarbonylContact O-C 3.59Å; T414-Q417 PolarHBondContact O-N 3.18Å; T414-Q417 VanDerWaalsContact O-N 3.12Å; T414-Q417 PolarHBondContact OG1-N 3.15Å; T414-Q417 VanDerWaalsContact OG1-N 3.14Å; T414-S418 WeakPolarHBondContact O-CA 3.32Å; T414-S418 PolarHBondContact O-N 3.45Å
415	P	81.3	Confident	83.9	Confident	108 Å²	108	54.2 Å²	54.2	70%	0.701	30%	0.296	S	S	*	.	S	Bend	trans	-56	-34.4	175.8	-26	36.2	0	0	0	113.2
416	E	83	Confident	83.5	Confident	160 Å²	160	54.8 Å²	54.8	75%	0.748	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-27.1	179.8	-44.6	71.5	-153.1	0	0	112.5	T414	T414-E416 WeakPolarHBondContact CB-OE2 3.31Å; T414-E416 PolarHBondContact O-N 2.84Å; T414-E416 PolarHBondContact OG1-N 3.34Å; T414-E416 PolarHBondContact OG1-OE2 2.81Å
417	Q	84	Confident	83.6	Confident	107 Å²	107	53.8 Å²	53.8	50%	0.5	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.4	62.4	174.6	-162.6	178.5	32.6	0	0	111	I413 T414 K419 R420	I413-Q417 WeakPolarHBondContact CB-O 3.15Å; T414-Q417 PolarHBondContact N-O 3.46Å; T414-Q417 CarbonylContact O-C 3.59Å; T414-Q417 PolarHBondContact O-N 3.18Å; T414-Q417 VanDerWaalsContact O-N 3.12Å; T414-Q417 PolarHBondContact OG1-N 3.15Å; T414-Q417 VanDerWaalsContact OG1-N 3.14Å; Q417-K419 PolarHBondContact O-N 3.1Å; Q417-R420 VanDerWaalsContact CD-NH1 3.31Å
418	S	82.7	Confident	84	Confident	58 Å²	58	55 Å²	55	41%	0.406	30%	0.299	S	S	.	.			trans	-75	-7.4	-175.6	57.7	0	0	0	0	114.5	I413 T414	I413-S418 WeakPolarHBondContact CD1-O 3.33Å; T414-S418 WeakPolarHBondContact O-CA 3.32Å; T414-S418 PolarHBondContact O-N 3.45Å
419	K	85.8	Confident	84.7	Confident	96 Å²	96	55 Å²	55	42%	0.417	30%	0.295	S	S	.	.			trans	-126.9	147.3	176.8	-63.9	-172.4	174.2	-168.3	0	111.6	Q417 A439 Y440 E506	Q417-K419 PolarHBondContact O-N 3.1Å; K419-A439 HydrophobicContact CB-CB 3.99Å; K419-A439 HydrophobicContact CD-CB 4.28Å; K419-Y440 CarbonylContact C-O 3.53Å; K419-Y440 WeakPolarHBondContact CA-O 3.48Å; K419-Y440 WeakPolarHBondContact CB-O 3.36Å; K419-E506 IonicContact NZ-OE1 2.8Å
420	R	86.3	Confident	85.3	Confident	62 Å²	62	52.6 Å²	52.6	23%	0.234	28%	0.284	C	S	.	.	B	Isolated β-bridge	trans	-111.1	154.1	175.7	-65.3	-55	-166.1	-179.5	0.3	110.5	A411 Q412 I413 Q417 A439 Y440	A411-R420 HydrophobicContact CB-CG 4.24Å; Q412-R420 PolarHBondContact O-NH2 3.15Å; I413-R420 HydrophobicContact CG2-CG 3.93Å; Q417-R420 VanDerWaalsContact CD-NH1 3.31Å; R420-A439 CarbonylContact O-C 3.02Å; R420-A439 WeakPolarHBondContact O-CA 3.28Å; R420-Y440 HydrophobicContact CB-CD2 4.36Å; R420-Y440 HydrophobicContact CB-CE1 4.12Å; R420-Y440 HydrophobicContact CB-CE2 3.74Å; R420-Y440 PolarHBondContact N-O 3.4Å; R420-Y440 WeakPolarHBondContact O-CD1 3.42Å; R420-Y440 WeakPolarHBondContact O-CE1 3.44Å; R420-Y440 PolarHBondContact O-N 2.86Å
421	S	82.2	Confident	85.6	Confident	92 Å²	92	52.2 Å²	52.2	64%	0.643	28%	0.282	S	S	*	.			trans	-124.7	5.2	171.6	55.6	0	0	0	0	112.3	M423	S421-M423 PolarHBondContact O-N 3.44Å
422	T	79.9	Confident	85.9	Confident	69 Å²	69	52.2 Å²	52.2	42%	0.423	28%	0.281	S	S	.	.			trans	-77.4	119.1	179.5	48.1	0	0	0	0	110	R387 V424 Y440	R387-T422 PolarHBondContact NH1-OG1 3.22Å; T422-V424 PolarHBondContact O-N 2.93Å; T422-Y440 WeakPolarHBondContact O-CE1 3.44Å; T422-Y440 PolarHBondContact O-OH 3.44Å
423	M	72.8	Confident	86.3	Confident	41 Å²	41	47.6 Å²	47.6	20%	0.202	26%	0.26	C	S	.	.			trans	-75.3	113.6	179.3	-178.1	176.6	-80.4	0	0	110.9	F130 S421 R437	F130-M423 WeakPolarHBondContact CA-SD 3.25Å; F130-M423 HydrophobicContact CB-CE 3.8Å; F130-M423 HydrophobicContact CB-SD 3.59Å; F130-M423 VanDerWaalsContact CB-SD 3.59Å; F130-M423 HydrophobicContact CD2-CE 3.55Å; F130-M423 HydrophobicContact CD2-CG 3.53Å; F130-M423 HydrophobicContact CD2-SD 3.13Å; F130-M423 WeakPolarHBondContact CD2-SD 3.35Å; F130-M423 HydrophobicContact CE2-CG 3.61Å; F130-M423 HydrophobicContact CE2-SD 3.83Å; F130-M423 HydrophobicContact CG-CE 4.08Å; F130-M423 HydrophobicContact CG-CG 4.39Å; F130-M423 HydrophobicContact CG-SD 3.49Å; F130-M423 WeakPolarHBondContact CG-SD 3.47Å; S421-M423 PolarHBondContact O-N 3.44Å; M423-R437 HydrophobicContact CE-CG 3.41Å; M423-R437 VanDerWaalsContact CE-CG 3.41Å
424	V	79.6	Confident	86.4	Confident	24 Å²	24	47.8 Å²	47.8	15%	0.145	26%	0.261	C	S	.	.			trans	-149.2	170.2	177.9	-63.2	0	0	0	0	109.7	R387 F409 T422 M430	R387-V424 HydrophobicContact CB-CG2 3.9Å; R387-V424 VanDerWaalsContact CZ-CG2 3.42Å; F409-V424 HydrophobicContact CD1-CB 4.26Å; F409-V424 HydrophobicContact CD1-CG1 4.49Å; T422-V424 PolarHBondContact O-N 2.93Å; V424-M430 WeakPolarHBondContact O-CE 3.48Å
425	G	80.6	Confident	86.5	Confident	8 Å²	8	45 Å²	45	8%	0.082	24%	0.244	C	C	.	.	S	Bend	trans	106.4	171.1	178.7	0	0	0	0	0	114.3	R387	R387-G425 WeakPolarHBondContact O-CA 3.42Å
426	T	86.4	Confident	86.7	Confident	31 Å²	31	40.8 Å²	40.8	19%	0.19	22%	0.217	C	C	.	.			trans	-89	121.8	179.3	-52.4	0	0	0	0	110.6	D388 Y428 W429 M430	D388-T426 VanDerWaalsContact OD1-CB 3.3Å; D388-T426 WeakPolarHBondContact OD1-CB 3.35Å; D388-T426 PolarHBondContact OD1-N 3.35Å; D388-T426 PolarHBondContact OD1-OG1 2.73Å; D388-T426 PolarHBondContact OD2-OG1 2.94Å; T426-Y428 PolarHBondContact O-N 3.01Å; T426-Y428 VanDerWaalsContact O-N 3.13Å; T426-W429 HydrophobicContact CG2-CE3 3.52Å; T426-W429 HydrophobicContact CG2-CH2 4.45Å; T426-W429 HydrophobicContact CG2-CZ3 3.34Å; T426-W429 PolarHBondContact O-N 3.42Å; T426-W429 VanDerWaalsContact O-N 3.11Å; T426-M430 WeakPolarHBondContact O-CG 3.15Å
427	P	88.3	Confident	86.7	Confident	10 Å²	10	37.1 Å²	37.1	7%	0.065	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-47.9	-47.3	-161.8	-35	38.6	0	0	0	117.6	F130 W429 M430 P468 L472 I475	F130-P427 HydrophobicContact CZ-CG 4.4Å; P427-W429 PolarHBondContact O-N 3.28Å; P427-M430 WeakPolarHBondContact O-CB 3.17Å; P427-M430 WeakPolarHBondContact O-CG 3.36Å; P427-M430 PolarHBondContact O-N 3.22Å; P427-M430 VanDerWaalsContact O-N 3.15Å; P427-P468 HydrophobicContact CB-CB 4.47Å; P427-P468 HydrophobicContact CG-CB 4.3Å; P427-L472 HydrophobicContact CB-CD1 4.25Å; P427-L472 HydrophobicContact CB-CD2 4.02Å; P427-L472 HydrophobicContact CB-CG 4.03Å; P427-I475 WeakPolarHBondContact O-CD1 3.42Å
428	Y	93.1	Very high	86.9	Confident	26 Å²	26	37.9 Å²	37.9	10%	0.102	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-67.1	-21.2	-173.1	-49.7	-83.6	0	0	0	113.5	T426 Y463 L464 E466 P468 A471	T426-Y428 PolarHBondContact O-N 3.01Å; T426-Y428 VanDerWaalsContact O-N 3.13Å; Y428-Y463 WeakPolarHBondContact CE1-O 3.26Å; Y428-L464 HydrophobicContact CD2-CD1 4.05Å; Y428-L464 HydrophobicContact CE2-CD1 3.92Å; Y428-L464 HydrophobicContact CG-CD1 4.43Å; Y428-E466 PolarHBondContact OH-O 2.76Å; Y428-P468 WeakPolarHBondContact OH-CG 3.18Å; Y428-A471 HydrophobicContact CD1-CB 3.63Å; Y428-A471 HydrophobicContact CE1-CB 3.48Å; Y428-A471 VanDerWaalsContact CE1-CB 3.48Å
429	W	96.1	Very high	87.3	Confident	16 Å²	16	38 Å²	38	6%	0.061	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-96.8	-2.4	178.2	-64.6	-100	0	0	0	113.7	I389 K390 T426 P427 S448 I451 E455 P461	I389-W429 VanDerWaalsContact O-CD1 3.32Å; K390-W429 HydrophobicContact CB-CD2 3.81Å; K390-W429 VanDerWaalsContact CB-CE2 3.41Å; K390-W429 HydrophobicContact CB-CG 3.93Å; K390-W429 HydrophobicContact CB-CZ2 3.86Å; K390-W429 VanDerWaalsContact CB-NE1 3.3Å; K390-W429 HydrophobicContact CD-CZ2 4.48Å; T426-W429 HydrophobicContact CG2-CE3 3.52Å; T426-W429 HydrophobicContact CG2-CH2 4.45Å; T426-W429 HydrophobicContact CG2-CZ3 3.34Å; T426-W429 PolarHBondContact O-N 3.42Å; T426-W429 VanDerWaalsContact O-N 3.11Å; P427-W429 PolarHBondContact O-N 3.28Å; W429-S448 WeakPolarHBondContact O-CB 3.45Å; W429-S448 PolarHBondContact O-OG 2.79Å; W429-I451 HydrophobicContact CB-CG2 4.49Å; W429-I451 HydrophobicContact CG-CB 4.44Å; W429-I451 HydrophobicContact CG-CG2 3.96Å; W429-E455 WeakPolarHBondContact CZ2-OE1 3.28Å; W429-E455 PolarHBondContact NE1-OE2 3.02Å; W429-P461 HydrophobicContact CH2-CG 3.77Å; W429-P461 HydrophobicContact CZ2-CB 4.12Å; W429-P461 HydrophobicContact CZ2-CG 3.68Å; W429-P461 HydrophobicContact CZ3-CG 4.3Å
430	M	93.6	Very high	87.6	Confident	8 Å²	8	33.7 Å²	33.7	4%	0.039	18%	0.183	C	C	.	.			trans	-75.3	132.4	-170.6	-64.6	-169.8	62.5	0	0	112.4	F130 V424 T426 P427 V434 V435 W447 L472 I475	F130-M430 HydrophobicContact CE2-CE 3.74Å; F130-M430 HydrophobicContact CE2-SD 3.53Å; F130-M430 VanDerWaalsContact CE2-SD 3.53Å; F130-M430 HydrophobicContact CZ-SD 3.81Å; V424-M430 WeakPolarHBondContact O-CE 3.48Å; T426-M430 WeakPolarHBondContact O-CG 3.15Å; P427-M430 WeakPolarHBondContact O-CB 3.17Å; P427-M430 WeakPolarHBondContact O-CG 3.36Å; P427-M430 PolarHBondContact O-N 3.22Å; P427-M430 VanDerWaalsContact O-N 3.15Å; M430-V434 HydrophobicContact CE-CB 3.85Å; M430-V434 HydrophobicContact CE-CG1 3.34Å; M430-V435 HydrophobicContact CB-CG2 3.82Å; M430-W447 PolarHBondContact O-NE1 3.39Å; M430-L472 HydrophobicContact SD-CD2 4.21Å; M430-I475 WeakPolarHBondContact O-CG2 3.26Å
431	A	94.6	Very high	88.1	Confident	1 Å²	1	31.2 Å²	31.2	1%	0.008	18%	0.177	C	C	.	.			trans	-66.3	143.1	174.5	0	0	0	0	0	111.6	E433 V434 V435 V444 W447	A431-E433 HydrophobicContact CB-CG 4.47Å; A431-E433 WeakPolarHBondContact CB-OE2 3.25Å; A431-E433 PolarHBondContact O-N 2.97Å; A431-E433 VanDerWaalsContact O-N 3.1Å; A431-V434 HydrophobicContact CB-CG2 4.22Å; A431-V434 WeakPolarHBondContact O-CB 3.45Å; A431-V434 PolarHBondContact O-N 3.12Å; A431-V435 PolarHBondContact O-N 2.66Å; A431-V444 HydrophobicContact CB-CB 4.1Å; A431-V444 HydrophobicContact CB-CG1 4.05Å; A431-W447 VanDerWaalsContact CA-CD1 3.5Å; A431-W447 HydrophobicContact CB-CB 3.68Å; A431-W447 HydrophobicContact CB-CD2 4.31Å; A431-W447 HydrophobicContact CB-CG 3.7Å
432	P	93.3	Very high	88.8	Confident	8 Å²	8	28.4 Å²	28.4	5%	0.052	16%	0.156	C	C	.	.	H	α-helix	trans	-56.4	-31	-175.4	-27.8	34.7	0	0	0	114.1	V434 V435 T436 W447 I475 M503	P432-V434 VanDerWaalsContact C-N 3.31Å; P432-V434 PolarHBondContact O-N 3.06Å; P432-V435 PolarHBondContact O-N 3.13Å; P432-T436 WeakPolarHBondContact O-CB 3.3Å; P432-T436 PolarHBondContact O-N 3.45Å; P432-T436 PolarHBondContact O-OG1 3.15Å; P432-W447 HydrophobicContact CG-CE3 4.4Å; P432-W447 HydrophobicContact CG-CH2 3.57Å; P432-W447 HydrophobicContact CG-CZ2 3.71Å; P432-W447 HydrophobicContact CG-CZ3 3.93Å; P432-I475 HydrophobicContact CB-CG2 4.49Å; P432-I475 HydrophobicContact CG-CG2 4.04Å; P432-M503 HydrophobicContact CB-CE 3.96Å; P432-M503 HydrophobicContact CB-SD 4.46Å; P432-M503 HydrophobicContact CG-CE 3.9Å; P432-M503 HydrophobicContact CG-SD 3.78Å
433	E	93.3	Very high	89.6	Confident	11 Å²	11	27 Å²	27	5%	0.051	14%	0.144	C	C	.	.	H	α-helix	trans	-66.5	-28.5	174.5	67	-89.7	-155.5	0	0	113.7	A431 R437 K438 V444 V505 R508	A431-E433 HydrophobicContact CB-CG 4.47Å; A431-E433 WeakPolarHBondContact CB-OE2 3.25Å; A431-E433 PolarHBondContact O-N 2.97Å; A431-E433 VanDerWaalsContact O-N 3.1Å; E433-R437 PolarHBondContact O-N 3.49Å; E433-K438 HydrophobicContact CB-CB 4.19Å; E433-K438 HydrophobicContact CB-CD 4.43Å; E433-K438 WeakPolarHBondContact O-CB 3.48Å; E433-K438 PolarHBondContact O-N 3.02Å; E433-V444 HydrophobicContact CG-CG1 4.19Å; E433-V444 WeakPolarHBondContact OE1-CG1 3.25Å; E433-V505 HydrophobicContact CB-CG2 4.33Å; E433-V505 HydrophobicContact CG-CG2 4.08Å; E433-R508 IonicContact OE1-CZ 2.96Å; E433-R508 IonicContact OE1-NH1 3.62Å; E433-R508 PolarHBondContact OE1-NH1 2.95Å; E433-R508 IonicContact OE1-NH2 3.94Å; E433-R508 PolarHBondContact OE1-NH2 2.95Å; E433-R508 IonicContact OE2-CZ 2.68Å; E433-R508 IonicContact OE2-NH1 3.76Å; E433-R508 IonicContact OE2-NH2 2.62Å; E433-R508 PolarHBondContact OE2-NH2 3.44Å
434	V	91.4	Very high	90.8	Very high	10 Å²	10	25.2 Å²	25.2	6%	0.061	14%	0.136	C	C	.	.	H	α-helix	trans	-78.3	-39.4	176	-165.5	0	0	0	0	110.5	M430 A431 P432 R437 Y440 V444	M430-V434 HydrophobicContact CE-CB 3.85Å; M430-V434 HydrophobicContact CE-CG1 3.34Å; A431-V434 HydrophobicContact CB-CG2 4.22Å; A431-V434 WeakPolarHBondContact O-CB 3.45Å; A431-V434 PolarHBondContact O-N 3.12Å; P432-V434 VanDerWaalsContact C-N 3.31Å; P432-V434 PolarHBondContact O-N 3.06Å; V434-R437 PolarHBondContact O-N 3.39Å; V434-Y440 HydrophobicContact CB-CD1 4.32Å; V434-Y440 HydrophobicContact CG1-CD1 4.09Å; V434-Y440 HydrophobicContact CG1-CE1 3.84Å; V434-Y440 HydrophobicContact CG2-CD1 3.87Å; V434-Y440 HydrophobicContact CG2-CD2 4.31Å; V434-Y440 HydrophobicContact CG2-CE1 4.28Å; V434-Y440 HydrophobicContact CG2-CG 3.89Å; V434-V444 HydrophobicContact CG2-CB 4.15Å; V434-V444 HydrophobicContact CG2-CG1 3.48Å; V434-V444 VanDerWaalsContact CG2-CG1 3.48Å
435	V	88.4	Confident	91.7	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-65.3	-47.8	176.3	-175	0	0	0	0	110.6	V127 M430 A431 P432 R437 L472 I475 A476	V127-V435 HydrophobicContact CG2-CG1 3.74Å; M430-V435 HydrophobicContact CB-CG2 3.82Å; A431-V435 PolarHBondContact O-N 2.66Å; P432-V435 PolarHBondContact O-N 3.13Å; V435-R437 PolarHBondContact O-N 2.94Å; V435-R437 VanDerWaalsContact O-N 3.11Å; V435-L472 HydrophobicContact CB-CD2 4.42Å; V435-L472 HydrophobicContact CG1-CB 4.02Å; V435-L472 HydrophobicContact CG1-CD2 3.92Å; V435-L472 WeakPolarHBondContact CG1-O 3.5Å; V435-L472 HydrophobicContact CG2-CD2 3.64Å; V435-I475 HydrophobicContact CG2-CG2 4.03Å; V435-A476 HydrophobicContact CG1-CB 4.14Å
436	T	86.2	Confident	92.6	Very high	19 Å²	19	23.7 Å²	23.7	12%	0.117	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	21.1	175.9	59.2	0	0	0	0	113.9	P432 K438 A476	P432-T436 WeakPolarHBondContact O-CB 3.3Å; P432-T436 PolarHBondContact O-N 3.45Å; P432-T436 PolarHBondContact O-OG1 3.15Å; T436-K438 PolarHBondContact O-N 3.39Å; T436-K438 WeakPolarHBondContact OG1-CD 3.44Å; T436-K438 VanDerWaalsContact OG1-CE 3.26Å; T436-K438 WeakPolarHBondContact OG1-CE 3.34Å; T436-K438 PolarHBondContact OG1-NZ 3.22Å; T436-A476 HydrophobicContact CG2-CB 3.9Å
437	R	83.1	Confident	93.2	Very high	82 Å²	82	22.2 Å²	22.2	31%	0.309	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	17	168.8	-71	160.3	159	-95.8	-6.3	116.3	D126 E129 M423 E433 V434 V435	D126-R437 PolarHBondContact O-NE 3.32Å; E129-R437 PolarHBondContact O-NH2 2.69Å; E129-R437 IonicContact OE1-CZ 2.88Å; E129-R437 IonicContact OE1-NH1 3.81Å; E129-R437 PolarHBondContact OE1-NH1 3.1Å; E129-R437 IonicContact OE1-NH2 3.52Å; E129-R437 PolarHBondContact OE1-NH2 2.6Å; E129-R437 IonicContact OE2-CZ 3.09Å; E129-R437 IonicContact OE2-NE 3.67Å; E129-R437 IonicContact OE2-NH1 2.72Å; E129-R437 PolarHBondContact OE2-NH1 3.25Å; E129-R437 IonicContact OE2-NH2 2.84Å; M423-R437 HydrophobicContact CE-CG 3.41Å; M423-R437 VanDerWaalsContact CE-CG 3.41Å; E433-R437 PolarHBondContact O-N 3.49Å; V434-R437 PolarHBondContact O-N 3.39Å; V435-R437 PolarHBondContact O-N 2.94Å; V435-R437 VanDerWaalsContact O-N 3.11Å
438	K	88.1	Confident	93.7	Very high	123 Å²	123	22 Å²	22	54%	0.535	12%	0.115	S	C	.	.			trans	-74.1	158.4	179.5	-66.6	162.9	-169.2	150.1	0	110.3	E433 T436 Y440	E433-K438 HydrophobicContact CB-CB 4.19Å; E433-K438 HydrophobicContact CB-CD 4.43Å; E433-K438 WeakPolarHBondContact O-CB 3.48Å; E433-K438 PolarHBondContact O-N 3.02Å; T436-K438 PolarHBondContact O-N 3.39Å; T436-K438 WeakPolarHBondContact OG1-CD 3.44Å; T436-K438 VanDerWaalsContact OG1-CE 3.26Å; T436-K438 WeakPolarHBondContact OG1-CE 3.34Å; T436-K438 PolarHBondContact OG1-NZ 3.22Å; K438-Y440 PolarHBondContact O-N 3.1Å
439	A	89.5	Confident	93.9	Very high	61 Å²	61	20.8 Å²	20.8	50%	0.504	11%	0.11	S	C	.	.			trans	-69	113.9	172.1	0	0	0	0	0	109.5	K419 R420	K419-A439 HydrophobicContact CB-CB 3.99Å; K419-A439 HydrophobicContact CD-CB 4.28Å; R420-A439 CarbonylContact O-C 3.02Å; R420-A439 WeakPolarHBondContact O-CA 3.28Å
440	Y	93.4	Very high	94	Very high	6 Å²	6	20 Å²	20	2%	0.024	11%	0.107	C	C	.	.	B	Isolated β-bridge	trans	-111.4	155.1	-172.5	67.3	-100.3	0	0	0	112.3	R387 K419 R420 T422 V434 K438 V444	R387-Y440 VanDerWaalsContact CD-OH 3.26Å; R387-Y440 WeakPolarHBondContact CD-OH 3.48Å; R387-Y440 HydrophobicContact CG-CE2 4.36Å; R387-Y440 PolarHBondContact NH1-OH 3.37Å; K419-Y440 CarbonylContact C-O 3.53Å; K419-Y440 WeakPolarHBondContact CA-O 3.48Å; K419-Y440 WeakPolarHBondContact CB-O 3.36Å; R420-Y440 HydrophobicContact CB-CD2 4.36Å; R420-Y440 HydrophobicContact CB-CE1 4.12Å; R420-Y440 HydrophobicContact CB-CE2 3.74Å; R420-Y440 PolarHBondContact N-O 3.4Å; R420-Y440 WeakPolarHBondContact O-CD1 3.42Å; R420-Y440 WeakPolarHBondContact O-CE1 3.44Å; R420-Y440 PolarHBondContact O-N 2.86Å; T422-Y440 WeakPolarHBondContact O-CE1 3.44Å; T422-Y440 PolarHBondContact O-OH 3.44Å; V434-Y440 HydrophobicContact CB-CD1 4.32Å; V434-Y440 HydrophobicContact CG1-CD1 4.09Å; V434-Y440 HydrophobicContact CG1-CE1 3.84Å; V434-Y440 HydrophobicContact CG2-CD1 3.87Å; V434-Y440 HydrophobicContact CG2-CD2 4.31Å; V434-Y440 HydrophobicContact CG2-CE1 4.28Å; V434-Y440 HydrophobicContact CG2-CG 3.89Å; K438-Y440 PolarHBondContact O-N 3.1Å; Y440-V444 HydrophobicContact CD2-CB 4.49Å; Y440-V444 HydrophobicContact CD2-CG1 3.61Å; Y440-V444 HydrophobicContact CD2-CG2 4.07Å; Y440-V444 HydrophobicContact CE2-CG2 4.36Å; Y440-V444 HydrophobicContact CG-CG1 3.86Å
441	G	95.4	Very high	94.3	Very high	9 Å²	9	19.8 Å²	19.8	9%	0.093	11%	0.106	C	C	.	.			trans	-122.3	-164.7	179.3	0	0	0	0	0	112.6	K443 V444	G441-K443 PolarHBondContact O-N 2.85Å; G441-K443 VanDerWaalsContact O-N 3.12Å; G441-V444 WeakPolarHBondContact O-CG2 3.32Å; G441-V444 PolarHBondContact O-N 2.91Å
442	P	97.1	Very high	94.4	Very high	33 Å²	33	19.8 Å²	19.8	21%	0.214	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-26.9	-174.4	-24.6	32.7	0	0	0	115.7	H380 I385 I413 V444 D445	H380-P442 HydrophobicContact CB-CB 4.15Å; H380-P442 PolarHBondContact CE1-O 2.93Å; H380-P442 WeakPolarHBondContact ND1-CB 3.45Å; H380-P442 PolarHBondContact NE2-O 3.1Å; I385-P442 HydrophobicContact CD1-CG 4.35Å; I385-P442 HydrophobicContact CG1-CB 4.28Å; I385-P442 HydrophobicContact CG1-CG 4.05Å; I413-P442 HydrophobicContact CD1-CG 3.94Å; P442-V444 PolarHBondContact O-N 3.37Å; P442-D445 PolarHBondContact O-N 2.67Å
443	K	98.2	Very high	94.7	Very high	40 Å²	40	19.4 Å²	19.4	17%	0.174	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-2.5	178.7	-68.4	-174.4	-178.8	-173	0	115.3	G441 D445 I446 W447 V505 E506 R508	G441-K443 PolarHBondContact O-N 2.85Å; G441-K443 VanDerWaalsContact O-N 3.12Å; K443-D445 VanDerWaalsContact C-N 3.34Å; K443-I446 PolarHBondContact O-N 3.48Å; K443-W447 PolarHBondContact O-N 2.94Å; K443-V505 HydrophobicContact CB-CG1 4.22Å; K443-V505 HydrophobicContact CD-CG1 4.24Å; K443-V505 WeakPolarHBondContact CD-O 3.39Å; K443-V505 WeakPolarHBondContact CE-O 3.36Å; K443-V505 PolarHBondContact NZ-O 3.3Å; K443-E506 PolarHBondContact NZ-O 3.25Å; K443-R508 HydrophobicContact CD-CB 4.48Å; K443-R508 WeakPolarHBondContact CD-O 3.26Å; K443-R508 WeakPolarHBondContact CE-O 3.46Å; K443-R508 PolarHBondContact NZ-O 2.71Å; K443-R508 PolarHBondContact O-NH1 3.09Å
444	V	97.8	Very high	94.9	Very high	4 Å²	4	19 Å²	19	2%	0.024	10%	0.101	C	C	.	.	H	α-helix	trans	-66	-38.3	167	-60.5	0	0	0	0	111.5	I385 R387 A431 E433 V434 Y440 G441 P442 I446 W447 S448	I385-V444 HydrophobicContact CG2-CG2 3.65Å; R387-V444 HydrophobicContact CG-CG2 4.45Å; A431-V444 HydrophobicContact CB-CB 4.1Å; A431-V444 HydrophobicContact CB-CG1 4.05Å; E433-V444 HydrophobicContact CG-CG1 4.19Å; E433-V444 WeakPolarHBondContact OE1-CG1 3.25Å; V434-V444 HydrophobicContact CG2-CB 4.15Å; V434-V444 HydrophobicContact CG2-CG1 3.48Å; V434-V444 VanDerWaalsContact CG2-CG1 3.48Å; Y440-V444 HydrophobicContact CD2-CB 4.49Å; Y440-V444 HydrophobicContact CD2-CG1 3.61Å; Y440-V444 HydrophobicContact CD2-CG2 4.07Å; Y440-V444 HydrophobicContact CE2-CG2 4.36Å; Y440-V444 HydrophobicContact CG-CG1 3.86Å; G441-V444 WeakPolarHBondContact O-CG2 3.32Å; G441-V444 PolarHBondContact O-N 2.91Å; P442-V444 PolarHBondContact O-N 3.37Å; V444-I446 PolarHBondContact O-N 2.86Å; V444-W447 WeakPolarHBondContact O-CB 3.49Å; V444-W447 PolarHBondContact O-N 3.48Å; V444-W447 VanDerWaalsContact O-N 3.16Å; V444-S448 PolarHBondContact O-N 2.86Å; V444-S448 PolarHBondContact O-OG 3.38Å
445	D	98.5	Very high	95.2	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-65.3	-27.1	179.5	-61.4	-25.2	0	0	0	111.5	L376 H380 I385 H386 R387 I389 P442 K443 L449	L376-D445 HydrophobicContact CD1-CB 4.15Å; L376-D445 HydrophobicContact CD2-CB 3.71Å; H380-D445 IonicContact CD2-OD2 2.95Å; H380-D445 IonicContact CE1-OD2 3.32Å; H380-D445 IonicContact NE2-OD2 2.7Å; H380-D445 PolarHBondContact NE2-OD2 3.33Å; I385-D445 WeakPolarHBondContact CG2-OD2 3.28Å; H386-D445 PolarHBondContact N-OD1 3.34Å; H386-D445 PolarHBondContact N-OD2 3.24Å; R387-D445 PolarHBondContact N-OD1 2.89Å; I389-D445 HydrophobicContact CG1-CB 3.99Å; P442-D445 PolarHBondContact O-N 2.67Å; K443-D445 VanDerWaalsContact C-N 3.34Å; D445-L449 WeakPolarHBondContact O-CB 3.22Å; D445-L449 PolarHBondContact O-N 2.94Å
446	I	98.8	Very high	95.6	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-74.3	-37.1	177	-57.9	-58.2	0	0	0	111.9	L373 L376 K443 V444 G450 C500 R508 G509 A511 L514	L373-I446 HydrophobicContact CD2-CD1 3.95Å; L376-I446 HydrophobicContact CD1-CD1 4.13Å; K443-I446 PolarHBondContact O-N 3.48Å; V444-I446 PolarHBondContact O-N 2.86Å; I446-G450 PolarHBondContact O-N 2.98Å; I446-C500 HydrophobicContact CG2-CB 4.29Å; I446-R508 HydrophobicContact CG2-CG 4.32Å; I446-G509 WeakPolarHBondContact CG2-O 3.49Å; I446-A511 HydrophobicContact CD1-CB 3.98Å; I446-L514 HydrophobicContact CD1-CD1 4.24Å; I446-L514 HydrophobicContact CG2-CD1 3.38Å
447	W	98.4	Very high	96.1	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-63.8	-47.9	170.3	177.5	-78.1	0	0	0	110.3	M430 A431 P432 K443 V444 L449 G450 I451 C500 L501 M503	M430-W447 PolarHBondContact O-NE1 3.39Å; A431-W447 VanDerWaalsContact CA-CD1 3.5Å; A431-W447 HydrophobicContact CB-CB 3.68Å; A431-W447 HydrophobicContact CB-CD2 4.31Å; A431-W447 HydrophobicContact CB-CG 3.7Å; P432-W447 HydrophobicContact CG-CE3 4.4Å; P432-W447 HydrophobicContact CG-CH2 3.57Å; P432-W447 HydrophobicContact CG-CZ2 3.71Å; P432-W447 HydrophobicContact CG-CZ3 3.93Å; K443-W447 PolarHBondContact O-N 2.94Å; V444-W447 WeakPolarHBondContact O-CB 3.49Å; V444-W447 PolarHBondContact O-N 3.48Å; V444-W447 VanDerWaalsContact O-N 3.16Å; W447-L449 VanDerWaalsContact C-N 3.31Å; W447-L449 PolarHBondContact O-N 3.16Å; W447-G450 CarbonylContact O-C 3.33Å; W447-G450 VanDerWaalsContact O-CA 3.3Å; W447-G450 WeakPolarHBondContact O-CA 3.13Å; W447-G450 PolarHBondContact O-N 2.84Å; W447-I451 PolarHBondContact O-N 3.22Å; W447-C500 WeakPolarHBondContact CA-O 3.43Å; W447-L501 HydrophobicContact CD2-CD2 3.8Å; W447-L501 HydrophobicContact CE3-CB 4.46Å; W447-L501 HydrophobicContact CE3-CD2 4.16Å; W447-L501 HydrophobicContact CG-CD2 4.14Å; W447-L501 HydrophobicContact CZ2-CD2 4.23Å; W447-L501 HydrophobicContact CZ3-CB 4.32Å; W447-L501 WeakPolarHBondContact CZ3-O 3.49Å; W447-L501 WeakPolarHBondContact O-CD2 3.34Å; W447-M503 HydrophobicContact CH2-SD 3.66Å; W447-M503 HydrophobicContact CZ3-SD 3.76Å
448	S	98.5	Very high	96.7	Very high	6 Å²	6	19.4 Å²	19.4	4%	0.042	11%	0.106	C	C	.	.	H	α-helix	trans	-61.7	-36.5	178.7	-56.9	0	0	0	0	112.6	I389 W429 V444 I451 M452	I389-S448 WeakPolarHBondContact O-CB 3.38Å; W429-S448 WeakPolarHBondContact O-CB 3.45Å; W429-S448 PolarHBondContact O-OG 2.79Å; V444-S448 PolarHBondContact O-N 2.86Å; V444-S448 PolarHBondContact O-OG 3.38Å; S448-I451 PolarHBondContact O-N 2.9Å; S448-M452 WeakPolarHBondContact O-CB 3.49Å; S448-M452 PolarHBondContact O-N 3.22Å
449	L	98.8	Very high	97	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-62	-39.4	167.7	176.9	71.4	0	0	0	112.3	C372 L373 L376 I389 D445 W447 M452 A453	C372-L449 HydrophobicContact CB-CD1 3.86Å; L373-L449 HydrophobicContact CD1-CD2 4.19Å; L373-L449 HydrophobicContact CD2-CD2 3.49Å; L373-L449 VanDerWaalsContact CD2-CD2 3.49Å; L373-L449 HydrophobicContact CG-CD2 3.57Å; L376-L449 HydrophobicContact CD1-CD2 4.45Å; I389-L449 HydrophobicContact CG2-CB 4.36Å; D445-L449 WeakPolarHBondContact O-CB 3.22Å; D445-L449 PolarHBondContact O-N 2.94Å; W447-L449 VanDerWaalsContact C-N 3.31Å; W447-L449 PolarHBondContact O-N 3.16Å; L449-M452 HydrophobicContact CD1-CE 3.84Å; L449-M452 PolarHBondContact O-N 2.96Å; L449-A453 PolarHBondContact O-N 3.08Å
450	G	98.5	Very high	97.2	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-61.2	-41.9	173.7	0	0	0	0	0	112.6	I446 W447 A453 I454	I446-G450 PolarHBondContact O-N 2.98Å; W447-G450 CarbonylContact O-C 3.33Å; W447-G450 VanDerWaalsContact O-CA 3.3Å; W447-G450 WeakPolarHBondContact O-CA 3.13Å; W447-G450 PolarHBondContact O-N 2.84Å; G450-A453 PolarHBondContact O-N 3.05Å; G450-I454 PolarHBondContact O-N 3.45Å
451	I	98.4	Very high	97.3	Very high	3 Å²	3	15.5 Å²	15.5	2%	0.015	9%	0.087	C	C	.	.	H	α-helix	trans	-64.9	-43.2	173	-60	-60.2	0	0	0	110.9	W429 W447 S448 A453 I454 E455 P461 P462 P481 L501	W429-I451 HydrophobicContact CB-CG2 4.49Å; W429-I451 HydrophobicContact CG-CB 4.44Å; W429-I451 HydrophobicContact CG-CG2 3.96Å; W447-I451 PolarHBondContact O-N 3.22Å; S448-I451 PolarHBondContact O-N 2.9Å; I451-A453 PolarHBondContact O-N 2.69Å; I451-I454 WeakPolarHBondContact O-CA 3.27Å; I451-I454 WeakPolarHBondContact O-CB 3.28Å; I451-I454 PolarHBondContact O-N 3.14Å; I451-E455 PolarHBondContact O-N 3.48Å; I451-P461 HydrophobicContact CG2-CB 3.64Å; I451-P462 HydrophobicContact CD1-CG 4.33Å; I451-P481 HydrophobicContact CD1-CG 3.84Å; I451-L501 HydrophobicContact CD1-CD2 3.75Å; I451-L501 HydrophobicContact CG1-CD2 4.05Å
452	M	98.3	Very high	97.2	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-62.7	-28.2	175.2	-165.7	-168.6	89.1	0	0	113.1	L351 V368 I389 I394 S448 L449 I454 E455 M456	L351-M452 HydrophobicContact CD2-CE 3.93Å; L351-M452 HydrophobicContact CD2-CG 4.34Å; L351-M452 HydrophobicContact CD2-SD 4.13Å; V368-M452 HydrophobicContact CG1-CE 3.97Å; I389-M452 HydrophobicContact CG2-SD 4.18Å; I394-M452 HydrophobicContact CD1-SD 4.32Å; I394-M452 HydrophobicContact CG1-CE 4.13Å; I394-M452 HydrophobicContact CG1-SD 3.54Å; I394-M452 VanDerWaalsContact CG1-SD 3.54Å; S448-M452 WeakPolarHBondContact O-CB 3.49Å; S448-M452 PolarHBondContact O-N 3.22Å; L449-M452 HydrophobicContact CD1-CE 3.84Å; L449-M452 PolarHBondContact O-N 2.96Å; M452-I454 VanDerWaalsContact C-N 3.35Å; M452-E455 VanDerWaalsContact CA-OE2 3.32Å; M452-E455 WeakPolarHBondContact CA-OE2 3.46Å; M452-E455 WeakPolarHBondContact CG-OE2 3.29Å; M452-E455 WeakPolarHBondContact O-CB 3.48Å; M452-E455 PolarHBondContact O-N 3.18Å; M452-M456 HydrophobicContact CE-CE 3.69Å; M452-M456 PolarHBondContact O-N 3.29Å
453	A	98.5	Very high	97	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-74	-23.9	171.1	0	0	0	0	0	113.1	L449 G450 I451 M456 I457 F493 L497	L449-A453 PolarHBondContact O-N 3.08Å; G450-A453 PolarHBondContact O-N 3.05Å; I451-A453 PolarHBondContact O-N 2.69Å; A453-M456 HydrophobicContact CB-CE 4.49Å; A453-I457 VanDerWaalsContact O-CD1 3.26Å; A453-I457 WeakPolarHBondContact O-CD1 3.49Å; A453-I457 VanDerWaalsContact O-CG1 3.31Å; A453-I457 WeakPolarHBondContact O-CG1 3.34Å; A453-F493 HydrophobicContact CB-CE2 4.42Å; A453-L497 HydrophobicContact CB-CD2 3.56Å
454	I	97.8	Very high	96.7	Very high	3 Å²	3	17.8 Å²	17.8	2%	0.015	10%	0.095	C	C	.	.	H	α-helix	trans	-73.5	-41	167.3	-59.2	176.8	0	0	0	110.6	G450 I451 M452 M456 I457 E458 P462 P481 L483 L501	G450-I454 PolarHBondContact O-N 3.45Å; I451-I454 WeakPolarHBondContact O-CA 3.27Å; I451-I454 WeakPolarHBondContact O-CB 3.28Å; I451-I454 PolarHBondContact O-N 3.14Å; M452-I454 VanDerWaalsContact C-N 3.35Å; I454-M456 PolarHBondContact O-N 2.83Å; I454-I457 WeakPolarHBondContact O-CA 3.46Å; I454-I457 WeakPolarHBondContact O-CB 3.37Å; I454-I457 PolarHBondContact O-N 3.27Å; I454-E458 HydrophobicContact CG2-CB 4.42Å; I454-E458 HydrophobicContact CG2-CG 4.19Å; I454-E458 PolarHBondContact O-N 3.32Å; I454-P462 HydrophobicContact CD1-CG 3.79Å; I454-P462 HydrophobicContact CG2-CG 4.1Å; I454-P481 HydrophobicContact CD1-CB 4.13Å; I454-P481 HydrophobicContact CD1-CG 4.42Å; I454-L483 HydrophobicContact CD1-CD2 4.33Å; I454-L483 HydrophobicContact CG1-CD2 4.02Å; I454-L483 HydrophobicContact CG2-CD2 4.2Å; I454-L501 HydrophobicContact CD1-CD1 3.76Å; I454-L501 HydrophobicContact CG1-CD1 4.4Å
455	E	97.2	Very high	96.3	Very high	7 Å²	7	24.1 Å²	24.1	3%	0.033	13%	0.128	C	C	.	.	H	α-helix	trans	-53.3	-43.8	173.5	-59	-176.7	80.3	0	0	111.6	S391 W429 I451 M452 I457 G459 P461	S391-E455 WeakPolarHBondContact CB-OE1 3.28Å; S391-E455 PolarHBondContact N-OE2 3.41Å; S391-E455 VanDerWaalsContact N-OE2 3.12Å; S391-E455 PolarHBondContact OG-OE1 3.23Å; W429-E455 WeakPolarHBondContact CZ2-OE1 3.28Å; W429-E455 PolarHBondContact NE1-OE2 3.02Å; I451-E455 PolarHBondContact O-N 3.48Å; M452-E455 VanDerWaalsContact CA-OE2 3.32Å; M452-E455 WeakPolarHBondContact CA-OE2 3.46Å; M452-E455 WeakPolarHBondContact CG-OE2 3.29Å; M452-E455 WeakPolarHBondContact O-CB 3.48Å; M452-E455 PolarHBondContact O-N 3.18Å; E455-I457 PolarHBondContact O-N 3.43Å; E455-G459 VanDerWaalsContact O-CA 3.3Å; E455-G459 WeakPolarHBondContact O-CA 3.35Å; E455-G459 PolarHBondContact O-N 3.38Å; E455-P461 HydrophobicContact CG-CB 4.09Å
456	M	98.1	Very high	95.9	Very high	8 Å²	8	26.1 Å²	26.1	4%	0.039	14%	0.138	C	C	.	.	H	α-helix	trans	-69.7	-8.2	177.6	-69.7	-174.1	-82.2	0	0	114.8	L351 V355 M360 I365 V368 M452 A453 I454	L351-M456 HydrophobicContact CD1-SD 4.38Å; L351-M456 HydrophobicContact CD2-CG 4.32Å; L351-M456 HydrophobicContact CD2-SD 4.01Å; V355-M456 HydrophobicContact CG1-CB 4.3Å; V355-M456 HydrophobicContact CG1-CG 3.68Å; M360-M456 HydrophobicContact CE-SD 3.88Å; M360-M456 HydrophobicContact SD-CB 4.07Å; M360-M456 HydrophobicContact SD-CG 3.71Å; M360-M456 HydrophobicContact SD-SD 3.86Å; I365-M456 HydrophobicContact CD1-CB 4.05Å; I365-M456 WeakPolarHBondContact CD1-O 3.32Å; I365-M456 HydrophobicContact CG1-CB 3.97Å; I365-M456 HydrophobicContact CG2-CB 4.15Å; I365-M456 HydrophobicContact CG2-CE 3.94Å; I365-M456 HydrophobicContact CG2-SD 4.1Å; V368-M456 HydrophobicContact CB-CE 4.33Å; V368-M456 HydrophobicContact CB-SD 3.89Å; V368-M456 HydrophobicContact CG1-CE 3.99Å; V368-M456 HydrophobicContact CG1-SD 3.8Å; V368-M456 HydrophobicContact CG2-SD 4.33Å; M452-M456 HydrophobicContact CE-CE 3.69Å; M452-M456 PolarHBondContact O-N 3.29Å; A453-M456 HydrophobicContact CB-CE 4.49Å; I454-M456 PolarHBondContact O-N 2.83Å
457	I	96.4	Very high	95.4	Very high	55 Å²	55	28.5 Å²	28.5	28%	0.282	15%	0.15	S	C	.	.	H	α-helix	trans	-101.9	-45.8	174.1	-61.7	157.9	0	0	0	111.2	I365 A453 I454 E455 L483 L489 F493 L497	I365-I457 HydrophobicContact CD1-CG1 4.28Å; A453-I457 VanDerWaalsContact O-CD1 3.26Å; A453-I457 WeakPolarHBondContact O-CD1 3.49Å; A453-I457 VanDerWaalsContact O-CG1 3.31Å; A453-I457 WeakPolarHBondContact O-CG1 3.34Å; I454-I457 WeakPolarHBondContact O-CA 3.46Å; I454-I457 WeakPolarHBondContact O-CB 3.37Å; I454-I457 PolarHBondContact O-N 3.27Å; E455-I457 PolarHBondContact O-N 3.43Å; I457-L483 HydrophobicContact CD1-CD2 4.23Å; I457-L489 HydrophobicContact CD1-CD1 3.75Å; I457-L489 HydrophobicContact CD1-CD2 4.26Å; I457-L489 HydrophobicContact CG1-CD2 4.27Å; I457-L489 HydrophobicContact CG2-CD2 4.07Å; I457-F493 HydrophobicContact CD1-CE1 3.58Å; I457-F493 HydrophobicContact CD1-CZ 3.58Å; I457-F493 HydrophobicContact CG1-CE1 3.69Å; I457-F493 HydrophobicContact CG1-CZ 3.89Å; I457-L497 HydrophobicContact CD1-CD1 3.92Å
458	E	94.9	Very high	94.9	Very high	49 Å²	49	30.6 Å²	30.6	23%	0.229	16%	0.164	C	C	.	.	H	α-helix	trans	-112.3	-3.9	-164.9	-57	-166.8	171.8	0	0	113.6	I454 E460 L483 Q484	I454-E458 HydrophobicContact CG2-CB 4.42Å; I454-E458 HydrophobicContact CG2-CG 4.19Å; I454-E458 PolarHBondContact O-N 3.32Å; E458-E460 PolarHBondContact O-N 3.38Å; E458-L483 WeakPolarHBondContact OE1-CA 3.43Å; E458-Q484 PolarHBondContact OE1-N 3.17Å; E458-Q484 WeakPolarHBondContact OE2-CG 3.41Å; E458-Q484 PolarHBondContact OE2-NE2 3.02Å
459	G	94.5	Very high	94.4	Very high	29 Å²	29	30.4 Å²	30.4	30%	0.299	16%	0.163	S	C	.	.	S	Bend	trans	83.4	-21.9	179.2	0	0	0	0	0	114.6	E455	E455-G459 VanDerWaalsContact O-CA 3.3Å; E455-G459 WeakPolarHBondContact O-CA 3.35Å; E455-G459 PolarHBondContact O-N 3.38Å
460	E	94.3	Very high	93.9	Very high	75 Å²	75	31.7 Å²	31.7	35%	0.35	17%	0.168	S	C	.	.	S	Bend	trans	-137.3	156.6	177.5	59.4	172.2	-156.3	0	0	112.1	E458 L464	E458-E460 PolarHBondContact O-N 3.38Å; E460-L464 HydrophobicContact CB-CB 4.27Å; E460-L464 HydrophobicContact CB-CD2 3.79Å
461	P	95.1	Very high	93.6	Very high	4 Å²	4	31.7 Å²	31.7	3%	0.026	17%	0.168	C	C	.	.			trans	-74	155.8	171.5	33.2	-38.1	0	0	0	111.2	W429 I451 E455 Y463 L464	W429-P461 HydrophobicContact CH2-CG 3.77Å; W429-P461 HydrophobicContact CZ2-CB 4.12Å; W429-P461 HydrophobicContact CZ2-CG 3.68Å; W429-P461 HydrophobicContact CZ3-CG 4.3Å; I451-P461 HydrophobicContact CG2-CB 3.64Å; E455-P461 HydrophobicContact CG-CB 4.09Å; P461-Y463 PolarHBondContact O-N 2.62Å; P461-L464 HydrophobicContact CG-CB 4.23Å; P461-L464 HydrophobicContact CG-CD1 4.28Å; P461-L464 PolarHBondContact O-N 2.88Å
462	P	94.1	Very high	93.2	Very high	17 Å²	17	31.6 Å²	31.6	11%	0.11	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	136	178	-28.3	36.7	0	0	0	113.2	I451 I454 L464 P481	I451-P462 HydrophobicContact CD1-CG 4.33Å; I454-P462 HydrophobicContact CD1-CG 3.79Å; I454-P462 HydrophobicContact CG2-CG 4.1Å; P462-L464 VanDerWaalsContact C-N 3.32Å; P462-L464 PolarHBondContact O-N 2.86Å; P462-P481 HydrophobicContact CB-CB 3.92Å; P462-P481 HydrophobicContact CB-CG 4.2Å; P462-P481 HydrophobicContact CG-CB 3.64Å; P462-P481 HydrophobicContact CG-CG 3.9Å
463	Y	92.4	Very high	92.9	Very high	52 Å²	52	31.7 Å²	31.7	20%	0.204	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.7	19.6	178.8	-36	-65.9	0	0	0	115.4	Y428 P461 N465 E466 L474 I475	Y428-Y463 WeakPolarHBondContact CE1-O 3.26Å; P461-Y463 PolarHBondContact O-N 2.62Å; Y463-N465 PolarHBondContact O-N 3.1Å; Y463-E466 WeakPolarHBondContact O-CB 3.47Å; Y463-E466 PolarHBondContact O-N 2.9Å; Y463-L474 HydrophobicContact CD1-CB 4.41Å; Y463-L474 HydrophobicContact CD1-CD1 3.66Å; Y463-L474 HydrophobicContact CD2-CB 4.16Å; Y463-L474 HydrophobicContact CE1-CB 4.21Å; Y463-L474 HydrophobicContact CE1-CD1 3.99Å; Y463-L474 HydrophobicContact CE2-CB 3.95Å; Y463-L474 HydrophobicContact CG-CB 4.39Å; Y463-L474 HydrophobicContact CG-CD1 3.98Å; Y463-I475 HydrophobicContact CD2-CG1 4.28Å; Y463-I475 HydrophobicContact CE2-CG1 4.24Å
464	L	91.4	Very high	92.5	Very high	62 Å²	62	32.2 Å²	32.2	33%	0.325	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-36.2	177.6	-174.2	65	0	0	0	112.7	Y428 E460 P461 P462 E466	Y428-L464 HydrophobicContact CD2-CD1 4.05Å; Y428-L464 HydrophobicContact CE2-CD1 3.92Å; Y428-L464 HydrophobicContact CG-CD1 4.43Å; E460-L464 HydrophobicContact CB-CB 4.27Å; E460-L464 HydrophobicContact CB-CD2 3.79Å; P461-L464 HydrophobicContact CG-CB 4.23Å; P461-L464 HydrophobicContact CG-CD1 4.28Å; P461-L464 PolarHBondContact O-N 2.88Å; P462-L464 VanDerWaalsContact C-N 3.32Å; P462-L464 PolarHBondContact O-N 2.86Å; L464-E466 PolarHBondContact O-N 2.7Å
465	N	89	Confident	92.2	Very high	136 Å²	136	32.3 Å²	32.3	73%	0.727	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-13.7	175	64.2	-4.8	0	0	0	115.1	Y463	Y463-N465 PolarHBondContact O-N 3.1Å
466	E	90.3	Very high	91.8	Very high	43 Å²	43	32.9 Å²	32.9	20%	0.201	18%	0.177	C	C	.	.	S	Bend	trans	-92.2	151.6	177.6	-76.6	-86.1	-129.5	0	0	111.8	Y428 Y463 L464 R470 L474	Y428-E466 PolarHBondContact OH-O 2.76Å; Y463-E466 WeakPolarHBondContact O-CB 3.47Å; Y463-E466 PolarHBondContact O-N 2.9Å; L464-E466 PolarHBondContact O-N 2.7Å; E466-R470 HydrophobicContact CB-CB 4.21Å; E466-R470 HydrophobicContact CB-CG 3.95Å; E466-R470 HydrophobicContact CG-CG 3.99Å; E466-R470 WeakPolarHBondContact OE1-CG 3.45Å; E466-R470 IonicContact OE1-CZ 2.69Å; E466-R470 IonicContact OE1-NE 2.69Å; E466-R470 PolarHBondContact OE1-NE 3.29Å; E466-R470 VanDerWaalsContact OE2-CG 3.27Å; E466-R470 WeakPolarHBondContact OE2-CG 3.24Å; E466-L474 HydrophobicContact CG-CD1 4.17Å
467	N	87.4	Confident	91.3	Very high	49 Å²	49	34.4 Å²	34.4	26%	0.262	19%	0.186	S	C	.	.			trans	-53.1	137.3	173	179	-41.6	0	0	0	109.8	T109 L469 R470 A471	T109-N467 PolarHBondContact O-ND2 2.64Å; N467-L469 PolarHBondContact O-N 3.2Å; N467-L469 PolarHBondContact OD1-N 3.48Å; N467-R470 HydrophobicContact CB-CB 4.05Å; N467-R470 CarbonylContact O-C 3.46Å; N467-R470 WeakPolarHBondContact O-CA 3.13Å; N467-R470 VanDerWaalsContact O-CB 3.22Å; N467-R470 WeakPolarHBondContact O-CB 3.46Å; N467-R470 PolarHBondContact O-N 2.9Å; N467-A471 PolarHBondContact O-N 2.77Å
468	P	88.2	Confident	90.9	Very high	45 Å²	45	36.3 Å²	36.3	29%	0.292	20%	0.197	S	C	.	.	H	α-helix	trans	-51.9	-31.5	-179.8	-27.8	31.5	0	0	0	115.1	Y131 P427 Y428 L472	Y131-P468 HydrophobicContact CE2-CB 4.36Å; P427-P468 HydrophobicContact CB-CB 4.47Å; P427-P468 HydrophobicContact CG-CB 4.3Å; Y428-P468 WeakPolarHBondContact OH-CG 3.18Å; P468-L472 WeakPolarHBondContact O-CD1 3.26Å; P468-L472 WeakPolarHBondContact O-CG 3.48Å; P468-L472 PolarHBondContact O-N 3.44Å
469	L	87.9	Confident	90.2	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-69.7	-38.8	174.2	-155.3	160.4	0	0	0	111.4	L106 I112 V127 L128 Y131 N467 Y473	L106-L469 HydrophobicContact CB-CD1 3.87Å; L106-L469 HydrophobicContact CD1-CD1 4.43Å; L106-L469 HydrophobicContact CD2-CD1 4.11Å; L106-L469 HydrophobicContact CG-CD1 4.36Å; I112-L469 HydrophobicContact CD1-CD2 3.79Å; V127-L469 HydrophobicContact CG1-CD2 3.68Å; V127-L469 HydrophobicContact CG1-CG 3.98Å; V127-L469 VanDerWaalsContact CG1-O 3.24Å; V127-L469 WeakPolarHBondContact CG1-O 3.31Å; L128-L469 HydrophobicContact CD2-CD1 4.2Å; L128-L469 HydrophobicContact CD2-CD2 4.46Å; Y131-L469 HydrophobicContact CD1-CD1 4.31Å; Y131-L469 HydrophobicContact CD2-CB 3.7Å; Y131-L469 HydrophobicContact CD2-CD1 3.84Å; Y131-L469 HydrophobicContact CD2-CG 3.91Å; Y131-L469 HydrophobicContact CE2-CB 4.05Å; Y131-L469 HydrophobicContact CE2-CD1 4.48Å; Y131-L469 HydrophobicContact CG-CB 4.44Å; Y131-L469 HydrophobicContact CG-CD1 3.72Å; Y131-L469 HydrophobicContact CG-CG 4.19Å; N467-L469 PolarHBondContact O-N 3.2Å; N467-L469 PolarHBondContact OD1-N 3.48Å; L469-Y473 PolarHBondContact O-N 3.08Å
470	R	89.9	Confident	89.9	Confident	28 Å²	28	35.4 Å²	35.4	11%	0.106	19%	0.19	C	C	.	.	H	α-helix	trans	-67.8	-47.2	176.8	-179	48.6	-179.8	172	-4.2	112	S110 E116 E466 N467 L472 Y473 L474	S110-R470 VanDerWaalsContact O-CB 3.3Å; S110-R470 WeakPolarHBondContact O-CB 3.49Å; E116-R470 VanDerWaalsContact CD-NH1 3.35Å; E116-R470 IonicContact OE1-CZ 3.5Å; E116-R470 VanDerWaalsContact OE1-CZ 3.26Å; E116-R470 IonicContact OE1-NH1 2.69Å; E116-R470 PolarHBondContact OE1-NH1 3.48Å; E116-R470 IonicContact OE1-NH2 3.32Å; E116-R470 PolarHBondContact OE1-NH2 3.12Å; E116-R470 IonicContact OE2-NH1 2.77Å; E116-R470 IonicContact OE2-NH2 3.89Å; E466-R470 HydrophobicContact CB-CB 4.21Å; E466-R470 HydrophobicContact CB-CG 3.95Å; E466-R470 HydrophobicContact CG-CG 3.99Å; E466-R470 WeakPolarHBondContact OE1-CG 3.45Å; E466-R470 IonicContact OE1-CZ 2.69Å; E466-R470 IonicContact OE1-NE 2.69Å; E466-R470 PolarHBondContact OE1-NE 3.29Å; E466-R470 VanDerWaalsContact OE2-CG 3.27Å; E466-R470 WeakPolarHBondContact OE2-CG 3.24Å; N467-R470 HydrophobicContact CB-CB 4.05Å; N467-R470 CarbonylContact O-C 3.46Å; N467-R470 WeakPolarHBondContact O-CA 3.13Å; N467-R470 VanDerWaalsContact O-CB 3.22Å; N467-R470 WeakPolarHBondContact O-CB 3.46Å; N467-R470 PolarHBondContact O-N 2.9Å; R470-L472 VanDerWaalsContact C-N 3.32Å; R470-L472 PolarHBondContact O-N 2.7Å; R470-Y473 WeakPolarHBondContact O-CB 3.45Å; R470-Y473 PolarHBondContact O-N 2.84Å; R470-Y473 VanDerWaalsContact O-N 3.15Å; R470-L474 HydrophobicContact CG-CD1 4.17Å; R470-L474 WeakPolarHBondContact O-CG 3.27Å; R470-L474 PolarHBondContact O-N 2.96Å
471	A	90.9	Very high	89.7	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-58.3	-42.6	176.2	0	0	0	0	0	112.1	Y428 N467 Y473 L474 I475	Y428-A471 HydrophobicContact CD1-CB 3.63Å; Y428-A471 HydrophobicContact CE1-CB 3.48Å; Y428-A471 VanDerWaalsContact CE1-CB 3.48Å; N467-A471 PolarHBondContact O-N 2.77Å; A471-Y473 PolarHBondContact O-N 2.94Å; A471-L474 PolarHBondContact O-N 3.25Å; A471-I475 VanDerWaalsContact O-CG1 3.28Å; A471-I475 WeakPolarHBondContact O-CG1 3.4Å; A471-I475 PolarHBondContact O-N 3.04Å
472	L	90.5	Very high	89.3	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-63.5	-39.5	175.4	-71.2	163.9	0	0	0	112.8	V127 F130 P427 M430 V435 P468 R470 A476	V127-L472 HydrophobicContact CG1-CB 3.67Å; V127-L472 HydrophobicContact CG1-CD1 4.5Å; V127-L472 HydrophobicContact CG2-CB 4Å; F130-L472 HydrophobicContact CD1-CD1 3.29Å; F130-L472 HydrophobicContact CD2-CD1 4.1Å; F130-L472 HydrophobicContact CD2-CD2 4.37Å; F130-L472 HydrophobicContact CE1-CD1 3.26Å; F130-L472 HydrophobicContact CE2-CD1 4.07Å; F130-L472 HydrophobicContact CE2-CD2 4.08Å; F130-L472 HydrophobicContact CG-CD1 3.8Å; F130-L472 HydrophobicContact CZ-CD1 3.69Å; F130-L472 HydrophobicContact CZ-CD2 4.22Å; P427-L472 HydrophobicContact CB-CD1 4.25Å; P427-L472 HydrophobicContact CB-CD2 4.02Å; P427-L472 HydrophobicContact CB-CG 4.03Å; M430-L472 HydrophobicContact SD-CD2 4.21Å; V435-L472 HydrophobicContact CB-CD2 4.42Å; V435-L472 HydrophobicContact CG1-CB 4.02Å; V435-L472 HydrophobicContact CG1-CD2 3.92Å; V435-L472 WeakPolarHBondContact CG1-O 3.5Å; V435-L472 HydrophobicContact CG2-CD2 3.64Å; P468-L472 WeakPolarHBondContact O-CD1 3.26Å; P468-L472 WeakPolarHBondContact O-CG 3.48Å; P468-L472 PolarHBondContact O-N 3.44Å; R470-L472 VanDerWaalsContact C-N 3.32Å; R470-L472 PolarHBondContact O-N 2.7Å; L472-A476 WeakPolarHBondContact O-CB 3.36Å; L472-A476 PolarHBondContact O-N 2.82Å
473	Y	91	Very high	89.1	Confident	2 Å²	2	42 Å²	42	1%	0.008	22%	0.221	C	C	.	.	H	α-helix	trans	-61.3	-47.3	172.1	171	-88.3	0	0	0	111	I112 E116 N120 A123 V124 L469 R470 A471 I475 A476 T477	I112-Y473 HydrophobicContact CD1-CD1 4.48Å; I112-Y473 HydrophobicContact CD1-CD2 4.09Å; I112-Y473 HydrophobicContact CD1-CG 3.81Å; I112-Y473 HydrophobicContact CG1-CD1 4.39Å; I112-Y473 HydrophobicContact CG1-CG 4.2Å; I112-Y473 HydrophobicContact CG2-CD1 4.43Å; I112-Y473 HydrophobicContact CG2-CD2 4.26Å; I112-Y473 HydrophobicContact CG2-CE1 4.38Å; I112-Y473 HydrophobicContact CG2-CE2 4.21Å; I112-Y473 HydrophobicContact CG2-CG 4.39Å; E116-Y473 HydrophobicContact CB-CE1 4.19Å; E116-Y473 WeakPolarHBondContact CB-OH 3.37Å; E116-Y473 HydrophobicContact CG-CE1 4.33Å; E116-Y473 PolarHBondContact O-OH 2.86Å; N120-Y473 HydrophobicContact CB-CE2 4.02Å; N120-Y473 PolarHBondContact ND2-OH 2.77Å; A123-Y473 HydrophobicContact CB-CD2 4.34Å; A123-Y473 HydrophobicContact CB-CE2 4.35Å; V124-Y473 HydrophobicContact CG2-CD2 3.76Å; V124-Y473 HydrophobicContact CG2-CE2 3.66Å; L469-Y473 PolarHBondContact O-N 3.08Å; R470-Y473 WeakPolarHBondContact O-CB 3.45Å; R470-Y473 PolarHBondContact O-N 2.84Å; R470-Y473 VanDerWaalsContact O-N 3.15Å; A471-Y473 PolarHBondContact O-N 2.94Å; Y473-I475 PolarHBondContact O-N 3.12Å; Y473-A476 PolarHBondContact O-N 3.16Å; Y473-A476 VanDerWaalsContact O-N 3.08Å; Y473-T477 HydrophobicContact CD2-CG2 4.09Å; Y473-T477 HydrophobicContact CE1-CG2 4.12Å; Y473-T477 HydrophobicContact CE2-CG2 3.63Å; Y473-T477 WeakPolarHBondContact O-CG2 3.46Å; Y473-T477 PolarHBondContact O-N 2.95Å; Y473-T477 PolarHBondContact O-OG1 3.04Å; Y473-T477 VanDerWaalsContact O-OG1 3.14Å
474	L	91.5	Very high	89	Confident	11 Å²	11	45.7 Å²	45.7	6%	0.058	24%	0.24	C	C	.	.	H	α-helix	trans	-60.8	-43.7	179.2	-68.3	167.1	0	0	0	112.2	Y463 E466 R470 A471 A476 T477 N478	Y463-L474 HydrophobicContact CD1-CB 4.41Å; Y463-L474 HydrophobicContact CD1-CD1 3.66Å; Y463-L474 HydrophobicContact CD2-CB 4.16Å; Y463-L474 HydrophobicContact CE1-CB 4.21Å; Y463-L474 HydrophobicContact CE1-CD1 3.99Å; Y463-L474 HydrophobicContact CE2-CB 3.95Å; Y463-L474 HydrophobicContact CG-CB 4.39Å; Y463-L474 HydrophobicContact CG-CD1 3.98Å; E466-L474 HydrophobicContact CG-CD1 4.17Å; R470-L474 HydrophobicContact CG-CD1 4.17Å; R470-L474 WeakPolarHBondContact O-CG 3.27Å; R470-L474 PolarHBondContact O-N 2.96Å; A471-L474 PolarHBondContact O-N 3.25Å; L474-A476 VanDerWaalsContact C-N 3.3Å; L474-A476 PolarHBondContact O-N 3.38Å; L474-T477 PolarHBondContact O-N 3.38Å; L474-N478 VanDerWaalsContact O-CB 3.27Å; L474-N478 WeakPolarHBondContact O-CB 3.17Å; L474-N478 PolarHBondContact O-N 2.57Å
475	I	91.6	Very high	88.9	Confident	5 Å²	5	45.8 Å²	45.8	3%	0.026	24%	0.241	C	C	.	.	H	α-helix	trans	-59.9	-39.6	173.4	-69.4	164.3	0	0	0	111.3	P427 M430 P432 V435 Y463 A471 Y473	P427-I475 WeakPolarHBondContact O-CD1 3.42Å; M430-I475 WeakPolarHBondContact O-CG2 3.26Å; P432-I475 HydrophobicContact CB-CG2 4.49Å; P432-I475 HydrophobicContact CG-CG2 4.04Å; V435-I475 HydrophobicContact CG2-CG2 4.03Å; Y463-I475 HydrophobicContact CD2-CG1 4.28Å; Y463-I475 HydrophobicContact CE2-CG1 4.24Å; A471-I475 VanDerWaalsContact O-CG1 3.28Å; A471-I475 WeakPolarHBondContact O-CG1 3.4Å; A471-I475 PolarHBondContact O-N 3.04Å; Y473-I475 PolarHBondContact O-N 3.12Å
476	A	88.4	Confident	89.1	Confident	20 Å²	20	41.9 Å²	41.9	17%	0.165	22%	0.223	C	C	.	.	H	α-helix	trans	-74	-25.7	179.5	0	0	0	0	0	114.2	A123 V435 T436 L472 Y473 L474	A123-A476 HydrophobicContact CB-CB 4.21Å; V435-A476 HydrophobicContact CG1-CB 4.14Å; T436-A476 HydrophobicContact CG2-CB 3.9Å; L472-A476 WeakPolarHBondContact O-CB 3.36Å; L472-A476 PolarHBondContact O-N 2.82Å; Y473-A476 PolarHBondContact O-N 3.16Å; Y473-A476 VanDerWaalsContact O-N 3.08Å; L474-A476 VanDerWaalsContact C-N 3.3Å; L474-A476 PolarHBondContact O-N 3.38Å
477	T	88.4	Confident	89.2	Confident	39 Å²	39	45.6 Å²	45.6	24%	0.239	24%	0.24	C	C	.	.	H	α-helix	trans	-111	-29.9	-173.4	63	0	0	0	0	115.8	N120 A123 Y473 L474	N120-T477 HydrophobicContact CB-CG2 3.71Å; N120-T477 WeakPolarHBondContact ND2-CG2 3.36Å; A123-T477 HydrophobicContact CB-CG2 3.67Å; Y473-T477 HydrophobicContact CD2-CG2 4.09Å; Y473-T477 HydrophobicContact CE1-CG2 4.12Å; Y473-T477 HydrophobicContact CE2-CG2 3.63Å; Y473-T477 WeakPolarHBondContact O-CG2 3.46Å; Y473-T477 PolarHBondContact O-N 2.95Å; Y473-T477 PolarHBondContact O-OG1 3.04Å; Y473-T477 VanDerWaalsContact O-OG1 3.14Å; L474-T477 PolarHBondContact O-N 3.38Å
478	N	87.3	Confident	89.5	Confident	95 Å²	95	50.3 Å²	50.3	51%	0.508	26%	0.258	S	S	.	.	H	α-helix	trans	-95.1	-31.1	-177.8	-57.9	8.3	0	0	0	110.6	L474	L474-N478 VanDerWaalsContact O-CB 3.27Å; L474-N478 WeakPolarHBondContact O-CB 3.17Å; L474-N478 PolarHBondContact O-N 2.57Å
479	G	80.2	Confident	89.8	Confident	3 Å²	3	49.1 Å²	49.1	3%	0.031	25%	0.25	C	C	.	.			trans	81.8	-122.9	176.3	0	0	0	0	0	113	P481 M503	G479-P481 WeakPolarHBondContact O-CD 3.49Å; G479-M503 VanDerWaalsContact CA-CE 3.47Å; G479-M503 WeakPolarHBondContact CA-SD 3.45Å
480	T	87.7	Confident	90.3	Very high	57 Å²	57	50.6 Å²	50.6	35%	0.35	26%	0.26	S	S	.	.	S	Bend	trans	-58.8	120.8	179	-54.1	0	0	0	0	110.1	L501	T480-L501 HydrophobicContact CG2-CB 3.97Å; T480-L501 PolarHBondContact OG1-O 2.84Å
481	P	89.6	Confident	90.7	Very high	13 Å²	13	53.7 Å²	53.7	8%	0.084	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-62.3	143.1	178.4	-23.5	34	0	0	0	112.9	I451 I454 P462 G479	I451-P481 HydrophobicContact CD1-CG 3.84Å; I454-P481 HydrophobicContact CD1-CB 4.13Å; I454-P481 HydrophobicContact CD1-CG 4.42Å; P462-P481 HydrophobicContact CB-CB 3.92Å; P462-P481 HydrophobicContact CB-CG 4.2Å; P462-P481 HydrophobicContact CG-CB 3.64Å; P462-P481 HydrophobicContact CG-CG 3.9Å; G479-P481 WeakPolarHBondContact O-CD 3.49Å
482	E	88.1	Confident	91	Very high	185 Å²	185	57.6 Å²	57.6	86%	0.864	30%	0.304	S	S	*	.	P	Polyproline II helix	trans	-83.8	138	169.4	-64.6	-176.9	176.8	0	0	109.9
483	L	90.4	Very high	91.4	Very high	35 Å²	35	57.6 Å²	57.6	18%	0.183	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-80.9	150.5	173.3	-67	165.3	0	0	0	110.3	I454 I457 E458 P486 L489 L497	I454-L483 HydrophobicContact CD1-CD2 4.33Å; I454-L483 HydrophobicContact CG1-CD2 4.02Å; I454-L483 HydrophobicContact CG2-CD2 4.2Å; I457-L483 HydrophobicContact CD1-CD2 4.23Å; E458-L483 WeakPolarHBondContact OE1-CA 3.43Å; L483-P486 HydrophobicContact CB-CB 4.17Å; L483-P486 HydrophobicContact CD1-CB 4.15Å; L483-P486 WeakPolarHBondContact O-CD 3.26Å; L483-L489 HydrophobicContact CD1-CD1 3.56Å; L483-L497 HydrophobicContact CD1-CD1 4.05Å
484	Q	88.9	Confident	91.7	Very high	131 Å²	131	61 Å²	61	61%	0.612	32%	0.316	S	S	*	.	S	Bend	trans	-71	-34.5	176.7	-66.3	177.5	64.5	0	0	112.7	E458	E458-Q484 PolarHBondContact OE1-N 3.17Å; E458-Q484 WeakPolarHBondContact OE2-CG 3.41Å; E458-Q484 PolarHBondContact OE2-NE2 3.02Å
485	N	90.5	Very high	92	Very high	63 Å²	63	63.4 Å²	63.4	34%	0.337	33%	0.33	S	S	.	.			trans	-140.1	63.7	-179.5	-73.8	124	0	0	0	112.3	E487 K488	N485-E487 VanDerWaalsContact CA-OE2 3.28Å; N485-E487 WeakPolarHBondContact CA-OE2 3.35Å; N485-E487 WeakPolarHBondContact CB-OE1 3.35Å; N485-E487 PolarHBondContact ND2-OE1 2.59Å; N485-E487 PolarHBondContact O-N 3.15Å; N485-E487 VanDerWaalsContact O-N 3.12Å; N485-K488 HydrophobicContact CB-CB 4.47Å; N485-K488 HydrophobicContact CB-CD 3.53Å; N485-K488 HydrophobicContact CB-CG 3.92Å; N485-K488 PolarHBondContact O-N 3.2Å; N485-K488 VanDerWaalsContact O-N 3.13Å; N485-K488 WeakPolarHBondContact OD1-CE 3.33Å; N485-K488 PolarHBondContact OD1-NZ 3.19Å
486	P	92.4	Very high	92.4	Very high	54 Å²	54	63.2 Å²	63.2	35%	0.351	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-58.4	-28.2	-177.9	25.6	-34.6	0	0	0	112.5	L483 K488 L489 R494	L483-P486 HydrophobicContact CB-CB 4.17Å; L483-P486 HydrophobicContact CD1-CB 4.15Å; L483-P486 WeakPolarHBondContact O-CD 3.26Å; P486-K488 VanDerWaalsContact C-N 3.29Å; P486-K488 PolarHBondContact O-N 3.03Å; P486-L489 PolarHBondContact O-N 3.09Å; P486-R494 WeakPolarHBondContact O-CD 3.21Å; P486-R494 PolarHBondContact O-NH1 3.25Å
487	E	92.6	Very high	92.8	Very high	121 Å²	121	62.6 Å²	62.6	57%	0.565	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-66.2	-23.5	179.7	76.2	-65.1	158.3	0	0	114.4	N485 L489	N485-E487 VanDerWaalsContact CA-OE2 3.28Å; N485-E487 WeakPolarHBondContact CA-OE2 3.35Å; N485-E487 WeakPolarHBondContact CB-OE1 3.35Å; N485-E487 PolarHBondContact ND2-OE1 2.59Å; N485-E487 PolarHBondContact O-N 3.15Å; N485-E487 VanDerWaalsContact O-N 3.12Å; E487-L489 VanDerWaalsContact C-N 3.31Å
488	K	92.9	Very high	93.3	Very high	148 Å²	148	65.2 Å²	65.2	64%	0.643	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-72.5	-24.7	176.5	-66.6	175.9	-171.2	165.8	0	112.6	N485 P486	N485-K488 HydrophobicContact CB-CB 4.47Å; N485-K488 HydrophobicContact CB-CD 3.53Å; N485-K488 HydrophobicContact CB-CG 3.92Å; N485-K488 PolarHBondContact O-N 3.2Å; N485-K488 VanDerWaalsContact O-N 3.13Å; N485-K488 WeakPolarHBondContact OD1-CE 3.33Å; N485-K488 PolarHBondContact OD1-NZ 3.19Å; P486-K488 VanDerWaalsContact C-N 3.29Å; P486-K488 PolarHBondContact O-N 3.03Å
489	L	96.1	Very high	93.8	Very high	21 Å²	21	66.4 Å²	66.4	11%	0.11	33%	0.332	C	S	.	.	S	Bend	trans	-82.5	157	-177.6	-52.9	-174	0	0	0	112.2	E362 I457 L483 P486 E487 F493 R494 L497	E362-L489 WeakPolarHBondContact OE1-CA 3.46Å; I457-L489 HydrophobicContact CD1-CD1 3.75Å; I457-L489 HydrophobicContact CD1-CD2 4.26Å; I457-L489 HydrophobicContact CG1-CD2 4.27Å; I457-L489 HydrophobicContact CG2-CD2 4.07Å; L483-L489 HydrophobicContact CD1-CD1 3.56Å; P486-L489 PolarHBondContact O-N 3.09Å; E487-L489 VanDerWaalsContact C-N 3.31Å; L489-F493 HydrophobicContact CB-CD1 4.37Å; L489-F493 HydrophobicContact CD1-CD1 4.08Å; L489-F493 HydrophobicContact CD1-CE1 4.31Å; L489-F493 HydrophobicContact CD2-CD1 3.99Å; L489-F493 HydrophobicContact CD2-CE1 4.12Å; L489-F493 HydrophobicContact CG-CD1 4.38Å; L489-R494 HydrophobicContact CB-CG 4.07Å; L489-R494 HydrophobicContact CD1-CG 4.34Å; L489-R494 PolarHBondContact O-NH1 2.87Å; L489-L497 HydrophobicContact CD1-CD1 3.88Å
490	S	97.9	Very high	94.7	Very high	31 Å²	31	66.2 Å²	66.2	22%	0.217	33%	0.331	C	S	.	.			trans	-69.1	149.4	169.7	76.9	0	0	0	0	111.1	E362 I492 F493 R494	E362-S490 PolarHBondContact OE1-N 2.92Å; E362-S490 PolarHBondContact OE1-OG 3.08Å; E362-S490 WeakPolarHBondContact OE2-CB 3.29Å; E362-S490 PolarHBondContact OE2-OG 3.21Å; S490-I492 PolarHBondContact O-N 2.93Å; S490-I492 VanDerWaalsContact O-N 3.15Å; S490-F493 PolarHBondContact O-N 3.25Å; S490-F493 WeakPolarHBondContact OG-CB 3.48Å; S490-F493 PolarHBondContact OG-N 3.23Å; S490-R494 PolarHBondContact O-N 3.48Å; S490-R494 VanDerWaalsContact O-N 3.08Å
491	P	97.8	Very high	95.1	Very high	94 Å²	94	63.8 Å²	63.8	61%	0.61	32%	0.315	S	S	*	.	H	α-helix	trans	-57.3	-28.2	172.7	-23.1	32.6	0	0	0	113.1	D495	P491-D495 PolarHBondContact O-N 2.84Å; P491-D495 VanDerWaalsContact O-N 3.1Å
492	I	98	Very high	95.5	Very high	81 Å²	81	66.1 Å²	66.1	42%	0.415	33%	0.325	S	S	.	.	H	α-helix	trans	-75.1	-39.8	-179.3	-63.8	171.5	0	0	0	110.8	S490 D495 F496 H517 Q518 F519	S490-I492 PolarHBondContact O-N 2.93Å; S490-I492 VanDerWaalsContact O-N 3.15Å; I492-D495 PolarHBondContact O-N 2.72Å; I492-F496 PolarHBondContact O-N 2.92Å; I492-F496 VanDerWaalsContact O-N 3.15Å; I492-H517 PolarHBondContact O-CE1 3.29Å; I492-Q518 HydrophobicContact CG2-CB 3.9Å; I492-F519 HydrophobicContact CG2-CB 3.95Å
493	F	98.4	Very high	95.8	Very high	0 Å²	0	61 Å²	61	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-69.2	-38.7	174.3	-172	-163.9	0	0	0	111.3	E362 I365 A453 I457 L489 S490 D495 F496 L497 F519	E362-F493 HydrophobicContact CG-CD1 3.71Å; E362-F493 HydrophobicContact CG-CE1 4.26Å; E362-F493 HydrophobicContact CG-CG 4.5Å; I365-F493 HydrophobicContact CD1-CE1 4.08Å; I365-F493 HydrophobicContact CD1-CZ 4.3Å; I365-F493 HydrophobicContact CG2-CE1 4.38Å; I365-F493 HydrophobicContact CG2-CE2 4.25Å; I365-F493 HydrophobicContact CG2-CZ 3.71Å; A453-F493 HydrophobicContact CB-CE2 4.42Å; I457-F493 HydrophobicContact CD1-CE1 3.58Å; I457-F493 HydrophobicContact CD1-CZ 3.58Å; I457-F493 HydrophobicContact CG1-CE1 3.69Å; I457-F493 HydrophobicContact CG1-CZ 3.89Å; L489-F493 HydrophobicContact CB-CD1 4.37Å; L489-F493 HydrophobicContact CD1-CD1 4.08Å; L489-F493 HydrophobicContact CD1-CE1 4.31Å; L489-F493 HydrophobicContact CD2-CD1 3.99Å; L489-F493 HydrophobicContact CD2-CE1 4.12Å; L489-F493 HydrophobicContact CG-CD1 4.38Å; S490-F493 PolarHBondContact O-N 3.25Å; S490-F493 WeakPolarHBondContact OG-CB 3.48Å; S490-F493 PolarHBondContact OG-N 3.23Å; F493-D495 PolarHBondContact O-N 3.14Å; F493-F496 HydrophobicContact CD2-CB 4.44Å; F493-F496 HydrophobicContact CD2-CD1 4.24Å; F493-F496 HydrophobicContact CE2-CD1 4.25Å; F493-F496 WeakPolarHBondContact O-CB 3.2Å; F493-F496 PolarHBondContact O-N 2.89Å; F493-F496 VanDerWaalsContact O-N 3.11Å; F493-L497 HydrophobicContact CD2-CD1 4.27Å; F493-L497 HydrophobicContact CD2-CD2 4.47Å; F493-L497 HydrophobicContact CD2-CG 3.97Å; F493-L497 HydrophobicContact CE2-CD1 4.08Å; F493-L497 HydrophobicContact CE2-CD2 3.79Å; F493-L497 HydrophobicContact CE2-CG 3.76Å; F493-L497 HydrophobicContact CZ-CD1 4.32Å; F493-L497 HydrophobicContact CZ-CD2 4.32Å; F493-L497 HydrophobicContact CZ-CG 4.43Å; F493-L497 WeakPolarHBondContact O-CG 3.48Å; F493-L497 PolarHBondContact O-N 3.49Å; F493-F519 HydrophobicContact CB-CD2 3.72Å; F493-F519 HydrophobicContact CB-CE2 3.54Å; F493-F519 HydrophobicContact CB-CZ 4.3Å; F493-F519 AromaticContact CD1-CE2 3.96Å; F493-F519 HydrophobicContact CD1-CE2 3.96Å; F493-F519 HydrophobicContact CD1-CZ 4.11Å; F493-F519 HydrophobicContact CD2-CD1 4.09Å; F493-F519 AromaticContact CD2-CD2 3.91Å; F493-F519 HydrophobicContact CD2-CD2 3.91Å; F493-F519 AromaticContact CD2-CE1 3.59Å; F493-F519 HydrophobicContact CD2-CE1 3.59Å; F493-F519 AromaticContact CD2-CE2 3.38Å; F493-F519 HydrophobicContact CD2-CE2 3.38Å; F493-F519 HydrophobicContact CD2-CG 4.24Å; F493-F519 AromaticContact CD2-CZ 3.2Å; F493-F519 HydrophobicContact CD2-CZ 3.2Å; F493-F519 HydrophobicContact CE1-CZ 4.24Å; F493-F519 AromaticContact CE2-CE1 3.68Å; F493-F519 HydrophobicContact CE2-CE1 3.68Å; F493-F519 HydrophobicContact CE2-CE2 4.05Å; F493-F519 AromaticContact CE2-CZ 3.4Å; F493-F519 HydrophobicContact CE2-CZ 3.4Å; F493-F519 AromaticContact CG-CD2 3.96Å; F493-F519 HydrophobicContact CG-CD2 3.96Å; F493-F519 HydrophobicContact CG-CE1 4.41Å; F493-F519 AromaticContact CG-CE2 3.35Å; F493-F519 HydrophobicContact CG-CE2 3.35Å; F493-F519 AromaticContact CG-CZ 3.62Å; F493-F519 HydrophobicContact CG-CZ 3.62Å; F493-F519 AromaticContact CZ-CZ 3.93Å; F493-F519 HydrophobicContact CZ-CZ 3.93Å
494	R	97.7	Very high	96	Very high	73 Å²	73	62.4 Å²	62.4	28%	0.275	31%	0.31	S	S	.	.	H	α-helix	trans	-59.6	-41.4	172.1	-68.4	-166.8	-63	-91.1	-8	113	P486 L489 S490 F496 L497 N498	P486-R494 WeakPolarHBondContact O-CD 3.21Å; P486-R494 PolarHBondContact O-NH1 3.25Å; L489-R494 HydrophobicContact CB-CG 4.07Å; L489-R494 HydrophobicContact CD1-CG 4.34Å; L489-R494 PolarHBondContact O-NH1 2.87Å; S490-R494 PolarHBondContact O-N 3.48Å; S490-R494 VanDerWaalsContact O-N 3.08Å; R494-F496 VanDerWaalsContact C-N 3.31Å; R494-F496 PolarHBondContact O-N 3.32Å; R494-L497 PolarHBondContact O-N 3.11Å; R494-N498 WeakPolarHBondContact O-CB 3.42Å; R494-N498 PolarHBondContact O-N 3.09Å; R494-N498 PolarHBondContact O-ND2 3.48Å; R494-N498 PolarHBondContact O-OD1 2.89Å
495	D	98.1	Very high	96.3	Very high	63 Å²	63	57.7 Å²	57.7	34%	0.337	29%	0.29	S	S	.	.	H	α-helix	trans	-63.9	-35.4	174	-164.5	63.2	0	0	0	112.2	P491 I492 F493 R499 H517	P491-D495 PolarHBondContact O-N 2.84Å; P491-D495 VanDerWaalsContact O-N 3.1Å; I492-D495 PolarHBondContact O-N 2.72Å; F493-D495 PolarHBondContact O-N 3.14Å; D495-R499 VanDerWaalsContact O-CG 3.25Å; D495-R499 WeakPolarHBondContact O-CG 3.46Å; D495-R499 PolarHBondContact O-N 2.88Å; D495-R499 VanDerWaalsContact O-N 3.08Å; D495-R499 IonicContact OD2-CZ 2.59Å; D495-R499 VanDerWaalsContact OD2-CZ 3.32Å; D495-R499 IonicContact OD2-NE 3.73Å; D495-R499 PolarHBondContact OD2-NE 2.99Å; D495-R499 IonicContact OD2-NH2 3.18Å; D495-R499 PolarHBondContact OD2-NH2 3.16Å; D495-H517 IonicContact OD2-CE1 2.87Å; D495-H517 IonicContact OD2-NE2 3.58Å; D495-H517 PolarHBondContact OD2-NE2 2.88Å
496	F	98.7	Very high	96.6	Very high	0 Å²	0	61 Å²	61	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-64.5	-48.8	174.5	-178.6	-99.1	0	0	0	111.9	C369 L373 I492 F493 R494 N498 R499 C500 L514 H517 F519 L520	C369-F496 HydrophobicContact CB-CE1 4.14Å; C369-F496 HydrophobicContact CB-CZ 3.96Å; L373-F496 HydrophobicContact CD1-CE2 3.95Å; L373-F496 HydrophobicContact CD1-CZ 3.89Å; I492-F496 PolarHBondContact O-N 2.92Å; I492-F496 VanDerWaalsContact O-N 3.15Å; F493-F496 HydrophobicContact CD2-CB 4.44Å; F493-F496 HydrophobicContact CD2-CD1 4.24Å; F493-F496 HydrophobicContact CE2-CD1 4.25Å; F493-F496 WeakPolarHBondContact O-CB 3.2Å; F493-F496 PolarHBondContact O-N 2.89Å; F493-F496 VanDerWaalsContact O-N 3.11Å; R494-F496 VanDerWaalsContact C-N 3.31Å; R494-F496 PolarHBondContact O-N 3.32Å; F496-N498 PolarHBondContact O-N 2.96Å; F496-R499 PolarHBondContact O-N 3.23Å; F496-C500 PolarHBondContact O-N 3.16Å; F496-C500 VanDerWaalsContact O-N 3.14Å; F496-C500 PolarHBondContact O-SG 3.39Å; F496-L514 HydrophobicContact CD2-CD2 4Å; F496-L514 HydrophobicContact CE2-CB 4.27Å; F496-L514 HydrophobicContact CE2-CD2 3.95Å; F496-H517 HydrophobicContact CD2-CB 4.03Å; F496-H517 AromaticContact CD2-CG 3.88Å; F496-H517 AromaticContact CD2-ND1 3.62Å; F496-H517 PolarHBondContact N-CE1 3.35Å; F496-F519 HydrophobicContact CB-CB 3.85Å; F496-F519 HydrophobicContact CB-CD1 3.94Å; F496-F519 HydrophobicContact CB-CG 4.02Å; F496-F519 AromaticContact CD1-CD1 3.54Å; F496-F519 HydrophobicContact CD1-CD1 3.54Å; F496-F519 AromaticContact CD1-CE1 3.82Å; F496-F519 HydrophobicContact CD1-CE1 3.82Å; F496-F519 HydrophobicContact CD1-CG 4.44Å; F496-F519 HydrophobicContact CD2-CB 4.16Å; F496-F519 AromaticContact CD2-CD1 3.87Å; F496-F519 HydrophobicContact CD2-CD1 3.87Å; F496-F519 HydrophobicContact CD2-CG 4.46Å; F496-F519 AromaticContact CE1-CD1 3.94Å; F496-F519 HydrophobicContact CE1-CD1 3.94Å; F496-F519 HydrophobicContact CE1-CE1 4.04Å; F496-F519 HydrophobicContact CE2-CD1 4.23Å; F496-F519 HydrophobicContact CG-CB 4.08Å; F496-F519 AromaticContact CG-CD1 3.5Å; F496-F519 HydrophobicContact CG-CD1 3.5Å; F496-F519 HydrophobicContact CG-CE1 4.26Å; F496-F519 HydrophobicContact CG-CG 4.06Å; F496-F519 HydrophobicContact CZ-CD1 4.26Å; F496-L520 HydrophobicContact CE2-CD2 4Å; F496-L520 HydrophobicContact CE2-CG 4.3Å; F496-L520 HydrophobicContact CZ-CD2 4.2Å
497	L	98.3	Very high	96.8	Very high	7 Å²	7	65.2 Å²	65.2	4%	0.037	32%	0.316	C	S	.	.	H	α-helix	trans	-59.5	-46.1	176.8	-68.5	172.8	0	0	0	111.4	A453 I457 L483 L489 F493 R494 R499 C500 L501	A453-L497 HydrophobicContact CB-CD2 3.56Å; I457-L497 HydrophobicContact CD1-CD1 3.92Å; L483-L497 HydrophobicContact CD1-CD1 4.05Å; L489-L497 HydrophobicContact CD1-CD1 3.88Å; F493-L497 HydrophobicContact CD2-CD1 4.27Å; F493-L497 HydrophobicContact CD2-CD2 4.47Å; F493-L497 HydrophobicContact CD2-CG 3.97Å; F493-L497 HydrophobicContact CE2-CD1 4.08Å; F493-L497 HydrophobicContact CE2-CD2 3.79Å; F493-L497 HydrophobicContact CE2-CG 3.76Å; F493-L497 HydrophobicContact CZ-CD1 4.32Å; F493-L497 HydrophobicContact CZ-CD2 4.32Å; F493-L497 HydrophobicContact CZ-CG 4.43Å; F493-L497 WeakPolarHBondContact O-CG 3.48Å; F493-L497 PolarHBondContact O-N 3.49Å; R494-L497 PolarHBondContact O-N 3.11Å; L497-R499 VanDerWaalsContact C-N 3.32Å; L497-R499 PolarHBondContact O-N 2.93Å; L497-C500 PolarHBondContact O-N 2.88Å; L497-L501 WeakPolarHBondContact O-CB 3.34Å; L497-L501 PolarHBondContact O-N 2.66Å
498	N	97.4	Very high	97.1	Very high	94 Å²	94	59.4 Å²	59.4	50%	0.503	29%	0.289	S	S	.	.	H	α-helix	trans	-57.3	-42.5	177	-69.9	-12.2	0	0	0	112.1	R494 F496 C500 L501 E502	R494-N498 WeakPolarHBondContact O-CB 3.42Å; R494-N498 PolarHBondContact O-N 3.09Å; R494-N498 PolarHBondContact O-ND2 3.48Å; R494-N498 PolarHBondContact O-OD1 2.89Å; F496-N498 PolarHBondContact O-N 2.96Å; N498-C500 VanDerWaalsContact C-N 3.3Å; N498-C500 PolarHBondContact O-N 3.45Å; N498-L501 PolarHBondContact O-N 3.2Å; N498-E502 WeakPolarHBondContact O-CB 3.27Å; N498-E502 PolarHBondContact O-N 2.83Å
499	R	98.2	Very high	97.3	Very high	120 Å²	120	52.8 Å²	52.8	45%	0.453	26%	0.263	S	S	.	.	H	α-helix	trans	-67.6	-27.4	177	-71	168.6	-173.9	-80.9	-8.7	113.7	D495 F496 L497 R508 G509 L514 H517	D495-R499 VanDerWaalsContact O-CG 3.25Å; D495-R499 WeakPolarHBondContact O-CG 3.46Å; D495-R499 PolarHBondContact O-N 2.88Å; D495-R499 VanDerWaalsContact O-N 3.08Å; D495-R499 IonicContact OD2-CZ 2.59Å; D495-R499 VanDerWaalsContact OD2-CZ 3.32Å; D495-R499 IonicContact OD2-NE 3.73Å; D495-R499 PolarHBondContact OD2-NE 2.99Å; D495-R499 IonicContact OD2-NH2 3.18Å; D495-R499 PolarHBondContact OD2-NH2 3.16Å; F496-R499 PolarHBondContact O-N 3.23Å; L497-R499 VanDerWaalsContact C-N 3.32Å; L497-R499 PolarHBondContact O-N 2.93Å; R499-R508 WeakPolarHBondContact O-CG 3.41Å; R499-G509 PolarHBondContact O-N 3.11Å; R499-L514 HydrophobicContact CB-CD2 3.76Å; R499-H517 VanDerWaalsContact CD-CD2 3.48Å; R499-H517 WeakPolarHBondContact CD-CD2 3.33Å; R499-H517 PolarHBondContact NE-CD2 3.39Å; R499-H517 PolarHBondContact NE-NE2 2.89Å
500	C	98.4	Very high	97.4	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-80.8	-39.8	175.7	-64.8	0	0	0	0	112	I446 W447 F496 L497 N498 R508	I446-C500 HydrophobicContact CG2-CB 4.29Å; W447-C500 WeakPolarHBondContact CA-O 3.43Å; F496-C500 PolarHBondContact O-N 3.16Å; F496-C500 VanDerWaalsContact O-N 3.14Å; F496-C500 PolarHBondContact O-SG 3.39Å; L497-C500 PolarHBondContact O-N 2.88Å; N498-C500 VanDerWaalsContact C-N 3.3Å; N498-C500 PolarHBondContact O-N 3.45Å; C500-R508 WeakPolarHBondContact O-CD 3.12Å; C500-R508 WeakPolarHBondContact O-CG 3.46Å
501	L	97.8	Very high	97.5	Very high	5 Å²	5	51.9 Å²	51.9	3%	0.026	26%	0.259	C	S	.	.	S	Bend	trans	-103.1	22.8	-173	-60.8	170.5	0	0	0	113.2	W447 I451 I454 T480 L497 N498	W447-L501 HydrophobicContact CD2-CD2 3.8Å; W447-L501 HydrophobicContact CE3-CB 4.46Å; W447-L501 HydrophobicContact CE3-CD2 4.16Å; W447-L501 HydrophobicContact CG-CD2 4.14Å; W447-L501 HydrophobicContact CZ2-CD2 4.23Å; W447-L501 HydrophobicContact CZ3-CB 4.32Å; W447-L501 WeakPolarHBondContact CZ3-O 3.49Å; W447-L501 WeakPolarHBondContact O-CD2 3.34Å; I451-L501 HydrophobicContact CD1-CD2 3.75Å; I451-L501 HydrophobicContact CG1-CD2 4.05Å; I454-L501 HydrophobicContact CD1-CD1 3.76Å; I454-L501 HydrophobicContact CG1-CD1 4.4Å; T480-L501 HydrophobicContact CG2-CB 3.97Å; T480-L501 PolarHBondContact OG1-O 2.84Å; L497-L501 WeakPolarHBondContact O-CB 3.34Å; L497-L501 PolarHBondContact O-N 2.66Å; N498-L501 PolarHBondContact O-N 3.2Å
502	E	97.1	Very high	97.5	Very high	62 Å²	62	53.4 Å²	53.4	29%	0.29	26%	0.255	S	S	.	.			trans	-68.9	133.2	173.4	168.5	59.4	-116.9	0	0	110.5	N498 D504 K507 R508	N498-E502 WeakPolarHBondContact O-CB 3.27Å; N498-E502 PolarHBondContact O-N 2.83Å; E502-D504 HydrophobicContact CG-CB 4.48Å; E502-D504 WeakPolarHBondContact OE1-CB 3.39Å; E502-D504 PolarHBondContact OE1-N 2.91Å; E502-K507 HydrophobicContact CG-CB 3.65Å; E502-R508 HydrophobicContact CB-CB 3.99Å; E502-R508 HydrophobicContact CB-CG 4.24Å; E502-R508 HydrophobicContact CG-CB 4.22Å; E502-R508 PolarHBondContact O-NE 2.86Å; E502-R508 PolarHBondContact O-NH2 2.81Å
503	M	93.4	Very high	97.5	Very high	78 Å²	78	55.1 Å²	55.1	38%	0.384	26%	0.262	S	S	.	.	S	Bend	trans	-73.7	-35.4	-175.4	-71.6	-62.2	-71.3	0	0	112.6	P432 W447 G479 V505	P432-M503 HydrophobicContact CB-CE 3.96Å; P432-M503 HydrophobicContact CB-SD 4.46Å; P432-M503 HydrophobicContact CG-CE 3.9Å; P432-M503 HydrophobicContact CG-SD 3.78Å; W447-M503 HydrophobicContact CH2-SD 3.66Å; W447-M503 HydrophobicContact CZ3-SD 3.76Å; G479-M503 VanDerWaalsContact CA-CE 3.47Å; G479-M503 WeakPolarHBondContact CA-SD 3.45Å; M503-V505 PolarHBondContact O-N 3.32Å
504	D	95	Very high	97.5	Very high	64 Å²	64	55.2 Å²	55.2	34%	0.342	26%	0.262	S	S	.	.	S	Bend	trans	-78.9	107.7	174.4	-174.4	-19.9	0	0	0	110.2	E502 E506 K507 R508	E502-D504 HydrophobicContact CG-CB 4.48Å; E502-D504 WeakPolarHBondContact OE1-CB 3.39Å; E502-D504 PolarHBondContact OE1-N 2.91Å; D504-E506 PolarHBondContact O-N 2.91Å; D504-E506 VanDerWaalsContact O-N 3.09Å; D504-E506 PolarHBondContact OD1-N 3.43Å; D504-K507 HydrophobicContact CB-CB 4.08Å; D504-K507 HydrophobicContact CB-CD 4.19Å; D504-K507 HydrophobicContact CB-CG 3.95Å; D504-K507 PolarHBondContact O-N 3.14Å; D504-K507 IonicContact OD2-NZ 3.77Å; D504-K507 PolarHBondContact OD2-NZ 3.44Å; D504-R508 PolarHBondContact O-N 2.59Å
505	V	95.8	Very high	97.6	Very high	33 Å²	33	54.3 Å²	54.3	20%	0.2	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-29.6	-179.1	-176.1	0	0	0	0	112.3	E433 K443 M503	E433-V505 HydrophobicContact CB-CG2 4.33Å; E433-V505 HydrophobicContact CG-CG2 4.08Å; K443-V505 HydrophobicContact CB-CG1 4.22Å; K443-V505 HydrophobicContact CD-CG1 4.24Å; K443-V505 WeakPolarHBondContact CD-O 3.39Å; K443-V505 WeakPolarHBondContact CE-O 3.36Å; K443-V505 PolarHBondContact NZ-O 3.3Å; M503-V505 PolarHBondContact O-N 3.32Å
506	E	95.9	Very high	97.6	Very high	132 Å²	132	58.4 Å²	58.4	62%	0.617	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-32.9	178.2	-55.2	-54.6	155.1	0	0	111.5	K419 K443 D504	K419-E506 IonicContact NZ-OE1 2.8Å; K443-E506 PolarHBondContact NZ-O 3.25Å; D504-E506 PolarHBondContact O-N 2.91Å; D504-E506 VanDerWaalsContact O-N 3.09Å; D504-E506 PolarHBondContact OD1-N 3.43Å
507	K	97.3	Very high	97.6	Very high	142 Å²	142	59.2 Å²	59.2	62%	0.617	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-32.4	173.5	-62.1	-168.7	-162.2	81.4	0	114.4	E502 D504	E502-K507 HydrophobicContact CG-CB 3.65Å; D504-K507 HydrophobicContact CB-CB 4.08Å; D504-K507 HydrophobicContact CB-CD 4.19Å; D504-K507 HydrophobicContact CB-CG 3.95Å; D504-K507 PolarHBondContact O-N 3.14Å; D504-K507 IonicContact OD2-NZ 3.77Å; D504-K507 PolarHBondContact OD2-NZ 3.44Å
508	R	98.4	Very high	97.6	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	31%	0.307	C	S	.	.	S	Bend	trans	-55.3	137.8	178.9	-167.4	-170.5	-58.8	154	4.9	110.1	E433 K443 I446 R499 C500 E502 D504	E433-R508 IonicContact OE1-CZ 2.96Å; E433-R508 IonicContact OE1-NH1 3.62Å; E433-R508 PolarHBondContact OE1-NH1 2.95Å; E433-R508 IonicContact OE1-NH2 3.94Å; E433-R508 PolarHBondContact OE1-NH2 2.95Å; E433-R508 IonicContact OE2-CZ 2.68Å; E433-R508 IonicContact OE2-NH1 3.76Å; E433-R508 IonicContact OE2-NH2 2.62Å; E433-R508 PolarHBondContact OE2-NH2 3.44Å; K443-R508 HydrophobicContact CD-CB 4.48Å; K443-R508 WeakPolarHBondContact CD-O 3.26Å; K443-R508 WeakPolarHBondContact CE-O 3.46Å; K443-R508 PolarHBondContact NZ-O 2.71Å; K443-R508 PolarHBondContact O-NH1 3.09Å; I446-R508 HydrophobicContact CG2-CG 4.32Å; R499-R508 WeakPolarHBondContact O-CG 3.41Å; C500-R508 WeakPolarHBondContact O-CD 3.12Å; C500-R508 WeakPolarHBondContact O-CG 3.46Å; E502-R508 HydrophobicContact CB-CB 3.99Å; E502-R508 HydrophobicContact CB-CG 4.24Å; E502-R508 HydrophobicContact CG-CB 4.22Å; E502-R508 PolarHBondContact O-NE 2.86Å; E502-R508 PolarHBondContact O-NH2 2.81Å; D504-R508 PolarHBondContact O-N 2.59Å
509	G	98.3	Very high	97.7	Very high	8 Å²	8	59.8 Å²	59.8	8%	0.082	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-60.3	146.9	-177.2	0	0	0	0	0	112.7	I446 R499	I446-G509 WeakPolarHBondContact CG2-O 3.49Å; R499-G509 PolarHBondContact O-N 3.11Å
510	S	98.7	Very high	97.7	Very high	32 Å²	32	54.7 Å²	54.7	22%	0.224	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-81.3	163.1	158.2	67.5	0	0	0	0	110.8	K512 E513 L514	S510-K512 PolarHBondContact O-N 3.01Å; S510-E513 WeakPolarHBondContact CB-OE2 3.35Å; S510-E513 PolarHBondContact N-OE2 3.21Å; S510-E513 PolarHBondContact O-N 2.98Å; S510-E513 WeakPolarHBondContact OG-CG 3.38Å; S510-E513 PolarHBondContact OG-N 2.88Å; S510-E513 PolarHBondContact OG-OE2 3.25Å; S510-L514 PolarHBondContact O-N 3.21Å
511	A	98.6	Very high	97.6	Very high	2 Å²	2	61.7 Å²	61.7	2%	0.017	30%	0.295	C	S	.	.	H	α-helix	trans	-52.8	-42.8	175.3	0	0	0	0	0	111.8	L373 L376 E377 I446 E513 L514 L515	L373-A511 HydrophobicContact CD2-CB 4.09Å; L376-A511 HydrophobicContact CB-CB 4.03Å; E377-A511 HydrophobicContact CB-CB 3.87Å; E377-A511 HydrophobicContact CG-CB 4.36Å; I446-A511 HydrophobicContact CD1-CB 3.98Å; A511-E513 PolarHBondContact O-N 3.2Å; A511-L514 PolarHBondContact O-N 2.85Å; A511-L515 WeakPolarHBondContact O-CG 3.37Å; A511-L515 PolarHBondContact O-N 3Å
512	K	98.4	Very high	97.6	Very high	125 Å²	125	65.4 Å²	65.4	54%	0.543	31%	0.314	S	S	.	.	H	α-helix	trans	-63.8	-35.9	-179.3	-171.1	170.1	-169.9	148.1	0	114.4	E377 S510	E377-K512 HydrophobicContact CG-CB 3.79Å; E377-K512 HydrophobicContact CG-CG 4.33Å; E377-K512 WeakPolarHBondContact OE1-CD 3.49Å; E377-K512 IonicContact OE1-NZ 3.04Å; S510-K512 PolarHBondContact O-N 3.01Å
513	E	98.5	Very high	97.7	Very high	117 Å²	117	63.3 Å²	63.3	55%	0.547	31%	0.307	S	S	.	.	H	α-helix	trans	-77.5	-40.6	177	-69	159.3	124.9	0	0	110.8	S510 A511 L515 Q516	S510-E513 WeakPolarHBondContact CB-OE2 3.35Å; S510-E513 PolarHBondContact N-OE2 3.21Å; S510-E513 PolarHBondContact O-N 2.98Å; S510-E513 WeakPolarHBondContact OG-CG 3.38Å; S510-E513 PolarHBondContact OG-N 2.88Å; S510-E513 PolarHBondContact OG-OE2 3.25Å; A511-E513 PolarHBondContact O-N 3.2Å; E513-L515 VanDerWaalsContact C-N 3.32Å; E513-L515 PolarHBondContact O-N 2.98Å; E513-Q516 WeakPolarHBondContact O-CB 3.15Å; E513-Q516 PolarHBondContact O-N 3.43Å
514	L	98.7	Very high	97.9	Very high	2 Å²	2	63.4 Å²	63.4	1%	0.01	31%	0.306	C	S	.	.	H	α-helix	trans	-66.6	-31.6	177.4	-72.7	168.6	0	0	0	112.6	L373 I446 F496 R499 S510 A511 Q516 H517 L520	L373-L514 HydrophobicContact CD1-CB 3.77Å; L373-L514 HydrophobicContact CD2-CB 3.84Å; L373-L514 HydrophobicContact CD2-CD1 4.14Å; I446-L514 HydrophobicContact CD1-CD1 4.24Å; I446-L514 HydrophobicContact CG2-CD1 3.38Å; F496-L514 HydrophobicContact CD2-CD2 4Å; F496-L514 HydrophobicContact CE2-CB 4.27Å; F496-L514 HydrophobicContact CE2-CD2 3.95Å; R499-L514 HydrophobicContact CB-CD2 3.76Å; S510-L514 PolarHBondContact O-N 3.21Å; A511-L514 PolarHBondContact O-N 2.85Å; L514-Q516 PolarHBondContact O-N 3.01Å; L514-Q516 VanDerWaalsContact O-N 3.12Å; L514-H517 WeakPolarHBondContact O-CB 3.22Å; L514-H517 PolarHBondContact O-N 3.28Å; L514-L520 WeakPolarHBondContact O-CD1 3.44Å
515	L	98.6	Very high	98.1	Very high	55 Å²	55	64.7 Å²	64.7	29%	0.288	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-19.8	170.1	-78.2	173.3	0	0	0	114.1	L373 Q374 E377 A511 E513 L520	L373-L515 HydrophobicContact CB-CD2 3.55Å; L373-L515 HydrophobicContact CB-CG 3.88Å; Q374-L515 HydrophobicContact CG-CD2 3.87Å; E377-L515 HydrophobicContact CB-CD1 3.88Å; E377-L515 HydrophobicContact CG-CD1 4.13Å; A511-L515 WeakPolarHBondContact O-CG 3.37Å; A511-L515 PolarHBondContact O-N 3Å; E513-L515 VanDerWaalsContact C-N 3.32Å; E513-L515 PolarHBondContact O-N 2.98Å; L515-L520 HydrophobicContact CD2-CD1 4.38Å
516	Q	98.4	Very high	98.2	Very high	149 Å²	149	64.9 Å²	64.9	70%	0.696	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-1.1	177	-56.3	-176.8	12.4	0	0	112.9	E513 L514	E513-Q516 WeakPolarHBondContact O-CB 3.15Å; E513-Q516 PolarHBondContact O-N 3.43Å; L514-Q516 PolarHBondContact O-N 3.01Å; L514-Q516 VanDerWaalsContact O-N 3.12Å
517	H	98.7	Very high	98.3	Very high	17 Å²	17	62.4 Å²	62.4	8%	0.079	31%	0.314	C	S	.	.			trans	-67.9	145.7	-173.9	-163	-101.4	0	0	0	112.8	I492 D495 F496 R499 L514 F519 L520	I492-H517 PolarHBondContact O-CE1 3.29Å; D495-H517 IonicContact OD2-CE1 2.87Å; D495-H517 IonicContact OD2-NE2 3.58Å; D495-H517 PolarHBondContact OD2-NE2 2.88Å; F496-H517 HydrophobicContact CD2-CB 4.03Å; F496-H517 AromaticContact CD2-CG 3.88Å; F496-H517 AromaticContact CD2-ND1 3.62Å; F496-H517 PolarHBondContact N-CE1 3.35Å; R499-H517 VanDerWaalsContact CD-CD2 3.48Å; R499-H517 WeakPolarHBondContact CD-CD2 3.33Å; R499-H517 PolarHBondContact NE-CD2 3.39Å; R499-H517 PolarHBondContact NE-NE2 2.89Å; L514-H517 WeakPolarHBondContact O-CB 3.22Å; L514-H517 PolarHBondContact O-N 3.28Å; H517-F519 WeakPolarHBondContact ND1-CB 3.18Å; H517-F519 PolarHBondContact ND1-N 3.24Å; H517-F519 PolarHBondContact O-N 2.87Å; H517-L520 PolarHBondContact O-N 3.41Å; H517-L520 VanDerWaalsContact O-N 3.16Å
518	Q	98.3	Very high	98.4	Very high	112 Å²	112	57 Å²	57	52%	0.523	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-62.1	-29.8	-176.6	-57.7	-73.7	23	0	0	112.6	I492 L520 K521	I492-Q518 HydrophobicContact CG2-CB 3.9Å; Q518-L520 VanDerWaalsContact C-N 3.31Å; Q518-L520 PolarHBondContact O-N 3.25Å; Q518-K521 WeakPolarHBondContact O-CB 3.44Å; Q518-K521 PolarHBondContact O-N 3.16Å; Q518-K521 VanDerWaalsContact O-N 3.14Å
519	F	98.7	Very high	98.4	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-56.3	-41.8	175.8	-179.7	-121.9	0	0	0	112.5	E362 I365 A366 I492 F493 F496 H517 K521 I522	E362-F519 HydrophobicContact CB-CE2 4.14Å; I365-F519 HydrophobicContact CB-CZ 4.36Å; I365-F519 HydrophobicContact CG2-CZ 4.13Å; A366-F519 HydrophobicContact CB-CD1 3.98Å; A366-F519 HydrophobicContact CB-CD2 4.24Å; A366-F519 HydrophobicContact CB-CE1 3.65Å; A366-F519 HydrophobicContact CB-CE2 3.92Å; A366-F519 HydrophobicContact CB-CG 4.27Å; A366-F519 HydrophobicContact CB-CZ 3.61Å; A366-F519 WeakPolarHBondContact CB-O 3.41Å; I492-F519 HydrophobicContact CG2-CB 3.95Å; F493-F519 HydrophobicContact CB-CD2 3.72Å; F493-F519 HydrophobicContact CB-CE2 3.54Å; F493-F519 HydrophobicContact CB-CZ 4.3Å; F493-F519 AromaticContact CD1-CE2 3.96Å; F493-F519 HydrophobicContact CD1-CE2 3.96Å; F493-F519 HydrophobicContact CD1-CZ 4.11Å; F493-F519 HydrophobicContact CD2-CD1 4.09Å; F493-F519 AromaticContact CD2-CD2 3.91Å; F493-F519 HydrophobicContact CD2-CD2 3.91Å; F493-F519 AromaticContact CD2-CE1 3.59Å; F493-F519 HydrophobicContact CD2-CE1 3.59Å; F493-F519 AromaticContact CD2-CE2 3.38Å; F493-F519 HydrophobicContact CD2-CE2 3.38Å; F493-F519 HydrophobicContact CD2-CG 4.24Å; F493-F519 AromaticContact CD2-CZ 3.2Å; F493-F519 HydrophobicContact CD2-CZ 3.2Å; F493-F519 HydrophobicContact CE1-CZ 4.24Å; F493-F519 AromaticContact CE2-CE1 3.68Å; F493-F519 HydrophobicContact CE2-CE1 3.68Å; F493-F519 HydrophobicContact CE2-CE2 4.05Å; F493-F519 AromaticContact CE2-CZ 3.4Å; F493-F519 HydrophobicContact CE2-CZ 3.4Å; F493-F519 AromaticContact CG-CD2 3.96Å; F493-F519 HydrophobicContact CG-CD2 3.96Å; F493-F519 HydrophobicContact CG-CE1 4.41Å; F493-F519 AromaticContact CG-CE2 3.35Å; F493-F519 HydrophobicContact CG-CE2 3.35Å; F493-F519 AromaticContact CG-CZ 3.62Å; F493-F519 HydrophobicContact CG-CZ 3.62Å; F493-F519 AromaticContact CZ-CZ 3.93Å; F493-F519 HydrophobicContact CZ-CZ 3.93Å; F496-F519 HydrophobicContact CB-CB 3.85Å; F496-F519 HydrophobicContact CB-CD1 3.94Å; F496-F519 HydrophobicContact CB-CG 4.02Å; F496-F519 AromaticContact CD1-CD1 3.54Å; F496-F519 HydrophobicContact CD1-CD1 3.54Å; F496-F519 AromaticContact CD1-CE1 3.82Å; F496-F519 HydrophobicContact CD1-CE1 3.82Å; F496-F519 HydrophobicContact CD1-CG 4.44Å; F496-F519 HydrophobicContact CD2-CB 4.16Å; F496-F519 AromaticContact CD2-CD1 3.87Å; F496-F519 HydrophobicContact CD2-CD1 3.87Å; F496-F519 HydrophobicContact CD2-CG 4.46Å; F496-F519 AromaticContact CE1-CD1 3.94Å; F496-F519 HydrophobicContact CE1-CD1 3.94Å; F496-F519 HydrophobicContact CE1-CE1 4.04Å; F496-F519 HydrophobicContact CE2-CD1 4.23Å; F496-F519 HydrophobicContact CG-CB 4.08Å; F496-F519 AromaticContact CG-CD1 3.5Å; F496-F519 HydrophobicContact CG-CD1 3.5Å; F496-F519 HydrophobicContact CG-CE1 4.26Å; F496-F519 HydrophobicContact CG-CG 4.06Å; F496-F519 HydrophobicContact CZ-CD1 4.26Å; H517-F519 WeakPolarHBondContact ND1-CB 3.18Å; H517-F519 PolarHBondContact ND1-N 3.24Å; H517-F519 PolarHBondContact O-N 2.87Å; F519-K521 PolarHBondContact O-N 2.78Å; F519-I522 HydrophobicContact CD2-CD1 4.15Å; F519-I522 HydrophobicContact CD2-CG1 4.31Å; F519-I522 HydrophobicContact CE2-CD1 4.15Å; F519-I522 WeakPolarHBondContact O-CG1 3.46Å; F519-I522 PolarHBondContact O-N 2.99Å
520	L	98.4	Very high	98.4	Very high	13 Å²	13	58.4 Å²	58.4	7%	0.068	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-72.9	-1	-177.5	-52.1	-176.1	0	0	0	113.5	A366 C369 R370 L373 F496 L514 L515 H517 Q518 A523	A366-L520 HydrophobicContact CB-CD2 4.48Å; A366-L520 WeakPolarHBondContact O-CD2 3.43Å; C369-L520 HydrophobicContact CB-CD2 4.02Å; R370-L520 HydrophobicContact CB-CD1 4.34Å; R370-L520 HydrophobicContact CB-CD2 4.26Å; L373-L520 HydrophobicContact CD1-CD1 3.7Å; F496-L520 HydrophobicContact CE2-CD2 4Å; F496-L520 HydrophobicContact CE2-CG 4.3Å; F496-L520 HydrophobicContact CZ-CD2 4.2Å; L514-L520 WeakPolarHBondContact O-CD1 3.44Å; L515-L520 HydrophobicContact CD2-CD1 4.38Å; H517-L520 PolarHBondContact O-N 3.41Å; H517-L520 VanDerWaalsContact O-N 3.16Å; Q518-L520 VanDerWaalsContact C-N 3.31Å; Q518-L520 PolarHBondContact O-N 3.25Å; L520-A523 WeakPolarHBondContact O-CB 3.01Å
521	K	97.5	Very high	98.3	Very high	148 Å²	148	60.7 Å²	60.7	64%	0.643	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-88.1	-17.7	173.7	-59	-178.1	-176.3	170	0	113.7	Q518 F519 A523	Q518-K521 WeakPolarHBondContact O-CB 3.44Å; Q518-K521 PolarHBondContact O-N 3.16Å; Q518-K521 VanDerWaalsContact O-N 3.14Å; F519-K521 PolarHBondContact O-N 2.78Å; K521-A523 VanDerWaalsContact C-N 3.29Å
522	I	97.9	Very high	98.3	Very high	83 Å²	83	61.9 Å²	61.9	43%	0.426	32%	0.321	S	S	.	.	S	Bend	trans	-87.9	-1.7	169.1	62.3	157.1	0	0	0	112.4	E362 G363 A366 F519 K524	E362-I522 HydrophobicContact CB-CD1 3.74Å; G363-I522 WeakPolarHBondContact CA-O 3.48Å; A366-I522 HydrophobicContact CB-CG1 4.28Å; F519-I522 HydrophobicContact CD2-CD1 4.15Å; F519-I522 HydrophobicContact CD2-CG1 4.31Å; F519-I522 HydrophobicContact CE2-CD1 4.15Å; F519-I522 WeakPolarHBondContact O-CG1 3.46Å; F519-I522 PolarHBondContact O-N 2.99Å; I522-K524 PolarHBondContact O-N 3.12Å
523	A	98.5	Very high	98.3	Very high	18 Å²	18	56 Å²	56	15%	0.149	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-61	117.9	-178.8	0	0	0	0	0	112.5	G363 A366 A367 L520 K521	G363-A523 CarbonylContact O-C 3.59Å; G363-A523 WeakPolarHBondContact O-CA 3.39Å; A366-A523 VanDerWaalsContact C-CB 3.46Å; A366-A523 HydrophobicContact CB-CB 3.73Å; A366-A523 WeakPolarHBondContact O-CB 3.28Å; A367-A523 HydrophobicContact CB-CB 4.29Å; L520-A523 WeakPolarHBondContact O-CB 3.01Å; K521-A523 VanDerWaalsContact C-N 3.29Å
524	K	98.6	Very high	98.3	Very high	79 Å²	79	53.8 Å²	53.8	34%	0.343	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-70.5	166.2	-176.2	-75.1	173.5	174.7	175.5	0	112.8	D361 G363 Q364 A367 I522 S528	D361-K524 WeakPolarHBondContact OD1-CE 3.42Å; D361-K524 IonicContact OD1-NZ 3.13Å; D361-K524 PolarHBondContact OD1-NZ 3.23Å; D361-K524 IonicContact OD2-NZ 3.39Å; D361-K524 PolarHBondContact OD2-NZ 3.32Å; G363-K524 PolarHBondContact O-N 3.11Å; Q364-K524 HydrophobicContact CG-CD 4.29Å; A367-K524 WeakPolarHBondContact CB-O 3.36Å; I522-K524 PolarHBondContact O-N 3.12Å; K524-S528 VanDerWaalsContact CB-OG 3.29Å; K524-S528 WeakPolarHBondContact CB-OG 3.35Å
525	P	98.4	Very high	98.2	Very high	91 Å²	91	55.7 Å²	55.7	59%	0.591	30%	0.304	S	S	*	.	P	Polyproline II helix	trans	-57.7	142.6	164.6	-21.9	34	0	0	0	110.8	S527 S528	P525-S527 PolarHBondContact O-N 2.68Å; P525-S528 VanDerWaalsContact O-CB 3.31Å; P525-S528 WeakPolarHBondContact O-CB 3.38Å; P525-S528 PolarHBondContact O-N 2.96Å; P525-S528 PolarHBondContact O-OG 3.41Å
526	L	98.3	Very high	98	Very high	37 Å²	37	53.2 Å²	53.2	19%	0.194	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-61.1	-29.3	-176.1	-67.8	-175.9	0	0	0	113.6	A367 E371 G400 V402 S528 L529	A367-L526 HydrophobicContact CB-CD2 4.03Å; E371-L526 HydrophobicContact CG-CD1 4.07Å; E371-L526 HydrophobicContact CG-CD2 3.82Å; G400-L526 WeakPolarHBondContact CA-O 3.13Å; G400-L526 WeakPolarHBondContact O-CB 3.27Å; V402-L526 HydrophobicContact CG2-CD2 4.06Å; L526-S528 PolarHBondContact O-N 3.09Å; L526-L529 HydrophobicContact CD2-CD1 4.25Å; L526-L529 VanDerWaalsContact O-CB 3.3Å; L526-L529 WeakPolarHBondContact O-CB 3.28Å; L526-L529 WeakPolarHBondContact O-CG 3.41Å; L526-L529 PolarHBondContact O-N 3.09Å
527	S	98	Very high	97.8	Very high	80 Å²	80	49.3 Å²	49.3	56%	0.559	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-60.6	-10.9	172.2	54.3	0	0	0	0	114.8	P525 L529 T530	P525-S527 PolarHBondContact O-N 2.68Å; S527-L529 PolarHBondContact O-N 3.07Å; S527-T530 PolarHBondContact O-N 3.29Å
528	S	98.2	Very high	97.6	Very high	30 Å²	30	53.9 Å²	53.9	21%	0.21	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-74.3	-10.6	168.2	67.4	0	0	0	0	114.1	Q364 K524 P525 L526	Q364-S528 PolarHBondContact NE2-O 2.59Å; K524-S528 VanDerWaalsContact CB-OG 3.29Å; K524-S528 WeakPolarHBondContact CB-OG 3.35Å; P525-S528 VanDerWaalsContact O-CB 3.31Å; P525-S528 WeakPolarHBondContact O-CB 3.38Å; P525-S528 PolarHBondContact O-N 2.96Å; P525-S528 PolarHBondContact O-OG 3.41Å; L526-S528 PolarHBondContact O-N 3.09Å
529	L	98.4	Very high	97.3	Very high	4 Å²	4	49.7 Å²	49.7	2%	0.021	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-28.1	171.9	-58.5	175.4	0	0	0	112.1	M360 Q364 V368 V402 L526 S527 P531 L532 I533	M360-L529 HydrophobicContact CE-CD2 3.85Å; Q364-L529 HydrophobicContact CB-CD2 3.76Å; Q364-L529 HydrophobicContact CG-CD2 4.07Å; V368-L529 HydrophobicContact CG2-CD1 3.84Å; V368-L529 HydrophobicContact CG2-CD2 4.23Å; V402-L529 HydrophobicContact CG2-CD1 3.81Å; L526-L529 HydrophobicContact CD2-CD1 4.25Å; L526-L529 VanDerWaalsContact O-CB 3.3Å; L526-L529 WeakPolarHBondContact O-CB 3.28Å; L526-L529 WeakPolarHBondContact O-CG 3.41Å; L526-L529 PolarHBondContact O-N 3.09Å; S527-L529 PolarHBondContact O-N 3.07Å; L529-P531 VanDerWaalsContact C-CD 3.45Å; L529-P531 VanDerWaalsContact C-N 3.34Å; L529-L532 WeakPolarHBondContact O-CB 3.44Å; L529-L532 PolarHBondContact O-N 2.83Å; L529-I533 HydrophobicContact CB-CD1 4.06Å; L529-I533 WeakPolarHBondContact O-CG1 3.21Å; L529-I533 PolarHBondContact O-N 2.86Å
530	T	98.3	Very high	96.7	Very high	32 Å²	32	51.9 Å²	51.9	20%	0.196	30%	0.295	C	S	.	.	H	α-helix	trans	-50.4	-41.4	-178.6	-60.5	0	0	0	0	114.3	M398 S527 L532 I533 I534	M398-T530 VanDerWaalsContact O-CG2 3.25Å; M398-T530 WeakPolarHBondContact O-CG2 3.42Å; M398-T530 PolarHBondContact O-OG1 2.96Å; S527-T530 PolarHBondContact O-N 3.29Å; T530-L532 PolarHBondContact O-N 2.95Å; T530-I533 PolarHBondContact O-N 3.02Å; T530-I534 HydrophobicContact CG2-CD1 3.87Å; T530-I534 VanDerWaalsContact O-CG1 3.31Å; T530-I534 WeakPolarHBondContact O-CG1 3.45Å; T530-I534 PolarHBondContact O-N 3.36Å
531	P	98.2	Very high	95.9	Very high	81 Å²	81	58.2 Å²	58.2	53%	0.526	32%	0.322	S	S	.	.	H	α-helix	trans	-63.6	-37	175.7	-23	35.2	0	0	0	113.7	L529 I534 A535	L529-P531 VanDerWaalsContact C-CD 3.45Å; L529-P531 VanDerWaalsContact C-N 3.34Å; P531-I534 PolarHBondContact O-N 3.34Å; P531-A535 WeakPolarHBondContact O-CB 3.37Å; P531-A535 PolarHBondContact O-N 2.78Å
532	L	98.1	Very high	94.9	Very high	26 Å²	26	57.4 Å²	57.4	14%	0.136	33%	0.325	C	S	.	.	H	α-helix	trans	-71.1	-42.4	177.9	-54	-173.6	0	0	0	111	V354 T358 M360 L529 T530 I534 A535 A536	V354-L532 HydrophobicContact CG1-CB 3.91Å; V354-L532 HydrophobicContact CG1-CD1 4.18Å; T358-L532 HydrophobicContact CG2-CB 4.3Å; M360-L532 HydrophobicContact CG-CD1 3.79Å; L529-L532 WeakPolarHBondContact O-CB 3.44Å; L529-L532 PolarHBondContact O-N 2.83Å; T530-L532 PolarHBondContact O-N 2.95Å; L532-I534 VanDerWaalsContact C-N 3.27Å; L532-I534 PolarHBondContact O-N 3.32Å; L532-A535 PolarHBondContact O-N 3.06Å; L532-A536 WeakPolarHBondContact O-CB 3.19Å; L532-A536 PolarHBondContact O-N 2.86Å
533	I	97.9	Very high	93.3	Very high	1 Å²	1	59 Å²	59	1%	0.005	33%	0.334	C	S	.	.	H	α-helix	trans	-58.4	-39.6	174.8	-67.8	165.8	0	0	0	111.1	V354 L396 G397 M398 L529 T530 K537	V354-I533 HydrophobicContact CG2-CG1 4.08Å; L396-I533 HydrophobicContact CB-CD1 3.85Å; L396-I533 HydrophobicContact CB-CG1 4.31Å; L396-I533 HydrophobicContact CD1-CD1 4.02Å; L396-I533 HydrophobicContact CD1-CG1 3.81Å; L396-I533 HydrophobicContact CG-CD1 4.46Å; G397-I533 WeakPolarHBondContact O-CD1 3.29Å; M398-I533 HydrophobicContact CE-CG2 4.27Å; M398-I533 HydrophobicContact SD-CG2 3.98Å; L529-I533 HydrophobicContact CB-CD1 4.06Å; L529-I533 WeakPolarHBondContact O-CG1 3.21Å; L529-I533 PolarHBondContact O-N 2.86Å; T530-I533 PolarHBondContact O-N 3.02Å; I533-K537 HydrophobicContact CG2-CD 4.29Å; I533-K537 WeakPolarHBondContact O-CB 3.27Å; I533-K537 VanDerWaalsContact O-CG 3.24Å; I533-K537 WeakPolarHBondContact O-CG 3.43Å; I533-K537 PolarHBondContact O-N 3.29Å
534	I	97.5	Very high	90.9	Very high	71 Å²	71	68.5 Å²	68.5	36%	0.364	38%	0.375	S	S	.	.	H	α-helix	trans	-68.4	-48.9	175.3	-68.7	166	0	0	0	110.4	M398 T530 P531 L532 A536 K537 E538	M398-I534 HydrophobicContact CE-CG1 4.09Å; T530-I534 HydrophobicContact CG2-CD1 3.87Å; T530-I534 VanDerWaalsContact O-CG1 3.31Å; T530-I534 WeakPolarHBondContact O-CG1 3.45Å; T530-I534 PolarHBondContact O-N 3.36Å; P531-I534 PolarHBondContact O-N 3.34Å; L532-I534 VanDerWaalsContact C-N 3.27Å; L532-I534 PolarHBondContact O-N 3.32Å; I534-A536 PolarHBondContact O-N 3.26Å; I534-K537 CarbonylContact O-C 3.5Å; I534-K537 PolarHBondContact O-N 2.89Å; I534-E538 HydrophobicContact CG2-CG 4.48Å; I534-E538 WeakPolarHBondContact O-CG 3.28Å; I534-E538 PolarHBondContact O-N 3.24Å
535	A	96.8	Very high	90.5	Very high	43 Å²	43	68 Å²	68	36%	0.355	38%	0.377	S	S	.	.	H	α-helix	trans	-59.6	-47.3	-179.4	0	0	0	0	0	112.8	T358 P531 L532 K537 E538 A539	T358-A535 HydrophobicContact CG2-CB 4.04Å; P531-A535 WeakPolarHBondContact O-CB 3.37Å; P531-A535 PolarHBondContact O-N 2.78Å; L532-A535 PolarHBondContact O-N 3.06Å; A535-K537 VanDerWaalsContact C-N 3.32Å; A535-K537 PolarHBondContact O-N 3.1Å; A535-E538 PolarHBondContact O-N 3.46Å; A535-E538 VanDerWaalsContact O-N 3.11Å; A535-A539 PolarHBondContact O-N 2.73Å
536	A	95.9	Very high	90.1	Very high	2 Å²	2	66.7 Å²	66.7	2%	0.017	37%	0.366	C	S	.	.	H	α-helix	trans	-56	-45.5	174.5	0	0	0	0	0	112.2	D353 V354 E357 T358 L532 I534 E538 A539 A540	D353-A536 HydrophobicContact CB-CB 4.41Å; D353-A536 WeakPolarHBondContact O-CB 3.4Å; V354-A536 HydrophobicContact CG2-CB 4.17Å; E357-A536 HydrophobicContact CB-CB 4.24Å; E357-A536 HydrophobicContact CG-CB 4.5Å; T358-A536 HydrophobicContact CG2-CB 4.41Å; L532-A536 WeakPolarHBondContact O-CB 3.19Å; L532-A536 PolarHBondContact O-N 2.86Å; I534-A536 PolarHBondContact O-N 3.26Å; A536-E538 VanDerWaalsContact C-N 3.28Å; A536-E538 PolarHBondContact O-N 2.83Å; A536-A539 PolarHBondContact O-N 3.01Å; A536-A540 WeakPolarHBondContact O-CB 3.32Å; A536-A540 PolarHBondContact O-N 3.04Å
537	K	93.6	Very high	89.6	Confident	68 Å²	68	68.4 Å²	68.4	30%	0.296	38%	0.375	S	S	.	.	H	α-helix	trans	-74.1	-13.8	178.5	-71.2	-177.1	64.2	178.5	0	114.6	A347 M398 I533 I534 A535 K541	A347-K537 PolarHBondContact O-NZ 3.19Å; M398-K537 HydrophobicContact SD-CD 4.41Å; I533-K537 HydrophobicContact CG2-CD 4.29Å; I533-K537 WeakPolarHBondContact O-CB 3.27Å; I533-K537 VanDerWaalsContact O-CG 3.24Å; I533-K537 WeakPolarHBondContact O-CG 3.43Å; I533-K537 PolarHBondContact O-N 3.29Å; I534-K537 CarbonylContact O-C 3.5Å; I534-K537 PolarHBondContact O-N 2.89Å; A535-K537 VanDerWaalsContact C-N 3.32Å; A535-K537 PolarHBondContact O-N 3.1Å; K537-K541 WeakPolarHBondContact O-CD 3.22Å; K537-K541 VanDerWaalsContact O-CG 3.26Å; K537-K541 WeakPolarHBondContact O-CG 3.39Å
538	E	94.2	Very high	89.2	Confident	112 Å²	112	67.7 Å²	67.7	52%	0.523	36%	0.364	S	S	.	.	H	α-helix	trans	-86.2	-42.1	169	-74	177.8	178.2	0	0	110.6	I534 A535 A536 K541 N542	I534-E538 HydrophobicContact CG2-CG 4.48Å; I534-E538 WeakPolarHBondContact O-CG 3.28Å; I534-E538 PolarHBondContact O-N 3.24Å; A535-E538 PolarHBondContact O-N 3.46Å; A535-E538 VanDerWaalsContact O-N 3.11Å; A536-E538 VanDerWaalsContact C-N 3.28Å; A536-E538 PolarHBondContact O-N 2.83Å; E538-K541 PolarHBondContact O-N 3.02Å; E538-N542 VanDerWaalsContact O-CG 3.27Å; E538-N542 PolarHBondContact O-N 2.97Å; E538-N542 VanDerWaalsContact O-N 3.1Å; E538-N542 PolarHBondContact O-ND2 3.44Å; E538-N542 VanDerWaalsContact O-ND2 3.12Å
539	A	92.3	Very high	88.6	Confident	25 Å²	25	70.1 Å²	70.1	21%	0.207	37%	0.374	C	S	.	.	H	α-helix	trans	-58.7	-50.3	172.7	0	0	0	0	0	112	E357 A535 A536 K541 N542 N543	E357-A539 HydrophobicContact CB-CB 4.12Å; E357-A539 HydrophobicContact CG-CB 3.98Å; E357-A539 WeakPolarHBondContact OE2-CB 3.49Å; A535-A539 PolarHBondContact O-N 2.73Å; A536-A539 PolarHBondContact O-N 3.01Å; A539-K541 PolarHBondContact O-N 2.9Å; A539-K541 VanDerWaalsContact O-N 3.11Å; A539-N542 PolarHBondContact O-N 2.75Å; A539-N543 PolarHBondContact O-N 2.62Å; A539-N543 VanDerWaalsContact O-N 3.14Å; A539-N543 PolarHBondContact O-ND2 3.48Å
540	A	85.2	Confident	87.9	Confident	45 Å²	45	74.5 Å²	74.5	37%	0.372	40%	0.397	S	S	.	.	H	α-helix	trans	-59.1	-24.9	176.9	0	0	0	0	0	114	A536	A536-A540 WeakPolarHBondContact O-CB 3.32Å; A536-A540 PolarHBondContact O-N 3.04Å
541	K	83.3	Confident	87.2	Confident	147 Å²	147	77.5 Å²	77.5	64%	0.639	41%	0.412	S	S	*	.	H	α-helix	trans	-84.1	-26.6	174	-76.9	175	-176.8	175.6	0	114	K537 E538 A539 N543	K537-K541 WeakPolarHBondContact O-CD 3.22Å; K537-K541 VanDerWaalsContact O-CG 3.26Å; K537-K541 WeakPolarHBondContact O-CG 3.39Å; E538-K541 PolarHBondContact O-N 3.02Å; A539-K541 PolarHBondContact O-N 2.9Å; A539-K541 VanDerWaalsContact O-N 3.11Å; K541-N543 VanDerWaalsContact C-N 3.33Å
542	N	76.3	Confident	86.4	Confident	130 Å²	130	77.2 Å²	77.2	70%	0.695	40%	0.403	S	S	*	.	H	α-helix	trans	-83.3	-16.3	178.4	-65.4	-32.6	0	0	0	112.1	E538 A539 H544	E538-N542 VanDerWaalsContact O-CG 3.27Å; E538-N542 PolarHBondContact O-N 2.97Å; E538-N542 VanDerWaalsContact O-N 3.1Å; E538-N542 PolarHBondContact O-ND2 3.44Å; E538-N542 VanDerWaalsContact O-ND2 3.12Å; A539-N542 PolarHBondContact O-N 2.75Å; N542-H544 VanDerWaalsContact C-N 3.31Å
543	N	62.8	Low	85.4	Confident	116 Å²	116	81.5 Å²	81.5	62%	0.62	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	12.5	175.3	-66.1	-21.7	0	0	0	113.1	A539 K541	A539-N543 PolarHBondContact O-N 2.62Å; A539-N543 VanDerWaalsContact O-N 3.14Å; A539-N543 PolarHBondContact O-ND2 3.48Å; K541-N543 VanDerWaalsContact C-N 3.33Å
544	H	48.8	Very low	84.2	Confident	218 Å²	218	88.8 Å²	88.8	100%	1.009	46%	0.463	S	S	*	.			trans	-138	0	-176.8	-79.2	3.8	0	0	0	112	N542	N542-H544 VanDerWaalsContact C-N 3.31Å

Retrieved 544 of 544 residues in 844.8 ms (Link to these results)

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